info:bmrb/17946
type: datablock
references: doi:10.13018/BMR17946
alternative label: bmr17946
title: Aliphatic 1H, 13C, and 15N chemical shift assignments of dihydrofolate reductase from the psychropiezophile Moritella profunda in complex with NADP+ and folate
datablock name: 17946
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17946,1
type: assembly
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assembly.id: 1
assembly.details: DHFR from Moritella profunda in complex with NADP+ and folate
assembly.enzyme commission number: 1.5.1.3
assembly.name: Dihydrofolate reductase from Moritella profunda
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info:ec-code/1.5.1.3

ec-code:1.5.1.3

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atom chem shift.val: 9.84
atom chem shift.val err: 0.01

1,17946,33
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 33
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 4.38
atom chem shift.val err: 0.01

1,17946,34
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 34
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 2.37
atom chem shift.val err: 0.01

1,17946,35
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 35
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,36
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 36
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,37
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 37
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,38
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 38
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 0.98
atom chem shift.val err: 0.00

1,17946,39
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 39
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 0.98
atom chem shift.val err: 0.00

1,17946,40
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 40
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 0.98
atom chem shift.val err: 0.00

1,17946,41
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 41
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 174.80
atom chem shift.val err: 0.05

1,17946,42
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 42
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 62.96
atom chem shift.val err: 0.08

1,17946,43
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 43
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 31.81
atom chem shift.val err: 0.10

1,17946,44
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 44
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 21.27
atom chem shift.val err: 0.05

1,17946,45
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 45
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 21.26
atom chem shift.val err: 0.38

1,17946,46
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 46
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 3
atom chem shift.comp id: VAL
atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 129.07
atom chem shift.val err: 0.08

1,17946,47
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 47
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 9.02
atom chem shift.val err: 0.01

1,17946,48
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 48
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 6.03
atom chem shift.val err: 0.01

1,17946,49
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 49
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 3.77
atom chem shift.val err: 0.01

1,17946,50
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 50
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 4.35
atom chem shift.val err: 0.01

1,17946,51
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 51
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 174.32
atom chem shift.val err: 0.03

1,17946,52
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 52
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 56.47
atom chem shift.val err: 0.14

1,17946,53
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 53
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 65.95
atom chem shift.val err: 0.26

1,17946,54
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 54
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 4
atom chem shift.comp id: SER
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 126.58
atom chem shift.val err: 0.07

1,17946,55
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 55
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 8.63
atom chem shift.val err: 0.01

1,17946,56
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 56
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 6.02
atom chem shift.val err: 0.01

1,17946,57
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 57
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.32
atom chem shift.val err: 0.01

1,17946,58
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 58
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.76
atom chem shift.val err: 0.01

1,17946,59
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 59
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE*
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.03
atom chem shift.val err: 0.01

1,17946,60
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 60
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE*
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.03
atom chem shift.val err: 0.01

1,17946,61
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 61
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE*
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.03
atom chem shift.val err: 0.01

1,17946,62
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 62
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 173.07
atom chem shift.val err: 0.02

1,17946,63
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 63
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 53.44
atom chem shift.val err: 0.23

1,17946,64
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 64
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 35.41
atom chem shift.val err: 0.01

1,17946,65
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 65
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 29.78
atom chem shift.val err: 0.29

1,17946,66
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 66
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 15.82
atom chem shift.val err: 0.07

1,17946,67
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 67
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 5
atom chem shift.comp id: MET
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 117.19
atom chem shift.val err: 0.10

1,17946,68
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 68
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 6
atom chem shift.comp id: ILE
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 9.02
atom chem shift.val err: 0.01

1,17946,69
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.83
atom chem shift.val err: 0.02

1,17946,70
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.27
atom chem shift.val err: 0.02

1,17946,71
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.27
atom chem shift.val err: 0.03

1,17946,72
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.05

1,17946,73
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,74
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,75
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.val err: 0.02

1,17946,76
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.66
atom chem shift.val err: 0.01

1,17946,77
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,78
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,79
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,80
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,81
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,82
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,83
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,84
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,85
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,86
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,87
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,88
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,89
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,90
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,91
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,92
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,93
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,94
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,95
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,96
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,97
type: atom chem shift
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1,17946,98
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,99
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,100
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,101
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,102
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,103
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,104
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,105
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.seq id: 9
atom chem shift.val: 4.77
atom chem shift.val err: 0.01

1,17946,106
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.32
atom chem shift.val err: 0.01

1,17946,107
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.72
atom chem shift.val err: 0.01

1,17946,108
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,109
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.14
atom chem shift.val err: 0.01

1,17946,110
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,111
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.14
atom chem shift.val err: 0.01

1,17946,112
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.45
atom chem shift.val err: 0.01

1,17946,113
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.45
atom chem shift.val err: 0.01

1,17946,114
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.45
atom chem shift.val err: 0.01

1,17946,115
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 176.58
atom chem shift.val err: 0.03

1,17946,116
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 54.07
atom chem shift.val err: 0.05

1,17946,117
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,118
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 29.31
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1,17946,119
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 25.19
atom chem shift.val err: 0.11

1,17946,120
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.09

1,17946,121
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.05

1,17946,122
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,123
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,124
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,125
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,126
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,127
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,128
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,129
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,130
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,131
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,132
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,133
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,134
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,135
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,136
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.val err: 0.00

1,17946,137
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.val err: 0.01

1,17946,138
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,139
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,140
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,141
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 141
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 11
atom chem shift.comp id: ASN
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 113.84
atom chem shift.val err: 0.05

1,17946,142
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 142
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 11
atom chem shift.comp id: ASN
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 111.11
atom chem shift.val err: 0.21

1,17946,143
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 143
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 9.33
atom chem shift.val err: 0.01

1,17946,144
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 144
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 4.45
atom chem shift.val err: 0.01

1,17946,145
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 145
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 3.13
atom chem shift.val err: 0.01

1,17946,146
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 146
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 3.23
atom chem shift.val err: 0.01

1,17946,147
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 147
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 7.12
atom chem shift.val err: 0.01

1,17946,148
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 148
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 7.74
atom chem shift.val err: 0.01

1,17946,149
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 149
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 173.80
atom chem shift.val err: 0.05

1,17946,150
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 150
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 54.85
atom chem shift.val err: 0.18

1,17946,151
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 151
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 37.62
atom chem shift.val err: 0.10

1,17946,152
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 152
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 178.55
atom chem shift.val err: 0.02

1,17946,153
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 153
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 116.94
atom chem shift.val err: 0.09

1,17946,154
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 154
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 12
atom chem shift.comp id: ASN
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 114.37
atom chem shift.val err: 0.21

1,17946,155
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 155
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 8.73
atom chem shift.val err: 0.01

1,17946,156
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 156
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 3.83
atom chem shift.val err: 0.01

1,17946,157
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 157
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 175.53
atom chem shift.val err: 0.05

1,17946,158
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 158
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 57.95
atom chem shift.val err: 0.10

1,17946,159
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 159
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 28.26
atom chem shift.val err: 0.19

1,17946,160
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 160
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 28.64
atom chem shift.val err: 0.00

1,17946,161
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 161
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 43.99
atom chem shift.val err: 0.00

1,17946,162
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 162
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 13
atom chem shift.comp id: ARG
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 108.17
atom chem shift.val err: 0.04

1,17946,163
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 163
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 7.17
atom chem shift.val err: 0.00

1,17946,164
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 164
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 3.71
atom chem shift.val err: 0.01

1,17946,165
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 165
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 2.00
atom chem shift.val err: 0.01

1,17946,166
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 166
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 0.95
atom chem shift.val err: 0.01

1,17946,167
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 167
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 0.95
atom chem shift.val err: 0.01

1,17946,168
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 168
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 0.95
atom chem shift.val err: 0.01

1,17946,169
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 169
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.41
atom chem shift.val err: 0.01

1,17946,170
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 170
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.41
atom chem shift.val err: 0.01

1,17946,171
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 171
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.41
atom chem shift.val err: 0.01

1,17946,172
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 172
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 176.93
atom chem shift.val err: 0.00

1,17946,173
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 173
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 65.91
atom chem shift.val err: 0.24

1,17946,174
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 174
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 33.05
atom chem shift.val err: 0.25

1,17946,175
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 175
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 21.84
atom chem shift.val err: 0.12

1,17946,176
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 176
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 23.65
atom chem shift.val err: 0.16

1,17946,177
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.atom id: N
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atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 120.80
atom chem shift.val err: 0.07

1,17946,178
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ILE
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 5.35
atom chem shift.val err: 0.02

1,17946,179
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ILE
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.02
atom chem shift.val err: 0.00

1,17946,180
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.79
atom chem shift.val err: 0.01

1,17946,181
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.00

1,17946,182
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,183
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,184
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,185
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.48
atom chem shift.val err: 0.02

1,17946,186
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.48
atom chem shift.val err: 0.02

1,17946,187
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.48
atom chem shift.val err: 0.02

1,17946,188
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 176.37
atom chem shift.val err: 0.00

1,17946,189
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,190
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 42.67
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1,17946,191
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 26.77
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1,17946,192
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,193
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 15.14
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1,17946,194
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,195
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,196
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,197
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,198
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,199
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,200
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,201
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,202
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,203
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,204
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,205
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,206
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,207
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,208
type: atom chem shift
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1,17946,209
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,210
type: atom chem shift
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1,17946,211
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1,17946,212
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1,17946,213
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 213
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 17
atom chem shift.comp id: LEU
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 17
atom chem shift.val: 120.40
atom chem shift.val err: 0.10

1,17946,214
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 214
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 10.48
atom chem shift.val err: 0.01

1,17946,215
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 215
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 4.22
atom chem shift.val err: 0.01

1,17946,216
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 216
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 2.36
atom chem shift.val err: 0.00

1,17946,217
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 217
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 2.84
atom chem shift.val err: 0.01

1,17946,218
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 218
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 174.95
atom chem shift.val err: 0.01

1,17946,219
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 219
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 55.74
atom chem shift.val err: 0.19

1,17946,220
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 220
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 39.07
atom chem shift.val err: 0.13

1,17946,221
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 221
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 18
atom chem shift.comp id: ASP
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 131.88
atom chem shift.val err: 0.11

1,17946,222
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 222
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 9.54
atom chem shift.val err: 0.01

1,17946,223
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 223
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 4.19
atom chem shift.val err: 0.01

1,17946,224
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 224
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 2.46
atom chem shift.val err: 0.01

1,17946,225
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 225
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,226
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 226
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ASN
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 6.66
atom chem shift.val err: 0.01

1,17946,227
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 227
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
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atom chem shift.auth comp id: ASN
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 7.43
atom chem shift.val err: 0.01

1,17946,228
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 228
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 173.99
atom chem shift.val err: 0.03

1,17946,229
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 229
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 54.63
atom chem shift.val err: 0.27

1,17946,230
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 230
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 39.43
atom chem shift.val err: 0.08

1,17946,231
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 231
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 178.43
atom chem shift.val err: 0.03

1,17946,232
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 232
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 113.39
atom chem shift.val err: 0.06

1,17946,233
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 233
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 19
atom chem shift.comp id: ASN
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 109.88
atom chem shift.val err: 0.18

1,17946,234
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 234
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 7.63
atom chem shift.val err: 0.01

1,17946,235
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 235
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 4.43
atom chem shift.val err: 0.01

1,17946,236
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 236
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 1.60
atom chem shift.val err: 0.02

1,17946,237
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 237
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 1.76
atom chem shift.val err: 0.01

1,17946,238
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 238
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 1.37
atom chem shift.val err: 0.02

1,17946,239
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 239
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 1.37
atom chem shift.val err: 0.02

1,17946,240
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 240
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 1.60
atom chem shift.val err: 0.01

1,17946,241
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 1.60
atom chem shift.val err: 0.01

1,17946,242
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 2.95
atom chem shift.val err: 0.01

1,17946,243
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 243
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.95
atom chem shift.val err: 0.01

1,17946,244
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 175.97
atom chem shift.val err: 0.01

1,17946,245
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 245
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 54.27
atom chem shift.val err: 0.10

1,17946,246
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 35.67
atom chem shift.val err: 0.21

1,17946,247
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 24.57
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1,17946,248
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 28.99
atom chem shift.val err: 0.06

1,17946,249
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 42.17
atom chem shift.val err: 0.00

1,17946,250
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 250
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 117.47
atom chem shift.val err: 0.04

1,17946,251
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 251
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atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 8.45
atom chem shift.val err: 0.01

1,17946,252
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: MET
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 4.41
atom chem shift.val err: 0.01

1,17946,253
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.09
atom chem shift.val err: 0.02

1,17946,254
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.26
atom chem shift.val err: 0.00

1,17946,255
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: MET
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.81
atom chem shift.val err: 0.01

1,17946,256
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.81
atom chem shift.val err: 0.01

1,17946,257
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.81
atom chem shift.val err: 0.01

1,17946,258
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 175.91
atom chem shift.val err: 0.00

1,17946,259
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.val: 52.10
atom chem shift.val err: 0.05

1,17946,260
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 31.78
atom chem shift.val err: 0.33

1,17946,261
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 17.07
atom chem shift.val err: 0.04

1,17946,262
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: MET
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.val: 120.95
atom chem shift.val err: 0.05

1,17946,263
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.51
atom chem shift.val err: 0.01

1,17946,264
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.04
atom chem shift.val err: 0.02

1,17946,265
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.38
atom chem shift.val err: 0.02

1,17946,266
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.58
atom chem shift.val err: 0.03

1,17946,267
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.64
atom chem shift.val err: 0.03

1,17946,268
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.27
atom chem shift.val err: 0.02

1,17946,269
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,270
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.00

1,17946,271
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,272
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,273
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,274
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,275
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,276
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,277
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,278
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,279
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,280
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,281
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,282
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,283
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of datablock: info:bmrb/17946
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1,17946,284
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of datablock: info:bmrb/17946
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1,17946,285
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of datablock: info:bmrb/17946
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atom chem shift.comp id: HIS
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 4.82
atom chem shift.val err: 0.01

1,17946,286
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 286
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atom chem shift.comp id: HIS
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 2.93
atom chem shift.val err: 0.01

1,17946,287
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 287
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: HIS
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 24
atom chem shift.val: 3.17
atom chem shift.val err: 0.01

1,17946,288
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 288
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atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 24
atom chem shift.val: 173.02
atom chem shift.val err: 0.00

1,17946,289
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
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atom chem shift.val: 56.72
atom chem shift.val err: 0.16

1,17946,290
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 290
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 30.90
atom chem shift.val err: 0.19

1,17946,291
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: HIS
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 24
atom chem shift.val: 118.04
atom chem shift.val err: 0.10

1,17946,292
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 292
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atom chem shift.comp id: LEU
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 9.33
atom chem shift.val err: 0.01

1,17946,293
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LEU
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 5.06
atom chem shift.val err: 0.01

1,17946,294
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 294
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 1.32
atom chem shift.val err: 0.01

1,17946,295
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.63
atom chem shift.val err: 0.03

1,17946,296
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 296
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atom chem shift.val: 0.47
atom chem shift.val err: 0.01

1,17946,297
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.47
atom chem shift.val err: 0.01

1,17946,298
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.47
atom chem shift.val err: 0.01

1,17946,299
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.04
atom chem shift.val err: 0.01

1,17946,300
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.04
atom chem shift.val err: 0.01

1,17946,301
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,302
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 179.46
atom chem shift.val err: 0.00

1,17946,303
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,304
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,305
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,306
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 24.82
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1,17946,307
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: LEU
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atom chem shift.val: 127.55
atom chem shift.val err: 0.15

1,17946,308
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,309
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,310
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,311
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,312
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,313
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,314
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,315
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,316
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,317
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,318
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,319
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,320
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,321
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 4.04
atom chem shift.val err: 0.01

1,17946,322
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 1.28
atom chem shift.val err: 0.01

1,17946,323
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 1.28
atom chem shift.val err: 0.01

1,17946,324
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.28
atom chem shift.val err: 0.01

1,17946,325
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 180.41
atom chem shift.val err: 0.01

1,17946,326
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 54.87
atom chem shift.val err: 0.12

1,17946,327
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 17.99
atom chem shift.val err: 0.16

1,17946,328
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 120.63
atom chem shift.val err: 0.04

1,17946,329
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.28
atom chem shift.val err: 0.01

1,17946,330
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.55
atom chem shift.val err: 0.00

1,17946,331
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.38
atom chem shift.val err: 0.00

1,17946,332
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,333
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.66
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1,17946,334
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,335
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,336
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,337
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,338
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,339
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of datablock: info:bmrb/17946
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1,17946,340
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,341
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,342
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,343
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,344
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,345
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,346
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,347
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of datablock: info:bmrb/17946
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1,17946,348
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of datablock: info:bmrb/17946
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1,17946,349
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,350
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1,17946,351
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,352
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,353
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,354
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,355
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,356
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,357
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atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 29
atom chem shift.comp id: LEU
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 117.73
atom chem shift.val err: 0.13

1,17946,358
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 358
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.16
atom chem shift.val err: 0.01

1,17946,359
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 359
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 3.89
atom chem shift.val err: 0.01

1,17946,360
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 360
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 2.09
atom chem shift.val err: 0.02

1,17946,361
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 361
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 2.09
atom chem shift.val err: 0.02

1,17946,362
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 362
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 2.40
atom chem shift.val err: 0.01

1,17946,363
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 363
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 2.40
atom chem shift.val err: 0.01

1,17946,364
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 364
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.03
atom chem shift.val err: 0.00

1,17946,365
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 365
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.81
atom chem shift.val err: 0.01

1,17946,366
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 366
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 178.85
atom chem shift.val err: 0.01

1,17946,367
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 367
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 57.98
atom chem shift.val err: 0.13

1,17946,368
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 368
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 27.48
atom chem shift.val err: 0.17

1,17946,369
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 369
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 33.34
atom chem shift.val err: 0.20

1,17946,370
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 370
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 179.70
atom chem shift.val err: 0.03

1,17946,371
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 371
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 115.25
atom chem shift.val err: 0.08

1,17946,372
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 372
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 30
atom chem shift.comp id: GLN
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 114.58
atom chem shift.val err: 0.15

1,17946,373
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 373
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 7.43
atom chem shift.val err: 0.01

1,17946,374
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 374
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 3.84
atom chem shift.val err: 0.01

1,17946,375
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 375
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 1.55
atom chem shift.val err: 0.01

1,17946,376
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 376
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 1.96
atom chem shift.val err: 0.01

1,17946,377
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 377
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
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atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 1.54
atom chem shift.val err: 0.01

1,17946,378
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 378
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
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atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 0.57
atom chem shift.val err: 0.01

1,17946,379
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 379
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 31
atom chem shift.val: 0.57
atom chem shift.val err: 0.01

1,17946,380
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 380
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
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atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 0.57
atom chem shift.val err: 0.01

1,17946,381
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 381
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 0.74
atom chem shift.val err: 0.01

1,17946,382
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 382
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 0.74
atom chem shift.val err: 0.01

1,17946,383
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 383
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 0.74
atom chem shift.val err: 0.01

1,17946,384
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 384
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: LEU
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 179.73
atom chem shift.val err: 0.03

1,17946,385
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 385
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 58.46
atom chem shift.val err: 0.26

1,17946,386
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 386
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 31
atom chem shift.val: 40.37
atom chem shift.val err: 0.12

1,17946,387
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 387
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 26.82
atom chem shift.val err: 0.15

1,17946,388
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 388
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 21.97
atom chem shift.val err: 0.16

1,17946,389
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 389
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 31
atom chem shift.val: 25.83
atom chem shift.val err: 0.27

1,17946,390
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 390
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 31
atom chem shift.comp id: LEU
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
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atom chem shift.val: 123.39
atom chem shift.val err: 0.10

1,17946,391
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 391
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atom chem shift.comp id: PHE
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.55
atom chem shift.val err: 0.01

1,17946,392
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 392
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 3.85
atom chem shift.val err: 0.01

1,17946,393
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 393
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 32
atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 2.65
atom chem shift.val err: 0.01

1,17946,394
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 394
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 32
atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 3.18
atom chem shift.val err: 0.01

1,17946,395
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 395
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 32
atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 178.13
atom chem shift.val err: 0.00

1,17946,396
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 396
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 32
atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 61.18
atom chem shift.val err: 0.07

1,17946,397
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 397
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 32
atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 37.66
atom chem shift.val err: 0.11

1,17946,398
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 398
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 32
atom chem shift.comp id: PHE
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 121.56
atom chem shift.val err: 0.11

1,17946,399
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 399
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
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atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 8.54
atom chem shift.val err: 0.01

1,17946,400
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 400
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 3.45
atom chem shift.val err: 0.01

1,17946,401
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 401
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 1.84
atom chem shift.val err: 0.01

1,17946,402
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 402
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 1.84
atom chem shift.val err: 0.01

1,17946,403
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 403
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 1.69
atom chem shift.val err: 0.01

1,17946,404
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 404
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
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atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 1.69
atom chem shift.val err: 0.01

1,17946,405
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 405
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 177.51
atom chem shift.val err: 0.02

1,17946,406
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 406
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 60.23
atom chem shift.val err: 0.05

1,17946,407
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 407
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 33.06
atom chem shift.val err: 0.08

1,17946,408
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 408
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 25.33
atom chem shift.val err: 0.00

1,17946,409
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 409
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 33
atom chem shift.val: 30.31
atom chem shift.val err: 0.12

1,17946,410
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 410
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 124.32
atom chem shift.val err: 0.06

1,17946,411
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 411
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 7.96
atom chem shift.val err: 0.01

1,17946,412
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 412
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 3.85
atom chem shift.val err: 0.01

1,17946,413
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 413
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.82
atom chem shift.val err: 0.02

1,17946,414
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 414
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 34
atom chem shift.val: 1.83
atom chem shift.val err: 0.01

1,17946,415
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 415
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.54
atom chem shift.val err: 0.01

1,17946,416
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 416
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.54
atom chem shift.val err: 0.01

1,17946,417
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 417
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,418
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 418
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,419
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 419
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 34
atom chem shift.val: 178.59
atom chem shift.val err: 0.02

1,17946,420
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
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atom chem shift.val: 59.28
atom chem shift.val err: 0.11

1,17946,421
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 30.10
atom chem shift.val err: 0.09

1,17946,422
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 422
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 27.15
atom chem shift.val err: 0.11

1,17946,423
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 423
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 43.64
atom chem shift.val err: 0.21

1,17946,424
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 424
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
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atom chem shift.val: 117.94
atom chem shift.val err: 0.06

1,17946,425
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 35
atom chem shift.val: 7.57
atom chem shift.val err: 0.01

1,17946,426
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.10
atom chem shift.val err: 0.01

1,17946,427
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.08
atom chem shift.val err: 0.00

1,17946,428
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.08
atom chem shift.val err: 0.00

1,17946,429
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 429
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 35
atom chem shift.comp id: ALA
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 1.08
atom chem shift.val err: 0.00

1,17946,430
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 430
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 35
atom chem shift.comp id: ALA
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 177.32
atom chem shift.val err: 0.01

1,17946,431
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 431
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 35
atom chem shift.comp id: ALA
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 53.65
atom chem shift.val err: 0.18

1,17946,432
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 432
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 35
atom chem shift.comp id: ALA
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 19.50
atom chem shift.val err: 0.28

1,17946,433
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 433
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 35
atom chem shift.comp id: ALA
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 118.49
atom chem shift.val err: 0.08

1,17946,434
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 434
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 7.12
atom chem shift.val err: 0.01

1,17946,435
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 435
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 3.95
atom chem shift.val err: 0.01

1,17946,436
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 436
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HB
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 3.55
atom chem shift.val err: 0.01

1,17946,437
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 437
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
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atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 0.31
atom chem shift.val err: 0.01

1,17946,438
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 438
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 0.31
atom chem shift.val err: 0.01

1,17946,439
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 439
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 0.31
atom chem shift.val err: 0.01

1,17946,440
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 36
atom chem shift.val: 174.57
atom chem shift.val err: 0.01

1,17946,441
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 36
atom chem shift.val: 61.79
atom chem shift.val err: 0.08

1,17946,442
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 442
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 71.26
atom chem shift.val err: 0.21

1,17946,443
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 443
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 21.40
atom chem shift.val err: 0.12

1,17946,444
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 444
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 36
atom chem shift.comp id: THR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 36
atom chem shift.val: 102.83
atom chem shift.val err: 0.06

1,17946,445
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 7.98
atom chem shift.val err: 0.01

1,17946,446
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 3.50
atom chem shift.val err: 0.01

1,17946,447
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 447
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 1.57
atom chem shift.val err: 0.02

1,17946,448
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 448
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.60
atom chem shift.val err: 0.01

1,17946,449
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 1.30
atom chem shift.val err: 0.01

1,17946,450
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 450
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,451
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 451
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,452
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 452
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,453
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,454
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 454
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,455
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 455
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.84
atom chem shift.val err: 0.01

1,17946,456
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.auth comp id: LEU
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 177.68
atom chem shift.val err: 0.01

1,17946,457
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 457
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 57.76
atom chem shift.val err: 0.12

1,17946,458
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 458
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 41.85
atom chem shift.val err: 0.11

1,17946,459
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 459
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 24.40
atom chem shift.val err: 0.24

1,17946,460
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 460
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 24.22
atom chem shift.val err: 0.23

1,17946,461
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 461
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
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atom chem shift.seq id: 37
atom chem shift.val: 24.22
atom chem shift.val err: 0.23

1,17946,462
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 462
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 37
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.val: 122.95
atom chem shift.val err: 0.04

1,17946,463
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: GLY
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atom chem shift.val: 7.68
atom chem shift.val err: 0.01

1,17946,464
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 3.78
atom chem shift.val err: 0.00

1,17946,465
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 465
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 4.19
atom chem shift.val err: 0.01

1,17946,466
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 466
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 173.24
atom chem shift.val err: 0.05

1,17946,467
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 467
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 45.47
atom chem shift.val err: 0.06

1,17946,468
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 468
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 38
atom chem shift.comp id: GLY
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 109.75
atom chem shift.val err: 0.04

1,17946,469
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 39
atom chem shift.val: 8.19
atom chem shift.val err: 0.01

1,17946,470
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 4.89
atom chem shift.val err: 0.01

1,17946,471
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.62
atom chem shift.val err: 0.00

1,17946,472
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 472
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.87
atom chem shift.val err: 0.00

1,17946,473
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 473
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 0.84
atom chem shift.val err: 0.00

1,17946,474
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 474
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 39
atom chem shift.val: 1.07
atom chem shift.val err: 0.01

1,17946,475
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 172.49
atom chem shift.val err: 0.00

1,17946,476
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 54.15
atom chem shift.val err: 0.26

1,17946,477
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 34.04
atom chem shift.val err: 0.11

1,17946,478
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 24.69
atom chem shift.val err: 0.00

1,17946,479
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.val: 122.17
atom chem shift.val err: 0.07

1,17946,480
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.07
atom chem shift.val err: 0.02

1,17946,481
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.77
atom chem shift.val err: 0.01

1,17946,482
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.19
atom chem shift.val err: 0.01

1,17946,483
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.18
atom chem shift.val err: 0.01

1,17946,484
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.35
atom chem shift.val err: 0.01

1,17946,485
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.02
atom chem shift.val err: 0.00

1,17946,486
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.00

1,17946,487
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 175.78
atom chem shift.val err: 0.03

1,17946,488
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 62.08
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1,17946,489
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 31.08
atom chem shift.val err: 0.27

1,17946,490
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 29.18
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1,17946,491
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 49.77
atom chem shift.val err: 0.16

1,17946,492
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.84
atom chem shift.val err: 0.01

1,17946,493
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ILE
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.69
atom chem shift.val err: 0.01

1,17946,494
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,495
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,496
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.01

1,17946,497
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,498
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,499
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,500
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,501
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.id: 501
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 41
atom chem shift.comp id: ILE
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 173.53
atom chem shift.val err: 0.01

1,17946,502
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 502
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 41
atom chem shift.comp id: ILE
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 57.38
atom chem shift.val err: 0.22

1,17946,503
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 503
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 41
atom chem shift.comp id: ILE
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 41.03
atom chem shift.val err: 0.27

1,17946,504
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 504
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 41
atom chem shift.comp id: ILE
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 17.38
atom chem shift.val err: 0.28

1,17946,505
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 505
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 41
atom chem shift.comp id: ILE
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 15.46
atom chem shift.val err: 0.22

1,17946,506
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 506
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 41
atom chem shift.comp id: ILE
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 115.79
atom chem shift.val err: 0.07

1,17946,507
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 507
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 8.79
atom chem shift.val err: 0.01

1,17946,508
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 508
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 4.96
atom chem shift.val err: 0.01

1,17946,509
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 509
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.85
atom chem shift.val err: 0.02

1,17946,510
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 510
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 0.57
atom chem shift.val err: 0.01

1,17946,511
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 511
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 0.57
atom chem shift.val err: 0.01

1,17946,512
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 512
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 0.57
atom chem shift.val err: 0.01

1,17946,513
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 513
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 0.74
atom chem shift.val err: 0.00

1,17946,514
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 514
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 0.74
atom chem shift.val err: 0.00

1,17946,515
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 515
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 0.74
atom chem shift.val err: 0.00

1,17946,516
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 516
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 174.72
atom chem shift.val err: 0.00

1,17946,517
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 517
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 60.29
atom chem shift.val err: 0.11

1,17946,518
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 518
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 34.20
atom chem shift.val err: 0.06

1,17946,519
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 519
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 21.78
atom chem shift.val err: 0.13

1,17946,520
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 520
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 22.06
atom chem shift.val err: 0.12

1,17946,521
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 521
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 42
atom chem shift.comp id: VAL
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 122.91
atom chem shift.val err: 0.06

1,17946,522
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 522
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 9.08
atom chem shift.val err: 0.02

1,17946,523
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 523
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 5.86
atom chem shift.val err: 0.01

1,17946,524
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 524
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 1.80
atom chem shift.val err: 0.02

1,17946,525
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 525
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.08
atom chem shift.val err: 0.00

1,17946,526
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 526
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.38
atom chem shift.val err: 0.01

1,17946,527
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 527
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.56
atom chem shift.val err: 0.01

1,17946,528
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 528
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE*
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 1.90
atom chem shift.val err: 0.01

1,17946,529
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 529
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE*
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 1.90
atom chem shift.val err: 0.01

1,17946,530
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 530
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE*
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 1.90
atom chem shift.val err: 0.01

1,17946,531
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 531
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 174.44
atom chem shift.val err: 0.00

1,17946,532
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 532
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 52.18
atom chem shift.val err: 0.20

1,17946,533
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 533
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 40.53
atom chem shift.val err: 0.10

1,17946,534
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 534
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 31.54
atom chem shift.val err: 0.12

1,17946,535
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 535
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 18.32
atom chem shift.val err: 0.02

1,17946,536
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 536
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 43
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 124.20
atom chem shift.val err: 0.06

1,17946,537
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 537
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 9.20
atom chem shift.val err: 0.02

1,17946,538
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 538
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 4.03
atom chem shift.val err: 0.01

1,17946,539
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 539
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 4.24
atom chem shift.val err: 0.01

1,17946,540
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 540
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 175.23
atom chem shift.val err: 0.01

1,17946,541
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 541
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 44.28
atom chem shift.val err: 0.12

1,17946,542
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 542
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 44
atom chem shift.comp id: GLY
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 107.24
atom chem shift.val err: 0.08

1,17946,543
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 543
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
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atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 45
atom chem shift.comp id: ARG
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 7.60
atom chem shift.val err: 0.01

1,17946,544
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 544
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 3.87
atom chem shift.val err: 0.01

1,17946,545
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 545
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.69
atom chem shift.val err: 0.00

1,17946,546
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 546
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.82
atom chem shift.val err: 0.02

1,17946,547
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 547
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atom chem shift.atom isotope number: 13
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 178.29
atom chem shift.val err: 0.05

1,17946,548
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 548
atom chem shift.ambiguity code: 1
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atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 61.43
atom chem shift.val err: 0.09

1,17946,549
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 45
atom chem shift.val: 29.45
atom chem shift.val err: 0.07

1,17946,550
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 45
atom chem shift.val: 25.64
atom chem shift.val err: 0.00

1,17946,551
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 45
atom chem shift.val: 120.75
atom chem shift.val err: 0.05

1,17946,552
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 46
atom chem shift.val: 7.37
atom chem shift.val err: 0.01

1,17946,553
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.58
atom chem shift.val err: 0.02

1,17946,554
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.15
atom chem shift.val err: 0.01

1,17946,555
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 46
atom chem shift.val: 3.42
atom chem shift.val err: 0.01

1,17946,556
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 6.85
atom chem shift.val err: 0.01

1,17946,557
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.25
atom chem shift.val err: 0.01

1,17946,558
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 178.47
atom chem shift.val err: 0.03

1,17946,559
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 56.76
atom chem shift.val err: 0.10

1,17946,560
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 35.53
atom chem shift.val err: 0.09

1,17946,561
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 175.10
atom chem shift.val err: 0.00

1,17946,562
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
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atom chem shift.val: 113.67
atom chem shift.val err: 0.10

1,17946,563
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
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atom chem shift.val: 109.17
atom chem shift.val err: 0.17

1,17946,564
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: THR
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atom chem shift.val: 8.11
atom chem shift.val err: 0.01

1,17946,565
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: THR
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atom chem shift.val: 3.84
atom chem shift.val err: 0.01

1,17946,566
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.27
atom chem shift.val err: 0.01

1,17946,567
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.34
atom chem shift.val err: 0.03

1,17946,568
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.03

1,17946,569
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.34
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1,17946,570
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,571
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,572
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,573
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 47
atom chem shift.comp id: THR
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 19.38
atom chem shift.val err: 0.09

1,17946,574
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 574
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 47
atom chem shift.comp id: THR
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 119.64
atom chem shift.val err: 0.10

1,17946,575
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 575
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 8.23
atom chem shift.val err: 0.01

1,17946,576
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 576
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 4.33
atom chem shift.val err: 0.01

1,17946,577
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 577
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 3.11
atom chem shift.val err: 0.01

1,17946,578
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 578
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 3.41
atom chem shift.val err: 0.00

1,17946,579
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 579
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 177.56
atom chem shift.val err: 0.02

1,17946,580
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 580
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 62.09
atom chem shift.val err: 0.18

1,17946,581
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 581
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 38.63
atom chem shift.val err: 0.35

1,17946,582
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 582
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 48
atom chem shift.comp id: PHE
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 122.99
atom chem shift.val err: 0.28

1,17946,583
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 583
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 8.30
atom chem shift.val err: 0.02

1,17946,584
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 584
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 3.55
atom chem shift.val err: 0.01

1,17946,585
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 585
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 1.94
atom chem shift.val err: 0.01

1,17946,586
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 586
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 1.94
atom chem shift.val err: 0.01

1,17946,587
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 587
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 2.32
atom chem shift.val err: 0.01

1,17946,588
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 588
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 2.78
atom chem shift.val err: 0.01

1,17946,589
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 589
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 178.44
atom chem shift.val err: 0.01

1,17946,590
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 590
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 59.19
atom chem shift.val err: 0.08

1,17946,591
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 591
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 28.62
atom chem shift.val err: 0.23

1,17946,592
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 592
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 37.69
atom chem shift.val err: 0.23

1,17946,593
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 593
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLU
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 117.89
atom chem shift.val err: 0.08

1,17946,594
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 594
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 7.99
atom chem shift.val err: 0.01

1,17946,595
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 595
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 4.15
atom chem shift.val err: 0.01

1,17946,596
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 596
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 4.01
atom chem shift.val err: 0.01

1,17946,597
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 597
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.atom type: H
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atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 4.01
atom chem shift.val err: 0.01

1,17946,598
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 598
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 175.89
atom chem shift.val err: 0.01

1,17946,599
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 599
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 60.66
atom chem shift.val err: 0.06

1,17946,600
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 600
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 63.58
atom chem shift.val err: 0.27

1,17946,601
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 601
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 50
atom chem shift.comp id: SER
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 115.04
atom chem shift.val err: 0.05

1,17946,602
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 602
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 7.70
atom chem shift.val err: 0.01

1,17946,603
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 603
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 3.38
atom chem shift.val err: 0.01

1,17946,604
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 604
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.57
atom chem shift.val err: 0.02

1,17946,605
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 605
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.62
atom chem shift.val err: 0.00

1,17946,606
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 606
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.63
atom chem shift.val err: 0.00

1,17946,607
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 607
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.40
atom chem shift.val err: 0.01

1,17946,608
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 608
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.40
atom chem shift.val err: 0.01

1,17946,609
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 609
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.40
atom chem shift.val err: 0.01

1,17946,610
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 610
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
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atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.44
atom chem shift.val err: 0.02

1,17946,611
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 611
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.44
atom chem shift.val err: 0.02

1,17946,612
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 612
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.44
atom chem shift.val err: 0.02

1,17946,613
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 613
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 179.07
atom chem shift.val err: 0.02

1,17946,614
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 614
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 65.17
atom chem shift.val err: 0.12

1,17946,615
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 615
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 38.70
atom chem shift.val err: 0.29

1,17946,616
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 616
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 27.07
atom chem shift.val err: 0.22

1,17946,617
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 617
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 17.80
atom chem shift.val err: 0.21

1,17946,618
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 618
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 14.47
atom chem shift.val err: 0.07

1,17946,619
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 619
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 51
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 123.84
atom chem shift.val err: 0.04

1,17946,620
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 620
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 7.90
atom chem shift.val err: 0.01

1,17946,621
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 621
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 3.27
atom chem shift.val err: 0.01

1,17946,622
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 622
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: GLY
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 3.85
atom chem shift.val err: 0.01

1,17946,623
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 623
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 172.85
atom chem shift.val err: 0.01

1,17946,624
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 45.47
atom chem shift.val err: 0.10

1,17946,625
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 625
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 105.09
atom chem shift.val err: 0.14

1,17946,626
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 626
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
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atom chem shift.val: 6.98
atom chem shift.val err: 0.01

1,17946,627
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.71
atom chem shift.val err: 0.01

1,17946,628
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.63
atom chem shift.val err: 0.02

1,17946,629
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.00
atom chem shift.val err: 0.01

1,17946,630
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.17
atom chem shift.val err: 0.02

1,17946,631
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.26
atom chem shift.val err: 0.01

1,17946,632
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 53
atom chem shift.val: 2.96
atom chem shift.val err: 0.00

1,17946,633
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 53
atom chem shift.val: 3.26
atom chem shift.val err: 0.00

1,17946,634
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ARG
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 53
atom chem shift.val: 170.82
atom chem shift.val err: 0.00

1,17946,635
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 53.31
atom chem shift.val err: 0.06

1,17946,636
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 28.36
atom chem shift.val err: 0.12

1,17946,637
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
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atom chem shift.val: 24.65
atom chem shift.val err: 0.24

1,17946,638
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
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atom chem shift.val: 43.57
atom chem shift.val err: 0.00

1,17946,639
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 639
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 53
atom chem shift.val: 115.32
atom chem shift.val err: 0.06

1,17946,640
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 640
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atom chem shift.comp id: PRO
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 54
atom chem shift.val: 4.36
atom chem shift.val err: 0.01

1,17946,641
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 54
atom chem shift.val: 1.69
atom chem shift.val err: 0.03

1,17946,642
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 642
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atom chem shift.val: 2.00
atom chem shift.val err: 0.02

1,17946,643
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,644
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17946,645
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 3.50
atom chem shift.val err: 0.02

1,17946,646
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 646
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 3.89
atom chem shift.val err: 0.01

1,17946,647
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 647
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 54
atom chem shift.val: 177.31
atom chem shift.val err: 0.00

1,17946,648
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 648
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 54
atom chem shift.val: 61.41
atom chem shift.val err: 0.27

1,17946,649
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 31.82
atom chem shift.val err: 0.10

1,17946,650
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 28.60
atom chem shift.val err: 0.00

1,17946,651
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 54
atom chem shift.val: 50.55
atom chem shift.val err: 0.16

1,17946,652
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 652
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atom chem shift.comp id: LEU
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 55
atom chem shift.val: 9.39
atom chem shift.val err: 0.01

1,17946,653
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 55
atom chem shift.val: 4.58
atom chem shift.val err: 0.01

1,17946,654
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.11
atom chem shift.val err: 0.01

1,17946,655
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.59
atom chem shift.val err: 0.00

1,17946,656
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.65
atom chem shift.val err: 0.00

1,17946,657
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.42
atom chem shift.val err: 0.01

1,17946,658
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,659
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.42
atom chem shift.val err: 0.01

1,17946,660
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.77
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1,17946,661
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,662
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,663
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.val: 176.38
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1,17946,664
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,665
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,666
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,667
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,668
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,669
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,670
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,671
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,672
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,673
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,674
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,675
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,676
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,677
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,678
type: atom chem shift
of datablock: info:bmrb/17946
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1,17946,679
type: atom chem shift
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1,17946,680
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of datablock: info:bmrb/17946
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1,17946,681
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 2.98
atom chem shift.val err: 0.01

1,17946,682
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 682
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 174.04
atom chem shift.val err: 0.01

1,17946,683
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 54.77
atom chem shift.val err: 0.31

1,17946,684
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 684
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 36.32
atom chem shift.val err: 0.29

1,17946,685
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 28.15
atom chem shift.val err: 0.22

1,17946,686
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 686
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 58
atom chem shift.val: 42.97
atom chem shift.val err: 0.02

1,17946,687
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 687
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atom chem shift.auth seq id: 58
atom chem shift.comp id: ARG
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 119.22
atom chem shift.val err: 0.06

1,17946,688
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 688
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atom chem shift.auth comp id: LEU
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 7.53
atom chem shift.val err: 0.01

1,17946,689
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 689
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 4.41
atom chem shift.val err: 0.00

1,17946,690
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 690
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.51
atom chem shift.val err: 0.04

1,17946,691
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 691
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.93
atom chem shift.val err: 0.01

1,17946,692
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.87
atom chem shift.val err: 0.01

1,17946,693
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.87
atom chem shift.val err: 0.01

1,17946,694
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.87
atom chem shift.val err: 0.01

1,17946,695
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.88
atom chem shift.val err: 0.01

1,17946,696
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.88
atom chem shift.val err: 0.01

1,17946,697
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.88
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1,17946,698
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 174.90
atom chem shift.val err: 0.05

1,17946,699
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 55.17
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1,17946,700
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,701
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 23.00
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1,17946,702
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 26.87
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1,17946,703
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 125.48
atom chem shift.val err: 0.05

1,17946,704
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.27
atom chem shift.val err: 0.01

1,17946,705
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17946,706
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.93
atom chem shift.val err: 0.02

1,17946,707
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,708
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 6.92
atom chem shift.val err: 0.01

1,17946,709
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.81
atom chem shift.val err: 0.01

1,17946,710
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 172.36
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1,17946,711
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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1,17946,712
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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1,17946,713
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 175.81
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1,17946,714
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 714
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
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1,17946,715
type: atom chem shift
of datablock: info:bmrb/17946
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atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
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1,17946,716
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.10
atom chem shift.val err: 0.01

1,17946,717
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 717
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 4.79
atom chem shift.val err: 0.01

1,17946,718
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 718
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 1.90
atom chem shift.val err: 0.01

1,17946,719
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 719
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG12
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 1.51
atom chem shift.val err: 0.01

1,17946,720
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 720
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG13
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 1.90
atom chem shift.val err: 0.02

1,17946,721
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 721
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 0.75
atom chem shift.val err: 0.01

1,17946,722
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 722
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 0.75
atom chem shift.val err: 0.01

1,17946,723
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 723
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 0.75
atom chem shift.val err: 0.01

1,17946,724
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 724
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 0.74
atom chem shift.val err: 0.01

1,17946,725
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 725
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 0.74
atom chem shift.val err: 0.01

1,17946,726
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 726
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 0.74
atom chem shift.val err: 0.01

1,17946,727
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 727
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 173.61
atom chem shift.val err: 0.02

1,17946,728
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 728
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 60.43
atom chem shift.val err: 0.08

1,17946,729
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 729
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 39.17
atom chem shift.val err: 0.07

1,17946,730
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 730
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 27.73
atom chem shift.val err: 0.20

1,17946,731
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 731
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 18.53
atom chem shift.val err: 0.12

1,17946,732
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 732
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 13.88
atom chem shift.val err: 0.05

1,17946,733
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 733
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 61
atom chem shift.comp id: ILE
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 126.72
atom chem shift.val err: 0.04

1,17946,734
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 734
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 8.94
atom chem shift.val err: 0.01

1,17946,735
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 735
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 4.76
atom chem shift.val err: 0.01

1,17946,736
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 736
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.51
atom chem shift.val err: 0.01

1,17946,737
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 737
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 0.30
atom chem shift.val err: 0.00

1,17946,738
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 738
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 0.30
atom chem shift.val err: 0.00

1,17946,739
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 739
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 0.30
atom chem shift.val err: 0.00

1,17946,740
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 740
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 0.77
atom chem shift.val err: 0.01

1,17946,741
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 741
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 0.77
atom chem shift.val err: 0.01

1,17946,742
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 742
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 0.77
atom chem shift.val err: 0.01

1,17946,743
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 743
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 174.18
atom chem shift.val err: 0.02

1,17946,744
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 744
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 59.96
atom chem shift.val err: 0.12

1,17946,745
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 745
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 34.80
atom chem shift.val err: 0.11

1,17946,746
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 746
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 20.52
atom chem shift.val err: 0.14

1,17946,747
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 747
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 20.73
atom chem shift.val err: 0.11

1,17946,748
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 748
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 62
atom chem shift.comp id: VAL
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 127.53
atom chem shift.val err: 0.07

1,17946,749
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 749
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 8.62
atom chem shift.val err: 0.01

1,17946,750
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 750
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 4.81
atom chem shift.val err: 0.02

1,17946,751
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 751
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.30
atom chem shift.val err: 0.01

1,17946,752
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 752
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.83
atom chem shift.val err: 0.02

1,17946,753
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 753
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HG
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atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.83
atom chem shift.val err: 0.02

1,17946,754
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 754
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: -0.01
atom chem shift.val err: 0.03

1,17946,755
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 755
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: -0.01
atom chem shift.val err: 0.03

1,17946,756
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 756
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: -0.01
atom chem shift.val err: 0.03

1,17946,757
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 757
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.12
atom chem shift.val err: 0.01

1,17946,758
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 758
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.12
atom chem shift.val err: 0.01

1,17946,759
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 759
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.12
atom chem shift.val err: 0.01

1,17946,760
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 760
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 175.58
atom chem shift.val err: 0.01

1,17946,761
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 761
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 53.61
atom chem shift.val err: 0.19

1,17946,762
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 762
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 41.80
atom chem shift.val err: 0.14

1,17946,763
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 763
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 27.98
atom chem shift.val err: 0.12

1,17946,764
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 764
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 25.20
atom chem shift.val err: 0.09

1,17946,765
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 765
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 25.76
atom chem shift.val err: 0.16

1,17946,766
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 766
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 63
atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 128.29
atom chem shift.val err: 0.07

1,17946,767
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 767
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 8.34
atom chem shift.val err: 0.01

1,17946,768
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 768
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 5.05
atom chem shift.val err: 0.01

1,17946,769
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 769
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 3.23
atom chem shift.val err: 0.03

1,17946,770
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 770
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
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atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 3.77
atom chem shift.val err: 0.01

1,17946,771
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 771
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 175.57
atom chem shift.val err: 0.02

1,17946,772
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 772
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 58.70
atom chem shift.val err: 0.24

1,17946,773
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 773
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 65.92
atom chem shift.val err: 0.26

1,17946,774
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 774
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 64
atom chem shift.comp id: SER
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 114.40
atom chem shift.val err: 0.07

1,17946,775
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 775
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ARG
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 10.25
atom chem shift.val err: 0.01

1,17946,776
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 776
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 4.60
atom chem shift.val err: 0.01

1,17946,777
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 777
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ARG
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 2.08
atom chem shift.val err: 0.01

1,17946,778
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 778
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 2.08
atom chem shift.val err: 0.01

1,17946,779
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 779
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 1.44
atom chem shift.val err: 0.03

1,17946,780
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 780
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 1.93
atom chem shift.val err: 0.01

1,17946,781
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 781
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 2.95
atom chem shift.val err: 0.02

1,17946,782
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 782
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 2.95
atom chem shift.val err: 0.02

1,17946,783
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 783
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 177.78
atom chem shift.val err: 0.03

1,17946,784
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 784
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 56.21
atom chem shift.val err: 0.25

1,17946,785
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 785
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 29.88
atom chem shift.val err: 0.36

1,17946,786
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 786
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 29.02
atom chem shift.val err: 0.32

1,17946,787
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 787
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 42.82
atom chem shift.val err: 0.28

1,17946,788
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 788
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 65
atom chem shift.comp id: ARG
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 126.86
atom chem shift.val err: 0.09

1,17946,789
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 789
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
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atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 9.09
atom chem shift.val err: 0.02

1,17946,790
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 790
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 4.28
atom chem shift.val err: 0.02

1,17946,791
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 791
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.08
atom chem shift.val err: 0.01

1,17946,792
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 792
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.08
atom chem shift.val err: 0.01

1,17946,793
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 793
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.15
atom chem shift.val err: 0.01

1,17946,794
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 794
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.50
atom chem shift.val err: 0.01

1,17946,795
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 795
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 6.68
atom chem shift.val err: 0.01

1,17946,796
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 796
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 7.78
atom chem shift.val err: 0.02

1,17946,797
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 797
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 177.69
atom chem shift.val err: 0.01

1,17946,798
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 798
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 56.49
atom chem shift.val err: 0.03

1,17946,799
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 799
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 30.21
atom chem shift.val err: 0.09

1,17946,800
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 800
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 34.93
atom chem shift.val err: 0.24

1,17946,801
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 801
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 180.75
atom chem shift.val err: 0.03

1,17946,802
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 802
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 121.90
atom chem shift.val err: 0.08

1,17946,803
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 803
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 66
atom chem shift.comp id: GLN
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 113.03
atom chem shift.val err: 0.26

1,17946,804
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 804
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 8.69
atom chem shift.val err: 0.00

1,17946,805
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 805
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 4.13
atom chem shift.val err: 0.01

1,17946,806
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 806
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 4.23
atom chem shift.val err: 0.01

1,17946,807
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 807
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 1.27
atom chem shift.val err: 0.01

1,17946,808
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 808
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 1.27
atom chem shift.val err: 0.01

1,17946,809
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 809
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 1.27
atom chem shift.val err: 0.01

1,17946,810
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 810
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 174.94
atom chem shift.val err: 0.02

1,17946,811
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 811
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 63.74
atom chem shift.val err: 0.20

1,17946,812
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 812
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 69.19
atom chem shift.val err: 0.48

1,17946,813
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 813
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 21.85
atom chem shift.val err: 0.16

1,17946,814
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 814
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 67
atom chem shift.comp id: THR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 118.53
atom chem shift.val err: 0.07

1,17946,815
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 815
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 8.55
atom chem shift.val err: 0.01

1,17946,816
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 816
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 4.57
atom chem shift.val err: 0.01

1,17946,817
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 817
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 2.69
atom chem shift.val err: 0.02

1,17946,818
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 818
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 2.82
atom chem shift.val err: 0.04

1,17946,819
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 819
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 174.63
atom chem shift.val err: 0.03

1,17946,820
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 820
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 53.40
atom chem shift.val err: 0.12

1,17946,821
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 821
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.atom type: C
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 39.64
atom chem shift.val err: 0.20

1,17946,822
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 822
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 68
atom chem shift.comp id: ASP
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 119.82
atom chem shift.val err: 0.04

1,17946,823
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 823
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 7.33
atom chem shift.val err: 0.00

1,17946,824
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 824
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 4.39
atom chem shift.val err: 0.02

1,17946,825
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 825
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 2.71
atom chem shift.val err: 0.01

1,17946,826
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 826
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 2.88
atom chem shift.val err: 0.01

1,17946,827
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 827
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 174.15
atom chem shift.val err: 0.01

1,17946,828
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 828
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 58.40
atom chem shift.val err: 0.23

1,17946,829
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 829
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 39.77
atom chem shift.val err: 0.30

1,17946,830
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 830
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 69
atom chem shift.comp id: TYR
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 122.46
atom chem shift.val err: 0.03

1,17946,831
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 831
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 8.59
atom chem shift.val err: 0.01

1,17946,832
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 832
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 4.32
atom chem shift.val err: 0.01

1,17946,833
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 833
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 1.75
atom chem shift.val err: 0.01

1,17946,834
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 834
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 1.90
atom chem shift.val err: 0.01

1,17946,835
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 835
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 2.09
atom chem shift.val err: 0.01

1,17946,836
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 836
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 2.14
atom chem shift.val err: 0.01

1,17946,837
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 837
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 6.75
atom chem shift.val err: 0.01

1,17946,838
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 838
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 7.53
atom chem shift.val err: 0.01

1,17946,839
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 839
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 171.04
atom chem shift.val err: 0.00

1,17946,840
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 840
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 53.39
atom chem shift.val err: 0.15

1,17946,841
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 841
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 29.36
atom chem shift.val err: 0.08

1,17946,842
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 842
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
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atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 34.00
atom chem shift.val err: 0.08

1,17946,843
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 843
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
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atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 181.00
atom chem shift.val err: 0.03

1,17946,844
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 844
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 125.27
atom chem shift.val err: 0.04

1,17946,845
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 845
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 112.72
atom chem shift.val err: 0.20

1,17946,846
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 846
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 4.32
atom chem shift.val err: 0.01

1,17946,847
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 847
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 71
atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 1.63
atom chem shift.val err: 0.00

1,17946,848
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 848
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 1.79
atom chem shift.val err: 0.00

1,17946,849
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 849
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 71
atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 0.84
atom chem shift.val err: 0.03

1,17946,850
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 850
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 71
atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 1.35
atom chem shift.val err: 0.02

1,17946,851
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 851
atom chem shift.ambiguity code: 2
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atom chem shift.auth seq id: 71
atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 71
atom chem shift.val: 2.03
atom chem shift.val err: 0.01

1,17946,852
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 852
atom chem shift.ambiguity code: 2
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atom chem shift.auth seq id: 71
atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 2.55
atom chem shift.val err: 0.01

1,17946,853
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 853
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 71
atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 176.27
atom chem shift.val err: 0.01

1,17946,854
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 854
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 71
atom chem shift.val: 62.14
atom chem shift.val err: 0.11

1,17946,855
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 855
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 71
atom chem shift.val: 31.56
atom chem shift.val err: 0.03

1,17946,856
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 856
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 71
atom chem shift.val: 27.94
atom chem shift.val err: 0.00

1,17946,857
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 857
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 49.71
atom chem shift.val err: 0.28

1,17946,858
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 858
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 8.44
atom chem shift.val err: 0.01

1,17946,859
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 859
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 4.09
atom chem shift.val err: 0.02

1,17946,860
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 860
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atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 1.93
atom chem shift.val err: 0.01

1,17946,861
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 861
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 1.93
atom chem shift.val err: 0.01

1,17946,862
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 862
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 2.27
atom chem shift.val err: 0.02

1,17946,863
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 863
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 2.27
atom chem shift.val err: 0.02

1,17946,864
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 864
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 178.34
atom chem shift.val err: 0.00

1,17946,865
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 865
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 57.20
atom chem shift.val err: 0.17

1,17946,866
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 866
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 30.06
atom chem shift.val err: 0.15

1,17946,867
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 867
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 36.46
atom chem shift.val err: 0.03

1,17946,868
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 868
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 72
atom chem shift.comp id: GLU
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 121.75
atom chem shift.val err: 0.04

1,17946,869
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 869
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 73
atom chem shift.comp id: GLY
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 8.68
atom chem shift.val err: 0.01

1,17946,870
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 870
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 73
atom chem shift.comp id: GLY
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 3.67
atom chem shift.val err: 0.01

1,17946,871
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 871
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 73
atom chem shift.comp id: GLY
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 4.02
atom chem shift.val err: 0.01

1,17946,872
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 872
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 73
atom chem shift.comp id: GLY
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 173.73
atom chem shift.val err: 0.02

1,17946,873
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 873
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 73
atom chem shift.comp id: GLY
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 45.94
atom chem shift.val err: 0.18

1,17946,874
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 874
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 73
atom chem shift.comp id: GLY
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 108.18
atom chem shift.val err: 0.04

1,17946,875
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 875
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 6.91
atom chem shift.val err: 0.01

1,17946,876
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 876
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 4.76
atom chem shift.val err: 0.01

1,17946,877
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 877
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 1.64
atom chem shift.val err: 0.01

1,17946,878
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 878
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 0.06
atom chem shift.val err: 0.00

1,17946,879
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 879
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 0.06
atom chem shift.val err: 0.00

1,17946,880
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 880
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 0.06
atom chem shift.val err: 0.00

1,17946,881
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 881
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 0.41
atom chem shift.val err: 0.01

1,17946,882
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 882
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 0.41
atom chem shift.val err: 0.01

1,17946,883
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 883
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 0.41
atom chem shift.val err: 0.01

1,17946,884
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 884
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 174.46
atom chem shift.val err: 0.01

1,17946,885
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 885
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 58.14
atom chem shift.val err: 0.17

1,17946,886
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 886
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 34.39
atom chem shift.val err: 0.11

1,17946,887
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 887
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 18.14
atom chem shift.val err: 0.06

1,17946,888
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 888
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 21.84
atom chem shift.val err: 0.09

1,17946,889
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 889
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 74
atom chem shift.comp id: VAL
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 108.70
atom chem shift.val err: 0.04

1,17946,890
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 890
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 8.80
atom chem shift.val err: 0.01

1,17946,891
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 891
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 4.47
atom chem shift.val err: 0.01

1,17946,892
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 892
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 3.88
atom chem shift.val err: 0.01

1,17946,893
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 893
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 1.09
atom chem shift.val err: 0.00

1,17946,894
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 894
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 1.09
atom chem shift.val err: 0.00

1,17946,895
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 895
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 1.09
atom chem shift.val err: 0.00

1,17946,896
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 896
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 172.69
atom chem shift.val err: 0.01

1,17946,897
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 897
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 62.20
atom chem shift.val err: 0.20

1,17946,898
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 898
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 70.61
atom chem shift.val err: 0.15

1,17946,899
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 899
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 21.01
atom chem shift.val err: 0.01

1,17946,900
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 900
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 75
atom chem shift.comp id: THR
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 120.91
atom chem shift.val err: 0.18

1,17946,901
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 901
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 8.91
atom chem shift.val err: 0.01

1,17946,902
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 902
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 5.23
atom chem shift.val err: 0.01

1,17946,903
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 903
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 1.96
atom chem shift.val err: 0.00

1,17946,904
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 904
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 0.83
atom chem shift.val err: 0.01

1,17946,905
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 905
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 0.83
atom chem shift.val err: 0.01

1,17946,906
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 906
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 0.83
atom chem shift.val err: 0.01

1,17946,907
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 907
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 1.11
atom chem shift.val err: 0.01

1,17946,908
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 908
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 1.11
atom chem shift.val err: 0.01

1,17946,909
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 909
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 1.11
atom chem shift.val err: 0.01

1,17946,910
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 910
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 176.53
atom chem shift.val err: 0.00

1,17946,911
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 911
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 61.11
atom chem shift.val err: 0.14

1,17946,912
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 912
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 32.75
atom chem shift.val err: 0.11

1,17946,913
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 913
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 22.97
atom chem shift.val err: 0.19

1,17946,914
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 914
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 21.62
atom chem shift.val err: 0.15

1,17946,915
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 915
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 76
atom chem shift.comp id: VAL
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 129.12
atom chem shift.val err: 0.05

1,17946,916
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 916
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 8.93
atom chem shift.val err: 0.01

1,17946,917
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 917
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 4.84
atom chem shift.val err: 0.01

1,17946,918
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 918
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 2.17
atom chem shift.val err: 0.01

1,17946,919
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 919
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 0.56
atom chem shift.val err: 0.01

1,17946,920
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 920
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 0.56
atom chem shift.val err: 0.01

1,17946,921
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 921
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 0.56
atom chem shift.val err: 0.01

1,17946,922
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 922
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 0.71
atom chem shift.val err: 0.01

1,17946,923
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 923
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 0.71
atom chem shift.val err: 0.01

1,17946,924
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 924
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 0.71
atom chem shift.val err: 0.01

1,17946,925
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 925
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 174.07
atom chem shift.val err: 0.00

1,17946,926
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 926
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 58.64
atom chem shift.val err: 0.24

1,17946,927
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 927
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 35.46
atom chem shift.val err: 0.13

1,17946,928
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 928
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 18.73
atom chem shift.val err: 0.07

1,17946,929
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 929
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 21.93
atom chem shift.val err: 0.12

1,17946,930
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 930
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 77
atom chem shift.comp id: VAL
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 120.51
atom chem shift.val err: 0.05

1,17946,931
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 931
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 8.83
atom chem shift.val err: 0.01

1,17946,932
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 932
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 5.18
atom chem shift.val err: 0.01

1,17946,933
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 933
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 1.57
atom chem shift.val err: 0.01

1,17946,934
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 934
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 1.57
atom chem shift.val err: 0.01

1,17946,935
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 935
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 1.57
atom chem shift.val err: 0.01

1,17946,936
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 936
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 177.56
atom chem shift.val err: 0.02

1,17946,937
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 937
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 51.73
atom chem shift.val err: 0.13

1,17946,938
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 938
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 21.34
atom chem shift.val err: 0.11

1,17946,939
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 939
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 78
atom chem shift.comp id: ALA
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 119.52
atom chem shift.val err: 0.09

1,17946,940
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 940
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 7.21
atom chem shift.val err: 0.01

1,17946,941
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 941
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 5.04
atom chem shift.val err: 0.02

1,17946,942
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 942
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 4.65
atom chem shift.val err: 0.01

1,17946,943
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 943
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 1.32
atom chem shift.val err: 0.01

1,17946,944
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 944
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 1.32
atom chem shift.val err: 0.01

1,17946,945
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 945
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 1.32
atom chem shift.val err: 0.01

1,17946,946
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 946
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 174.48
atom chem shift.val err: 0.02

1,17946,947
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 947
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 59.25
atom chem shift.val err: 0.18

1,17946,948
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 948
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 73.76
atom chem shift.val err: 0.09

1,17946,949
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 949
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 22.20
atom chem shift.val err: 0.16

1,17946,950
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 950
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 79
atom chem shift.comp id: THR
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 103.36
atom chem shift.val err: 0.06

1,17946,951
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 951
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 8.96
atom chem shift.val err: 0.02

1,17946,952
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 952
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 3.84
atom chem shift.val err: 0.01

1,17946,953
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 953
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 1.55
atom chem shift.val err: 0.01

1,17946,954
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 954
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 1.74
atom chem shift.val err: 0.01

1,17946,955
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 955
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 0.66
atom chem shift.val err: 0.00

1,17946,956
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 956
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 0.66
atom chem shift.val err: 0.00

1,17946,957
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 957
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 0.66
atom chem shift.val err: 0.00

1,17946,958
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 958
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 0.91
atom chem shift.val err: 0.01

1,17946,959
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 959
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 0.91
atom chem shift.val err: 0.01

1,17946,960
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 960
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 0.91
atom chem shift.val err: 0.01

1,17946,961
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 961
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 179.20
atom chem shift.val err: 0.00

1,17946,962
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 962
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 57.86
atom chem shift.val err: 0.23

1,17946,963
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 963
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 41.35
atom chem shift.val err: 0.09

1,17946,964
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 964
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 22.96
atom chem shift.val err: 0.19

1,17946,965
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 965
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 25.48
atom chem shift.val err: 0.24

1,17946,966
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 966
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 80
atom chem shift.comp id: LEU
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 122.74
atom chem shift.val err: 0.09

1,17946,967
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 967
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 8.79
atom chem shift.val err: 0.01

1,17946,968
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 968
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 3.93
atom chem shift.val err: 0.01

1,17946,969
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 969
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 2.24
atom chem shift.val err: 0.01

1,17946,970
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 970
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 2.23
atom chem shift.val err: 0.02

1,17946,971
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 971
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 2.43
atom chem shift.val err: 0.01

1,17946,972
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 972
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 2.43
atom chem shift.val err: 0.01

1,17946,973
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 973
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 179.66
atom chem shift.val err: 0.01

1,17946,974
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 974
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 60.58
atom chem shift.val err: 0.12

1,17946,975
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 975
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 28.39
atom chem shift.val err: 0.22

1,17946,976
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 976
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 37.11
atom chem shift.val err: 0.18

1,17946,977
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 977
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 81
atom chem shift.comp id: GLU
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 119.50
atom chem shift.val err: 0.04

1,17946,978
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 978
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 8.09
atom chem shift.val err: 0.01

1,17946,979
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 979
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 4.43
atom chem shift.val err: 0.01

1,17946,980
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 980
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 2.70
atom chem shift.val err: 0.03

1,17946,981
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 981
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 2.69
atom chem shift.val err: 0.02

1,17946,982
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 982
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 179.08
atom chem shift.val err: 0.05

1,17946,983
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 983
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 56.87
atom chem shift.val err: 0.08

1,17946,984
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 984
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 40.53
atom chem shift.val err: 0.16

1,17946,985
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 985
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 82
atom chem shift.comp id: ASP
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 119.07
atom chem shift.val err: 0.16

1,17946,986
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 986
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 7.81
atom chem shift.val err: 0.01

1,17946,987
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 987
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 3.93
atom chem shift.val err: 0.01

1,17946,988
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 988
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 1.44
atom chem shift.val err: 0.01

1,17946,989
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 989
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 1.44
atom chem shift.val err: 0.01

1,17946,990
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 990
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 1.44
atom chem shift.val err: 0.01

1,17946,991
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 991
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 177.30
atom chem shift.val err: 0.04

1,17946,992
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 992
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 55.65
atom chem shift.val err: 0.08

1,17946,993
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 993
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 17.97
atom chem shift.val err: 0.05

1,17946,994
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 994
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 124.81
atom chem shift.val err: 0.07

1,17946,995
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 995
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 7.46
atom chem shift.val err: 0.01

1,17946,996
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 996
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 3.36
atom chem shift.val err: 0.01

1,17946,997
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 997
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 2.17
atom chem shift.val err: 0.01

1,17946,998
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 998
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 0.91
atom chem shift.val err: 0.01

1,17946,999
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 999
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 0.91
atom chem shift.val err: 0.01

1,17946,1000
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1000
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 0.91
atom chem shift.val err: 0.01

1,17946,1001
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1001
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 0.93
atom chem shift.val err: 0.03

1,17946,1002
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1002
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 0.93
atom chem shift.val err: 0.03

1,17946,1003
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1003
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 0.93
atom chem shift.val err: 0.03

1,17946,1004
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1004
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 179.53
atom chem shift.val err: 0.01

1,17946,1005
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1005
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 66.70
atom chem shift.val err: 0.13

1,17946,1006
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1006
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 31.61
atom chem shift.val err: 0.13

1,17946,1007
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1007
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 21.37
atom chem shift.val err: 0.07

1,17946,1008
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1008
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 22.06
atom chem shift.val err: 0.00

1,17946,1009
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1009
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 84
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 116.02
atom chem shift.val err: 0.05

1,17946,1010
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1010
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 7.51
atom chem shift.val err: 0.01

1,17946,1011
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1011
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 3.59
atom chem shift.val err: 0.01

1,17946,1012
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1012
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 2.06
atom chem shift.val err: 0.01

1,17946,1013
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1013
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 0.92
atom chem shift.val err: 0.01

1,17946,1014
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1014
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 0.92
atom chem shift.val err: 0.01

1,17946,1015
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1015
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 0.92
atom chem shift.val err: 0.01

1,17946,1016
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1016
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 1.08
atom chem shift.val err: 0.00

1,17946,1017
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1017
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 1.08
atom chem shift.val err: 0.00

1,17946,1018
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1018
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 1.08
atom chem shift.val err: 0.00

1,17946,1019
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1019
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 179.27
atom chem shift.val err: 0.02

1,17946,1020
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1020
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 66.45
atom chem shift.val err: 0.11

1,17946,1021
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1021
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 31.98
atom chem shift.val err: 0.09

1,17946,1022
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1022
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 21.14
atom chem shift.val err: 0.07

1,17946,1023
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1023
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 22.70
atom chem shift.val err: 0.11

1,17946,1024
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1024
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 85
atom chem shift.comp id: VAL
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 120.11
atom chem shift.val err: 0.04

1,17946,1025
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1025
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 8.08
atom chem shift.val err: 0.01

1,17946,1026
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1026
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 3.99
atom chem shift.val err: 0.01

1,17946,1027
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1027
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 1.39
atom chem shift.val err: 0.01

1,17946,1028
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1028
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 1.39
atom chem shift.val err: 0.01

1,17946,1029
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1029
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 1.39
atom chem shift.val err: 0.01

1,17946,1030
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1030
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 177.83
atom chem shift.val err: 0.02

1,17946,1031
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1031
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 54.27
atom chem shift.val err: 0.18

1,17946,1032
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1032
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 17.79
atom chem shift.val err: 0.18

1,17946,1033
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1033
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 86
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 122.09
atom chem shift.val err: 0.05

1,17946,1034
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1034
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 7.40
atom chem shift.val err: 0.03

1,17946,1035
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1035
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 3.82
atom chem shift.val err: 0.00

1,17946,1036
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1036
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 1.37
atom chem shift.val err: 0.00

1,17946,1037
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1037
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 1.37
atom chem shift.val err: 0.00

1,17946,1038
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1038
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 1.37
atom chem shift.val err: 0.00

1,17946,1039
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1039
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 177.28
atom chem shift.val err: 0.01

1,17946,1040
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1040
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 53.64
atom chem shift.val err: 0.19

1,17946,1041
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1041
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 19.18
atom chem shift.val err: 0.15

1,17946,1042
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1042
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 87
atom chem shift.comp id: ALA
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 118.14
atom chem shift.val err: 0.05

1,17946,1043
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1043
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 88
atom chem shift.comp id: GLY
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 7.25
atom chem shift.val err: 0.01

1,17946,1044
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1044
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 88
atom chem shift.comp id: GLY
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 3.74
atom chem shift.val err: 0.00

1,17946,1045
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1045
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 88
atom chem shift.comp id: GLY
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 3.89
atom chem shift.val err: 0.01

1,17946,1046
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1046
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 88
atom chem shift.comp id: GLY
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 174.15
atom chem shift.val err: 0.01

1,17946,1047
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1047
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 88
atom chem shift.comp id: GLY
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 45.00
atom chem shift.val err: 0.12

1,17946,1048
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1048
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 88
atom chem shift.comp id: GLY
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 101.29
atom chem shift.val err: 0.04

1,17946,1049
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1049
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 8.53
atom chem shift.val err: 0.01

1,17946,1050
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1050
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 4.77
atom chem shift.val err: 0.01

1,17946,1051
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1051
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 2.49
atom chem shift.val err: 0.01

1,17946,1052
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1052
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 2.78
atom chem shift.val err: 0.01

1,17946,1053
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1053
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 175.78
atom chem shift.val err: 0.04

1,17946,1054
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1054
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 53.43
atom chem shift.val err: 0.18

1,17946,1055
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1055
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 39.33
atom chem shift.val err: 0.06

1,17946,1056
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1056
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 89
atom chem shift.comp id: ASP
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 121.82
atom chem shift.val err: 0.07

1,17946,1057
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1057
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 7.25
atom chem shift.val err: 0.01

1,17946,1058
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1058
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 4.66
atom chem shift.val err: 0.01

1,17946,1059
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1059
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 2.48
atom chem shift.val err: 0.01

1,17946,1060
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1060
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 0.65
atom chem shift.val err: 0.02

1,17946,1061
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1061
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 0.65
atom chem shift.val err: 0.02

1,17946,1062
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1062
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 0.65
atom chem shift.val err: 0.02

1,17946,1063
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1063
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 0.98
atom chem shift.val err: 0.00

1,17946,1064
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1064
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 0.98
atom chem shift.val err: 0.00

1,17946,1065
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1065
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 0.98
atom chem shift.val err: 0.00

1,17946,1066
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1066
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 176.50
atom chem shift.val err: 0.01

1,17946,1067
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1067
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 59.41
atom chem shift.val err: 0.19

1,17946,1068
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1068
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 34.39
atom chem shift.val err: 0.08

1,17946,1069
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1069
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 17.63
atom chem shift.val err: 0.12

1,17946,1070
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1070
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 21.73
atom chem shift.val err: 0.11

1,17946,1071
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1071
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 90
atom chem shift.comp id: VAL
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 90
atom chem shift.val: 113.91
atom chem shift.val err: 0.04

1,17946,1072
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1072
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 8.75
atom chem shift.val err: 0.00

1,17946,1073
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1073
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 4.14
atom chem shift.val err: 0.01

1,17946,1074
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1074
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 2.05
atom chem shift.val err: 0.01

1,17946,1075
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1075
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 2.05
atom chem shift.val err: 0.01

1,17946,1076
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1076
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 2.30
atom chem shift.val err: 0.03

1,17946,1077
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1077
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 2.30
atom chem shift.val err: 0.03

1,17946,1078
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1078
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 178.07
atom chem shift.val err: 0.01

1,17946,1079
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1079
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 58.69
atom chem shift.val err: 0.14

1,17946,1080
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1080
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 30.44
atom chem shift.val err: 0.09

1,17946,1081
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1081
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 36.54
atom chem shift.val err: 0.03

1,17946,1082
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1082
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 119.33
atom chem shift.val err: 0.03

1,17946,1083
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1083
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 8.06
atom chem shift.val err: 0.01

1,17946,1084
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1084
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 5.24
atom chem shift.val err: 0.01

1,17946,1085
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1085
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 2.25
atom chem shift.val err: 0.01

1,17946,1086
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1086
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 2.25
atom chem shift.val err: 0.01

1,17946,1087
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1087
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 1.88
atom chem shift.val err: 0.02

1,17946,1088
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1088
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 1.88
atom chem shift.val err: 0.02

1,17946,1089
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1089
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 172.75
atom chem shift.val err: 0.00

1,17946,1090
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1090
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 55.26
atom chem shift.val err: 0.12

1,17946,1091
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1091
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 33.99
atom chem shift.val err: 0.09

1,17946,1092
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1092
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 35.71
atom chem shift.val err: 0.12

1,17946,1093
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1093
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 92
atom chem shift.comp id: GLU
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 119.96
atom chem shift.val err: 0.06

1,17946,1094
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1094
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 8.95
atom chem shift.val err: 0.01

1,17946,1095
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1095
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 4.57
atom chem shift.val err: 0.01

1,17946,1096
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1096
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 1.65
atom chem shift.val err: 0.01

1,17946,1097
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1097
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 1.87
atom chem shift.val err: 0.01

1,17946,1098
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1098
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 1.48
atom chem shift.val err: 0.02

1,17946,1099
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1099
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 0.82
atom chem shift.val err: 0.01

1,17946,1100
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1100
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 0.82
atom chem shift.val err: 0.01

1,17946,1101
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1101
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 0.82
atom chem shift.val err: 0.01

1,17946,1102
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1102
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 0.83
atom chem shift.val err: 0.01

1,17946,1103
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1103
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 0.83
atom chem shift.val err: 0.01

1,17946,1104
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1104
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 0.83
atom chem shift.val err: 0.01

1,17946,1105
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1105
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 174.08
atom chem shift.val err: 0.01

1,17946,1106
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1106
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 53.36
atom chem shift.val err: 0.10

1,17946,1107
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1107
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 45.65
atom chem shift.val err: 0.18

1,17946,1108
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1108
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 26.76
atom chem shift.val err: 0.21

1,17946,1109
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1109
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 24.94
atom chem shift.val err: 0.25

1,17946,1110
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1110
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 93
atom chem shift.comp id: LEU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 129.86
atom chem shift.val err: 0.05

1,17946,1111
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1111
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 8.00
atom chem shift.val err: 0.01

1,17946,1112
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1112
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 5.14
atom chem shift.val err: 0.01

1,17946,1113
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1113
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 2.14
atom chem shift.val err: 0.03

1,17946,1114
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1114
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 2.15
atom chem shift.val err: 0.02

1,17946,1115
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1115
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
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atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 2.36
atom chem shift.val err: 0.01

1,17946,1116
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1116
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
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atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: MET
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atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 2.36
atom chem shift.val err: 0.01

1,17946,1117
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1117
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
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atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 174.32
atom chem shift.val err: 0.02

1,17946,1118
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1118
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.atom type: C
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atom chem shift.auth comp id: MET
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atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 52.16
atom chem shift.val err: 0.20

1,17946,1119
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1119
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 30.37
atom chem shift.val err: 0.30

1,17946,1120
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1120
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 32.04
atom chem shift.val err: 0.00

1,17946,1121
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1121
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 94
atom chem shift.comp id: MET
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 120.43
atom chem shift.val err: 0.08

1,17946,1122
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1122
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 9.73
atom chem shift.val err: 0.01

1,17946,1123
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1123
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 4.66
atom chem shift.val err: 0.01

1,17946,1124
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1124
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
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atom chem shift.atom type: H
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 2.37
atom chem shift.val err: 0.02

1,17946,1125
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1125
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 1.39
atom chem shift.val err: 0.03

1,17946,1126
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1126
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 1.44
atom chem shift.val err: 0.03

1,17946,1127
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1127
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 0.99
atom chem shift.val err: 0.01

1,17946,1128
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1128
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 0.99
atom chem shift.val err: 0.01

1,17946,1129
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1129
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 0.99
atom chem shift.val err: 0.01

1,17946,1130
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1130
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 0.74
atom chem shift.val err: 0.02

1,17946,1131
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1131
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
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atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 0.74
atom chem shift.val err: 0.02

1,17946,1132
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1132
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 0.74
atom chem shift.val err: 0.02

1,17946,1133
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1133
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 177.45
atom chem shift.val err: 0.10

1,17946,1134
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1134
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 60.43
atom chem shift.val err: 0.07

1,17946,1135
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1135
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 37.48
atom chem shift.val err: 0.21

1,17946,1136
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1136
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 27.88
atom chem shift.val err: 0.10

1,17946,1137
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1137
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 19.91
atom chem shift.val err: 0.12

1,17946,1138
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1138
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 12.14
atom chem shift.val err: 0.08

1,17946,1139
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1139
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 125.83
atom chem shift.val err: 0.06

1,17946,1140
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1140
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 9.21
atom chem shift.val err: 0.01

1,17946,1141
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1141
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 5.77
atom chem shift.val err: 0.01

1,17946,1142
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1142
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 2.84
atom chem shift.val err: 0.02

1,17946,1143
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1143
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 1.06
atom chem shift.val err: 0.02

1,17946,1144
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1144
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 1.06
atom chem shift.val err: 0.02

1,17946,1145
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1145
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 1.06
atom chem shift.val err: 0.02

1,17946,1146
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1146
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 1.20
atom chem shift.val err: 0.02

1,17946,1147
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1147
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 1.20
atom chem shift.val err: 0.02

1,17946,1148
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1148
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 1.20
atom chem shift.val err: 0.02

1,17946,1149
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1149
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 174.19
atom chem shift.val err: 0.01

1,17946,1150
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1150
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 60.62
atom chem shift.val err: 0.18

1,17946,1151
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1151
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 38.90
atom chem shift.val err: 0.16

1,17946,1152
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1152
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 17.92
atom chem shift.val err: 0.19

1,17946,1153
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1153
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 16.77
atom chem shift.val err: 0.23

1,17946,1154
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1154
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 96
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 120.66
atom chem shift.val err: 0.12

1,17946,1155
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1155
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 97
atom chem shift.comp id: GLY
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 6.33
atom chem shift.val err: 0.01

1,17946,1156
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1156
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 97
atom chem shift.comp id: GLY
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 2.13
atom chem shift.val err: 0.01

1,17946,1157
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1157
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 97
atom chem shift.comp id: GLY
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 4.05
atom chem shift.val err: 0.01

1,17946,1158
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1158
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 97
atom chem shift.comp id: GLY
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 174.32
atom chem shift.val err: 0.02

1,17946,1159
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1159
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 97
atom chem shift.comp id: GLY
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 41.27
atom chem shift.val err: 0.20

1,17946,1160
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1160
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 97
atom chem shift.comp id: GLY
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 102.41
atom chem shift.val err: 0.10

1,17946,1161
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1161
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLY
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 7.83
atom chem shift.val err: 0.02

1,17946,1162
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1162
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLY
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 3.01
atom chem shift.val err: 0.01

1,17946,1163
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1163
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLY
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 4.08
atom chem shift.val err: 0.01

1,17946,1164
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1164
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLY
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 173.84
atom chem shift.val err: 0.06

1,17946,1165
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1165
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLY
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 46.53
atom chem shift.val err: 0.08

1,17946,1166
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1166
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLY
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 110.43
atom chem shift.val err: 0.07

1,17946,1167
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1167
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 7.43
atom chem shift.val err: 0.01

1,17946,1168
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1168
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 3.97
atom chem shift.val err: 0.01

1,17946,1169
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1169
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 1.72
atom chem shift.val err: 0.01

1,17946,1170
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1170
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 1.72
atom chem shift.val err: 0.01

1,17946,1171
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1171
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 1.72
atom chem shift.val err: 0.01

1,17946,1172
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1172
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 179.80
atom chem shift.val err: 0.06

1,17946,1173
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1173
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 57.00
atom chem shift.val err: 0.05

1,17946,1174
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1174
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 19.07
atom chem shift.val err: 0.18

1,17946,1175
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1175
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 99
atom chem shift.comp id: ALA
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 124.07
atom chem shift.val err: 0.07

1,17946,1176
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1176
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 8.86
atom chem shift.val err: 0.01

1,17946,1177
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1177
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 4.34
atom chem shift.val err: 0.02

1,17946,1178
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1178
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 4.35
atom chem shift.val err: 0.01

1,17946,1179
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1179
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 1.59
atom chem shift.val err: 0.01

1,17946,1180
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1180
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 1.59
atom chem shift.val err: 0.01

1,17946,1181
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1181
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 1.59
atom chem shift.val err: 0.01

1,17946,1182
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1182
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 178.71
atom chem shift.val err: 0.01

1,17946,1183
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1183
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 66.56
atom chem shift.val err: 0.09

1,17946,1184
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1184
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 68.04
atom chem shift.val err: 0.13

1,17946,1185
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1185
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 22.33
atom chem shift.val err: 0.13

1,17946,1186
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1186
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 100
atom chem shift.comp id: THR
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 109.66
atom chem shift.val err: 0.17

1,17946,1187
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1187
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 6.76
atom chem shift.val err: 0.01

1,17946,1188
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1188
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 3.75
atom chem shift.val err: 0.02

1,17946,1189
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1189
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 2.14
atom chem shift.val err: 0.02

1,17946,1190
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1190
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG12
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 1.01
atom chem shift.val err: 0.02

1,17946,1191
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1191
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG13
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 1.59
atom chem shift.val err: 0.02

1,17946,1192
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1192
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 0.62
atom chem shift.val err: 0.01

1,17946,1193
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1193
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 0.62
atom chem shift.val err: 0.01

1,17946,1194
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1194
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 0.62
atom chem shift.val err: 0.01

1,17946,1195
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1195
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 0.13
atom chem shift.val err: 0.01

1,17946,1196
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1196
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 0.13
atom chem shift.val err: 0.01

1,17946,1197
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1197
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 0.13
atom chem shift.val err: 0.01

1,17946,1198
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1198
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 178.50
atom chem shift.val err: 0.01

1,17946,1199
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1199
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 61.72
atom chem shift.val err: 0.22

1,17946,1200
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1200
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 35.55
atom chem shift.val err: 0.09

1,17946,1201
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1201
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 21.84
atom chem shift.val err: 0.30

1,17946,1202
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1202
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 18.88
atom chem shift.val err: 0.27

1,17946,1203
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1203
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 10.15
atom chem shift.val err: 0.14

1,17946,1204
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1204
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 101
atom chem shift.comp id: ILE
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 101
atom chem shift.val: 124.68
atom chem shift.val err: 0.10

1,17946,1205
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1205
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 8.69
atom chem shift.val err: 0.01

1,17946,1206
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1206
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 4.46
atom chem shift.val err: 0.01

1,17946,1207
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1207
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 2.32
atom chem shift.val err: 0.01

1,17946,1208
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1208
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 2.56
atom chem shift.val err: 0.02

1,17946,1209
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1209
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 178.54
atom chem shift.val err: 0.00

1,17946,1210
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1210
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 58.98
atom chem shift.val err: 0.20

1,17946,1211
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1211
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 38.01
atom chem shift.val err: 0.28

1,17946,1212
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1212
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 102
atom chem shift.comp id: TYR
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 102
atom chem shift.val: 118.90
atom chem shift.val err: 0.10

1,17946,1213
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1213
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 8.59
atom chem shift.val err: 0.02

1,17946,1214
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1214
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 4.22
atom chem shift.val err: 0.01

1,17946,1215
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1215
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 2.83
atom chem shift.val err: 0.01

1,17946,1216
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1216
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 3.06
atom chem shift.val err: 0.01

1,17946,1217
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1217
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 7.05
atom chem shift.val err: 0.01

1,17946,1218
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1218
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 7.48
atom chem shift.val err: 0.01

1,17946,1219
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1219
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 178.01
atom chem shift.val err: 0.05

1,17946,1220
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1220
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 56.62
atom chem shift.val err: 0.12

1,17946,1221
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1221
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 38.53
atom chem shift.val err: 0.22

1,17946,1222
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1222
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 175.87
atom chem shift.val err: 0.00

1,17946,1223
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1223
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 114.95
atom chem shift.val err: 0.06

1,17946,1224
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1224
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 103
atom chem shift.comp id: ASN
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 110.96
atom chem shift.val err: 0.20

1,17946,1225
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1225
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 7.56
atom chem shift.val err: 0.01

1,17946,1226
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1226
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 4.21
atom chem shift.val err: 0.00

1,17946,1227
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1227
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 2.32
atom chem shift.val err: 0.02

1,17946,1228
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1228
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 2.32
atom chem shift.val err: 0.02

1,17946,1229
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1229
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 2.30
atom chem shift.val err: 0.01

1,17946,1230
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1230
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 2.31
atom chem shift.val err: 0.01

1,17946,1231
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1231
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2A
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 7.16
atom chem shift.val err: 0.01

1,17946,1232
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1232
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2B
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 9.27
atom chem shift.val err: 0.01

1,17946,1233
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1233
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 177.89
atom chem shift.val err: 0.02

1,17946,1234
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1234
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 58.67
atom chem shift.val err: 0.07

1,17946,1235
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1235
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 32.44
atom chem shift.val err: 0.26

1,17946,1236
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1236
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 36.60
atom chem shift.val err: 0.05

1,17946,1237
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1237
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 116.89
atom chem shift.val err: 0.08

1,17946,1238
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1238
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 104
atom chem shift.comp id: GLN
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 114.2
atom chem shift.val err: 0.19

1,17946,1239
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1239
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 7.81
atom chem shift.val err: 0.01

1,17946,1240
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1240
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 4.52
atom chem shift.val err: 0.01

1,17946,1241
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1241
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 2.9
atom chem shift.val err: 0.03

1,17946,1242
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1242
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 2.94
atom chem shift.val err: 0.01

1,17946,1243
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1243
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 175.11
atom chem shift.val err: 0.01

1,17946,1244
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1244
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 60.7
atom chem shift.val err: 0.06

1,17946,1245
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1245
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 30.35
atom chem shift.val err: 0.21

1,17946,1246
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1246
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 105
atom chem shift.comp id: CYS
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 113.77
atom chem shift.val err: 0.09

1,17946,1247
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1247
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 7.47
atom chem shift.val err: 0.01

1,17946,1248
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1248
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 4.00
atom chem shift.val err: 0.01

1,17946,1249
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1249
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.73
atom chem shift.val err: 0.01

1,17946,1250
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1250
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.90
atom chem shift.val err: 0.02

1,17946,1251
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1251
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.85
atom chem shift.val err: 0.02

1,17946,1252
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1252
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.05
atom chem shift.val err: 0.01

1,17946,1253
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1253
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.05
atom chem shift.val err: 0.01

1,17946,1254
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1254
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.05
atom chem shift.val err: 0.01

1,17946,1255
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1255
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.15
atom chem shift.val err: 0.01

1,17946,1256
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1256
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.15
atom chem shift.val err: 0.01

1,17946,1257
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1257
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 1.15
atom chem shift.val err: 0.01

1,17946,1258
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1258
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 177.45
atom chem shift.val err: 0.01

1,17946,1259
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1259
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 59.25
atom chem shift.val err: 0.26

1,17946,1260
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1260
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 40.84
atom chem shift.val err: 0.24

1,17946,1261
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1261
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 26.81
atom chem shift.val err: 0.20

1,17946,1262
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1262
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 26.61
atom chem shift.val err: 0.18

1,17946,1263
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1263
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 24.11
atom chem shift.val err: 0.11

1,17946,1264
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1264
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 106
atom chem shift.comp id: LEU
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 121.29
atom chem shift.val err: 0.06

1,17946,1265
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1265
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 8.65
atom chem shift.val err: 0.01

1,17946,1266
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1266
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 3.68
atom chem shift.val err: 0.01

1,17946,1267
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1267
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 1.41
atom chem shift.val err: 0.01

1,17946,1268
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1268
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 1.41
atom chem shift.val err: 0.01

1,17946,1269
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1269
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 1.41
atom chem shift.val err: 0.01

1,17946,1270
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1270
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 178.32
atom chem shift.val err: 0.02

1,17946,1271
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1271
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 54.92
atom chem shift.val err: 0.20

1,17946,1272
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1272
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 17.93
atom chem shift.val err: 0.18

1,17946,1273
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1273
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 107
atom chem shift.comp id: ALA
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 116.68
atom chem shift.val err: 0.06

1,17946,1274
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1274
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 7.51
atom chem shift.val err: 0.01

1,17946,1275
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1275
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 4.35
atom chem shift.val err: 0.01

1,17946,1276
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1276
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 1.40
atom chem shift.val err: 0.00

1,17946,1277
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1277
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 1.40
atom chem shift.val err: 0.00

1,17946,1278
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1278
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 1.40
atom chem shift.val err: 0.00

1,17946,1279
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1279
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 176.91
atom chem shift.val err: 0.00

1,17946,1280
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1280
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 51.47
atom chem shift.val err: 0.21

1,17946,1281
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1281
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 19.61
atom chem shift.val err: 0.32

1,17946,1282
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1282
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 108
atom chem shift.comp id: ALA
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 118.77
atom chem shift.val err: 0.04

1,17946,1283
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1283
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 7.57
atom chem shift.val err: 0.01

1,17946,1284
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1284
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 4.21
atom chem shift.val err: 0.01

1,17946,1285
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1285
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 1.68
atom chem shift.val err: 0.01

1,17946,1286
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1286
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 1.68
atom chem shift.val err: 0.01

1,17946,1287
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1287
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 1.68
atom chem shift.val err: 0.01

1,17946,1288
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1288
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 177.05
atom chem shift.val err: 0.02

1,17946,1289
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1289
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 53.54
atom chem shift.val err: 0.21

1,17946,1290
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1290
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 18.16
atom chem shift.val err: 0.18

1,17946,1291
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1291
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 109
atom chem shift.comp id: ALA
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 121.07
atom chem shift.val err: 0.08

1,17946,1292
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1292
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 9.87
atom chem shift.val err: 0.01

1,17946,1293
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1293
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 4.82
atom chem shift.val err: 0.01

1,17946,1294
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1294
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 2.79
atom chem shift.val err: 0.01

1,17946,1295
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1295
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 3.02
atom chem shift.val err: 0.01

1,17946,1296
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1296
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 177.05
atom chem shift.val err: 0.02

1,17946,1297
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1297
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 56.49
atom chem shift.val err: 0.08

1,17946,1298
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1298
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 44.25
atom chem shift.val err: 0.24

1,17946,1299
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1299
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 122.47
atom chem shift.val err: 0.10

1,17946,1300
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1300
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 7.95
atom chem shift.val err: 0.01

1,17946,1301
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1301
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 5.81
atom chem shift.val err: 0.02

1,17946,1302
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1302
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 1.89
atom chem shift.val err: 0.01

1,17946,1303
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1303
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 2.45
atom chem shift.val err: 0.03

1,17946,1304
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1304
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 1.63
atom chem shift.val err: 0.01

1,17946,1305
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1305
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 1.67
atom chem shift.val err: 0.01

1,17946,1306
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1306
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 2.86
atom chem shift.val err: 0.02

1,17946,1307
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1307
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 3.24
atom chem shift.val err: 0.02

1,17946,1308
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1308
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 175.34
atom chem shift.val err: 0.01

1,17946,1309
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1309
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 55.07
atom chem shift.val err: 0.23

1,17946,1310
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1310
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 35.40
atom chem shift.val err: 0.23

1,17946,1311
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1311
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 27.81
atom chem shift.val err: 0.18

1,17946,1312
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1312
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 44.07
atom chem shift.val err: 0.22

1,17946,1313
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1313
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 111
atom chem shift.comp id: ARG
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 117.16
atom chem shift.val err: 0.11

1,17946,1314
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1314
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 9.12
atom chem shift.val err: 0.01

1,17946,1315
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1315
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 5.29
atom chem shift.val err: 0.01

1,17946,1316
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1316
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 0.62
atom chem shift.val err: 0.01

1,17946,1317
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1317
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 1.17
atom chem shift.val err: 0.03

1,17946,1318
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1318
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 0.77
atom chem shift.val err: 0.01

1,17946,1319
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1319
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1320
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1320
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1321
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1321
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1322
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1322
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: -0.39
atom chem shift.val err: 0.01

1,17946,1323
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1323
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: -0.39
atom chem shift.val err: 0.01

1,17946,1324
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1324
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: -0.39
atom chem shift.val err: 0.01

1,17946,1325
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1325
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 174.08
atom chem shift.val err: 0.00

1,17946,1326
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1326
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 52.97
atom chem shift.val err: 0.12

1,17946,1327
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1327
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 44.01
atom chem shift.val err: 0.10

1,17946,1328
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1328
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 25.52
atom chem shift.val err: 0.18

1,17946,1329
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1329
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 22.81
atom chem shift.val err: 0.14

1,17946,1330
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1330
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 25.70
atom chem shift.val err: 0.13

1,17946,1331
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1331
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 112
atom chem shift.comp id: LEU
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 119.83
atom chem shift.val err: 0.07

1,17946,1332
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1332
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 9.63
atom chem shift.val err: 0.01

1,17946,1333
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1333
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 4.69
atom chem shift.val err: 0.01

1,17946,1334
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1334
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 2.86
atom chem shift.val err: 0.02

1,17946,1335
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1335
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 3.33
atom chem shift.val err: 0.01

1,17946,1336
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1336
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 174.66
atom chem shift.val err: 0.03

1,17946,1337
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1337
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 55.58
atom chem shift.val err: 0.14

1,17946,1338
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1338
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 38.09
atom chem shift.val err: 0.09

1,17946,1339
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1339
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 113
atom chem shift.comp id: TYR
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 125.78
atom chem shift.val err: 0.06

1,17946,1340
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1340
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 8.64
atom chem shift.val err: 0.01

1,17946,1341
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1341
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 5.03
atom chem shift.val err: 0.01

1,17946,1342
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1342
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 0.28
atom chem shift.val err: 0.02

1,17946,1343
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1343
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 1.40
atom chem shift.val err: 0.01

1,17946,1344
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1344
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 0.90
atom chem shift.val err: 0.02

1,17946,1345
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1345
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1346
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1346
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1347
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1347
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1348
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1348
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1349
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1349
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1350
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1350
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: -0.21
atom chem shift.val err: 0.01

1,17946,1351
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1351
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 175.33
atom chem shift.val err: 0.01

1,17946,1352
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1352
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 52.89
atom chem shift.val err: 0.09

1,17946,1353
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1353
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 44.25
atom chem shift.val err: 0.14

1,17946,1354
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1354
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 25.55
atom chem shift.val err: 0.08

1,17946,1355
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1355
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 25.55
atom chem shift.val err: 0.12

1,17946,1356
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1356
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 22.46
atom chem shift.val err: 0.21

1,17946,1357
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1357
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 114
atom chem shift.comp id: LEU
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 122.48
atom chem shift.val err: 0.05

1,17946,1358
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1358
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 8.47
atom chem shift.val err: 0.01

1,17946,1359
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1359
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 5.35
atom chem shift.val err: 0.01

1,17946,1360
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1360
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 3.85
atom chem shift.val err: 0.01

1,17946,1361
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1361
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 1.08
atom chem shift.val err: 0.01

1,17946,1362
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1362
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 1.08
atom chem shift.val err: 0.01

1,17946,1363
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1363
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 1.08
atom chem shift.val err: 0.01

1,17946,1364
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1364
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 173.55
atom chem shift.val err: 0.01

1,17946,1365
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1365
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
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atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 60.21
atom chem shift.val err: 0.10

1,17946,1366
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1366
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 69.14
atom chem shift.val err: 0.26

1,17946,1367
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1367
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 25.27
atom chem shift.val err: 0.10

1,17946,1368
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1368
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 115
atom chem shift.comp id: THR
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 119.50
atom chem shift.val err: 0.13

1,17946,1369
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1369
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 9.41
atom chem shift.val err: 0.01

1,17946,1370
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1370
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 5.04
atom chem shift.val err: 0.01

1,17946,1371
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1371
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 2.91
atom chem shift.val err: 0.01

1,17946,1372
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1372
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 2.91
atom chem shift.val err: 0.01

1,17946,1373
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1373
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 175.30
atom chem shift.val err: 0.01

1,17946,1374
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1374
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 55.46
atom chem shift.val err: 0.13

1,17946,1375
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1375
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 31.06
atom chem shift.val err: 0.13

1,17946,1376
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1376
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 116
atom chem shift.comp id: HIS
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 126.28
atom chem shift.val err: 0.06

1,17946,1377
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1377
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 9.33
atom chem shift.val err: 0.01

1,17946,1378
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1378
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 4.07
atom chem shift.val err: 0.01

1,17946,1379
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1379
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 117
atom chem shift.val: 0.80
atom chem shift.val err: 0.01

1,17946,1380
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1380
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 117
atom chem shift.val: 0.12
atom chem shift.val err: 0.01

1,17946,1381
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1381
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 0.73
atom chem shift.val err: 0.01

1,17946,1382
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1382
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 0.25
atom chem shift.val err: 0.00

1,17946,1383
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1383
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 0.25
atom chem shift.val err: 0.00

1,17946,1384
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1384
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 0.25
atom chem shift.val err: 0.00

1,17946,1385
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1385
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: -0.72
atom chem shift.val err: 0.01

1,17946,1386
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1386
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: -0.72
atom chem shift.val err: 0.01

1,17946,1387
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1387
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: -0.72
atom chem shift.val err: 0.01

1,17946,1388
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1388
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 176.13
atom chem shift.val err: 0.01

1,17946,1389
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1389
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 60.36
atom chem shift.val err: 0.12

1,17946,1390
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1390
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 39.20
atom chem shift.val err: 0.13

1,17946,1391
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1391
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 26.53
atom chem shift.val err: 0.23

1,17946,1392
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1392
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: C
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 18.38
atom chem shift.val err: 0.20

1,17946,1393
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1393
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 12.75
atom chem shift.val err: 0.13

1,17946,1394
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1394
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 117
atom chem shift.comp id: ILE
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 127.92
atom chem shift.val err: 0.07

1,17946,1395
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1395
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atom chem shift.auth comp id: GLU
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 8.50
atom chem shift.val err: 0.01

1,17946,1396
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1396
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 4.29
atom chem shift.val err: 0.01

1,17946,1397
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1397
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 1.91
atom chem shift.val err: 0.01

1,17946,1398
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1398
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 2.22
atom chem shift.val err: 0.01

1,17946,1399
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1399
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 2.22
atom chem shift.val err: 0.01

1,17946,1400
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1400
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 2.22
atom chem shift.val err: 0.01

1,17946,1401
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1401
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 173.29
atom chem shift.val err: 0.01

1,17946,1402
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1402
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 55.61
atom chem shift.val err: 0.08

1,17946,1403
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1403
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 27.88
atom chem shift.val err: 0.13

1,17946,1404
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1404
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 36.06
atom chem shift.val err: 0.17

1,17946,1405
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1405
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 118
atom chem shift.comp id: GLU
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 129.98
atom chem shift.val err: 0.07

1,17946,1406
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1406
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 7.69
atom chem shift.val err: 0.01

1,17946,1407
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1407
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 4.31
atom chem shift.val err: 0.01

1,17946,1408
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1408
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.89
atom chem shift.val err: 0.00

1,17946,1409
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1409
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.89
atom chem shift.val err: 0.00

1,17946,1410
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1410
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.93
atom chem shift.val err: 0.00

1,17946,1411
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1411
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.50
atom chem shift.val err: 0.01

1,17946,1412
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1412
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.50
atom chem shift.val err: 0.01

1,17946,1413
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1413
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.50
atom chem shift.val err: 0.01

1,17946,1414
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1414
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.62
atom chem shift.val err: 0.00

1,17946,1415
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1415
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.62
atom chem shift.val err: 0.00

1,17946,1416
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1416
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 0.62
atom chem shift.val err: 0.00

1,17946,1417
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1417
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 173.72
atom chem shift.val err: 0.01

1,17946,1418
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1418
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 54.82
atom chem shift.val err: 0.12

1,17946,1419
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1419
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 45.98
atom chem shift.val err: 0.10

1,17946,1420
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1420
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 27.22
atom chem shift.val err: 0.00

1,17946,1421
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1421
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 26.31
atom chem shift.val err: 0.17

1,17946,1422
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1422
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 21.93
atom chem shift.val err: 0.10

1,17946,1423
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1423
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 119
atom chem shift.comp id: LEU
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 128.23
atom chem shift.val err: 0.04

1,17946,1424
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1424
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 8.98
atom chem shift.val err: 0.01

1,17946,1425
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1425
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 4.82
atom chem shift.val err: 0.01

1,17946,1426
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1426
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 4.06
atom chem shift.val err: 0.01

1,17946,1427
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1427
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 1.21
atom chem shift.val err: 0.01

1,17946,1428
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1428
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 1.21
atom chem shift.val err: 0.01

1,17946,1429
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1429
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 1.21
atom chem shift.val err: 0.01

1,17946,1430
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1430
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 172.65
atom chem shift.val err: 0.02

1,17946,1431
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1431
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 61.89
atom chem shift.val err: 0.07

1,17946,1432
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1432
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 69.06
atom chem shift.val err: 0.15

1,17946,1433
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1433
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 21.92
atom chem shift.val err: 0.00

1,17946,1434
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1434
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 120
atom chem shift.comp id: THR
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 125.70
atom chem shift.val err: 0.05

1,17946,1435
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1435
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 8.89
atom chem shift.val err: 0.01

1,17946,1436
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1436
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 4.76
atom chem shift.val err: 0.02

1,17946,1437
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1437
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 3.80
atom chem shift.val err: 0.01

1,17946,1438
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1438
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 1.13
atom chem shift.val err: 0.02

1,17946,1439
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1439
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 1.13
atom chem shift.val err: 0.02

1,17946,1440
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1440
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 1.13
atom chem shift.val err: 0.02

1,17946,1441
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1441
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 171.91
atom chem shift.val err: 0.02

1,17946,1442
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1442
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 59.67
atom chem shift.val err: 0.07

1,17946,1443
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1443
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 70.24
atom chem shift.val err: 0.09

1,17946,1444
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1444
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 19.77
atom chem shift.val err: 0.00

1,17946,1445
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1445
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 121
atom chem shift.comp id: THR
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 122.56
atom chem shift.val err: 0.05

1,17946,1446
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1446
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 8.18
atom chem shift.val err: 0.00

1,17946,1447
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1447
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 4.38
atom chem shift.val err: 0.01

1,17946,1448
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1448
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 2.02
atom chem shift.val err: 0.00

1,17946,1449
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1449
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 2.02
atom chem shift.val err: 0.00

1,17946,1450
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1450
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 2.37
atom chem shift.val err: 0.02

1,17946,1451
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1451
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 2.37
atom chem shift.val err: 0.02

1,17946,1452
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1452
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 175.64
atom chem shift.val err: 0.01

1,17946,1453
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1453
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 57.42
atom chem shift.val err: 0.13

1,17946,1454
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1454
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 30.36
atom chem shift.val err: 0.12

1,17946,1455
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1455
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 36.52
atom chem shift.val err: 0.11

1,17946,1456
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1456
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 122
atom chem shift.comp id: GLU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 126.47
atom chem shift.val err: 0.08

1,17946,1457
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1457
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 123
atom chem shift.comp id: GLY
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 8.45
atom chem shift.val err: 0.01

1,17946,1458
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1458
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 123
atom chem shift.comp id: GLY
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 3.51
atom chem shift.val err: 0.01

1,17946,1459
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1459
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 123
atom chem shift.comp id: GLY
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 4.74
atom chem shift.val err: 0.00

1,17946,1460
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1460
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 123
atom chem shift.comp id: GLY
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 171.66
atom chem shift.val err: 0.02

1,17946,1461
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1461
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 123
atom chem shift.comp id: GLY
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 45.30
atom chem shift.val err: 0.06

1,17946,1462
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1462
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 123
atom chem shift.comp id: GLY
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 105.69
atom chem shift.val err: 0.08

1,17946,1463
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1463
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 8.60
atom chem shift.val err: 0.01

1,17946,1464
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1464
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 4.41
atom chem shift.val err: 0.02

1,17946,1465
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1465
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 2.46
atom chem shift.val err: 0.01

1,17946,1466
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1466
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 3.18
atom chem shift.val err: 0.01

1,17946,1467
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1467
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 175.01
atom chem shift.val err: 0.05

1,17946,1468
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1468
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 52.96
atom chem shift.val err: 0.08

1,17946,1469
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1469
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 42.45
atom chem shift.val err: 0.27

1,17946,1470
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1470
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 124
atom chem shift.comp id: ASP
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 114.67
atom chem shift.val err: 0.09

1,17946,1471
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1471
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 6.53
atom chem shift.val err: 0.01

1,17946,1472
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1472
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 4.30
atom chem shift.val err: 0.02

1,17946,1473
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1473
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 3.49
atom chem shift.val err: 0.01

1,17946,1474
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1474
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 1.31
atom chem shift.val err: 0.03

1,17946,1475
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1475
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 1.31
atom chem shift.val err: 0.03

1,17946,1476
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1476
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 1.31
atom chem shift.val err: 0.03

1,17946,1477
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1477
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 173.21
atom chem shift.val err: 0.01

1,17946,1478
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1478
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 61.35
atom chem shift.val err: 0.14

1,17946,1479
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1479
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 72.89
atom chem shift.val err: 0.13

1,17946,1480
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1480
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 24.42
atom chem shift.val err: 0.05

1,17946,1481
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1481
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 125
atom chem shift.comp id: THR
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 111.21
atom chem shift.val err: 0.07

1,17946,1482
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1482
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 9.12
atom chem shift.val err: 0.01

1,17946,1483
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1483
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 5.46
atom chem shift.val err: 0.01

1,17946,1484
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1484
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 2.97
atom chem shift.val err: 0.01

1,17946,1485
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1485
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 3.22
atom chem shift.val err: 0.01

1,17946,1486
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1486
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 175.00
atom chem shift.val err: 0.04

1,17946,1487
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1487
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 58.62
atom chem shift.val err: 0.16

1,17946,1488
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1488
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 32.94
atom chem shift.val err: 0.16

1,17946,1489
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1489
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 125.27
atom chem shift.val err: 0.10

1,17946,1490
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1490
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE1
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE1
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 126
atom chem shift.comp id: TRP
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 130.42
atom chem shift.val err: 0.03

1,17946,1491
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1491
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 9.47
atom chem shift.val err: 0.01

1,17946,1492
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1492
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 4.45
atom chem shift.val err: 0.00

1,17946,1493
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1493
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 2.36
atom chem shift.val err: 0.01

1,17946,1494
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1494
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 2.71
atom chem shift.val err: 0.03

1,17946,1495
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1495
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 56.92
atom chem shift.val err: 0.02

1,17946,1496
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1496
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 41.72
atom chem shift.val err: 0.13

1,17946,1497
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1497
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 127
atom chem shift.comp id: PHE
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 125.83
atom chem shift.val err: 0.06

1,17946,1498
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1498
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 4.50
atom chem shift.val err: 0.01

1,17946,1499
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1499
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 1.74
atom chem shift.val err: 0.01

1,17946,1500
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1500
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 2.50
atom chem shift.val err: 0.02

1,17946,1501
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1501
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 1.02
atom chem shift.val err: 0.01

1,17946,1502
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1502
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 1.42
atom chem shift.val err: 0.01

1,17946,1503
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1503
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,1504
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1504
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,1505
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1505
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 174.55
atom chem shift.val err: 0.01

1,17946,1506
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1506
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 62.21
atom chem shift.val err: 0.19

1,17946,1507
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1507
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 31.89
atom chem shift.val err: 0.19

1,17946,1508
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1508
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 27.08
atom chem shift.val err: 0.28

1,17946,1509
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1509
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 128
atom chem shift.comp id: PRO
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 49.68
atom chem shift.val err: 0.29

1,17946,1510
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1510
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 8.45
atom chem shift.val err: 0.01

1,17946,1511
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1511
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 4.50
atom chem shift.val err: 0.01

1,17946,1512
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1512
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 2.43
atom chem shift.val err: 0.01

1,17946,1513
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1513
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 2.76
atom chem shift.val err: 0.01

1,17946,1514
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1514
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 176.52
atom chem shift.val err: 0.02

1,17946,1515
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1515
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 53.47
atom chem shift.val err: 0.13

1,17946,1516
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1516
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 39.16
atom chem shift.val err: 0.10

1,17946,1517
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1517
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 129
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 115.40
atom chem shift.val err: 0.13

1,17946,1518
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1518
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 8.33
atom chem shift.val err: 0.01

1,17946,1519
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1519
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 4.77
atom chem shift.val err: 0.03

1,17946,1520
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1520
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 2.75
atom chem shift.val err: 0.01

1,17946,1521
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1521
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 3.19
atom chem shift.val err: 0.01

1,17946,1522
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1522
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 176.25
atom chem shift.val err: 0.00

1,17946,1523
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1523
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 58.22
atom chem shift.val err: 0.20

1,17946,1524
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1524
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 38.33
atom chem shift.val err: 0.37

1,17946,1525
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1525
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 130
atom chem shift.comp id: TYR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 124.86
atom chem shift.val err: 0.06

1,17946,1526
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1526
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 8.24
atom chem shift.val err: 0.01

1,17946,1527
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1527
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 4.32
atom chem shift.val err: 0.01

1,17946,1528
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1528
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 1.81
atom chem shift.val err: 0.01

1,17946,1529
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1529
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 1.81
atom chem shift.val err: 0.01

1,17946,1530
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1530
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 1.47
atom chem shift.val err: 0.01

1,17946,1531
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1531
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 1.80
atom chem shift.val err: 0.01

1,17946,1532
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1532
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 175.66
atom chem shift.val err: 0.06

1,17946,1533
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1533
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 58.53
atom chem shift.val err: 0.19

1,17946,1534
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1534
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 28.65
atom chem shift.val err: 0.12

1,17946,1535
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1535
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 37.69
atom chem shift.val err: 0.08

1,17946,1536
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1536
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLU
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 123.47
atom chem shift.val err: 0.11

1,17946,1537
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1537
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 7.26
atom chem shift.val err: 0.01

1,17946,1538
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1538
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 4.06
atom chem shift.val err: 0.01

1,17946,1539
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1539
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 1.68
atom chem shift.val err: 0.01

1,17946,1540
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1540
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 1.68
atom chem shift.val err: 0.01

1,17946,1541
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1541
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 1.42
atom chem shift.val err: 0.01

1,17946,1542
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1542
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 1.88
atom chem shift.val err: 0.01

1,17946,1543
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1543
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 6.79
atom chem shift.val err: 0.02

1,17946,1544
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1544
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 7.44
atom chem shift.val err: 0.01

1,17946,1545
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1545
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 175.20
atom chem shift.val err: 0.01

1,17946,1546
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1546
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 56.89
atom chem shift.val err: 0.08

1,17946,1547
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1547
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 28.71
atom chem shift.val err: 0.11

1,17946,1548
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1548
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 33.09
atom chem shift.val err: 0.08

1,17946,1549
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1549
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 180.16
atom chem shift.val err: 0.01

1,17946,1550
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1550
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 116.07
atom chem shift.val err: 0.06

1,17946,1551
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1551
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 132
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 111.11
atom chem shift.val err: 0.22

1,17946,1552
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1552
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 7.69
atom chem shift.val err: 0.02

1,17946,1553
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1553
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 4.68
atom chem shift.val err: 0.01

1,17946,1554
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1554
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 2.72
atom chem shift.val err: 0.02

1,17946,1555
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1555
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 2.72
atom chem shift.val err: 0.02

1,17946,1556
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1556
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 172.36
atom chem shift.val err: 0.01

1,17946,1557
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1557
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 55.90
atom chem shift.val err: 0.14

1,17946,1558
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1558
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 39.64
atom chem shift.val err: 0.16

1,17946,1559
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1559
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 133
atom chem shift.comp id: TYR
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 119.56
atom chem shift.val err: 0.05

1,17946,1560
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1560
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 8.13
atom chem shift.val err: 0.01

1,17946,1561
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1561
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 4.98
atom chem shift.val err: 0.01

1,17946,1562
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1562
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 2.72
atom chem shift.val err: 0.01

1,17946,1563
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1563
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 2.72
atom chem shift.val err: 0.01

1,17946,1564
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1564
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 6.95
atom chem shift.val err: 0.02

1,17946,1565
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1565
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 7.61
atom chem shift.val err: 0.01

1,17946,1566
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1566
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 173.77
atom chem shift.val err: 0.00

1,17946,1567
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1567
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 52.66
atom chem shift.val err: 0.15

1,17946,1568
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1568
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 39.44
atom chem shift.val err: 0.10

1,17946,1569
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1569
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 176.79
atom chem shift.val err: 0.01

1,17946,1570
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1570
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 116.49
atom chem shift.val err: 0.04

1,17946,1571
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1571
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 134
atom chem shift.comp id: ASN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 112.88
atom chem shift.val err: 0.20

1,17946,1572
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1572
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 8.53
atom chem shift.val err: 0.01

1,17946,1573
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1573
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 5.21
atom chem shift.val err: 0.01

1,17946,1574
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1574
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 2.94
atom chem shift.val err: 0.01

1,17946,1575
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1575
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 3.21
atom chem shift.val err: 0.02

1,17946,1576
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1576
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 175.76
atom chem shift.val err: 0.03

1,17946,1577
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1577
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 55.54
atom chem shift.val err: 0.14

1,17946,1578
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1578
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 34.92
atom chem shift.val err: 0.19

1,17946,1579
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1579
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 121.78
atom chem shift.val err: 0.04

1,17946,1580
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1580
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE1
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE1
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 135
atom chem shift.comp id: TRP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 129.99
atom chem shift.val err: 0.05

1,17946,1581
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1581
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 9.57
atom chem shift.val err: 0.00

1,17946,1582
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1582
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 4.81
atom chem shift.val err: 0.01

1,17946,1583
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1583
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 2.01
atom chem shift.val err: 0.02

1,17946,1584
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1584
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 2.01
atom chem shift.val err: 0.02

1,17946,1585
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1585
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 2.27
atom chem shift.val err: 0.01

1,17946,1586
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1586
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 2.29
atom chem shift.val err: 0.01

1,17946,1587
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1587
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 6.87
atom chem shift.val err: 0.01

1,17946,1588
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1588
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
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atom chem shift.atom type: H
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 7.55
atom chem shift.val err: 0.02

1,17946,1589
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1589
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 174.56
atom chem shift.val err: 0.01

1,17946,1590
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1590
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 53.81
atom chem shift.val err: 0.07

1,17946,1591
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1591
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: C
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 31.22
atom chem shift.val err: 0.05

1,17946,1592
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1592
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 33.04
atom chem shift.val err: 0.10

1,17946,1593
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1593
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 179.89
atom chem shift.val err: 0.03

1,17946,1594
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1594
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 121.23
atom chem shift.val err: 0.05

1,17946,1595
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1595
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 136
atom chem shift.comp id: GLN
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 111.78
atom chem shift.val err: 0.23

1,17946,1596
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1596
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 9.18
atom chem shift.val err: 0.01

1,17946,1597
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1597
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 4.82
atom chem shift.val err: 0.01

1,17946,1598
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1598
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 1.99
atom chem shift.val err: 0.02

1,17946,1599
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1599
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 2.15
atom chem shift.val err: 0.02

1,17946,1600
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1600
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HG2
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 1.97
atom chem shift.val err: 0.01

1,17946,1601
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1601
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: GLU
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 2.13
atom chem shift.val err: 0.01

1,17946,1602
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1602
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 176.51
atom chem shift.val err: 0.01

1,17946,1603
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1603
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.atom type: C
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 56.75
atom chem shift.val err: 0.04

1,17946,1604
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1604
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 30.83
atom chem shift.val err: 0.20

1,17946,1605
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1605
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 38.22
atom chem shift.val err: 0.12

1,17946,1606
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1606
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 137
atom chem shift.comp id: GLU
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 127.62
atom chem shift.val err: 0.05

1,17946,1607
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1607
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 9.34
atom chem shift.val err: 0.01

1,17946,1608
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1608
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 4.45
atom chem shift.val err: 0.00

1,17946,1609
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1609
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 2.00
atom chem shift.val err: 0.01

1,17946,1610
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1610
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ILE
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 1.21
atom chem shift.val err: 0.02

1,17946,1611
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1611
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG13
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 1.30
atom chem shift.val err: 0.02

1,17946,1612
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1612
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 0.96
atom chem shift.val err: 0.01

1,17946,1613
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1613
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 0.96
atom chem shift.val err: 0.01

1,17946,1614
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1614
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 0.96
atom chem shift.val err: 0.01

1,17946,1615
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1615
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 0.76
atom chem shift.val err: 0.02

1,17946,1616
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1616
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 0.76
atom chem shift.val err: 0.02

1,17946,1617
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1617
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 0.76
atom chem shift.val err: 0.02

1,17946,1618
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1618
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 176.14
atom chem shift.val err: 0.01

1,17946,1619
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1619
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 61.50
atom chem shift.val err: 0.14

1,17946,1620
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1620
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 39.08
atom chem shift.val err: 0.11

1,17946,1621
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1621
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 26.73
atom chem shift.val err: 0.20

1,17946,1622
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1622
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 17.85
atom chem shift.val err: 0.20

1,17946,1623
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1623
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 12.10
atom chem shift.val err: 0.13

1,17946,1624
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1624
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 138
atom chem shift.comp id: ILE
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 125.41
atom chem shift.val err: 0.05

1,17946,1625
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1625
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 7.48
atom chem shift.val err: 0.01

1,17946,1626
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1626
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 4.68
atom chem shift.val err: 0.01

1,17946,1627
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1627
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 1.99
atom chem shift.val err: 0.01

1,17946,1628
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1628
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 2.15
atom chem shift.val err: 0.01

1,17946,1629
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1629
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 2.24
atom chem shift.val err: 0.02

1,17946,1630
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1630
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 2.28
atom chem shift.val err: 0.01

1,17946,1631
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1631
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 174.31
atom chem shift.val err: 0.02

1,17946,1632
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1632
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 55.71
atom chem shift.val err: 0.08

1,17946,1633
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1633
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 33.87
atom chem shift.val err: 0.05

1,17946,1634
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1634
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 36.17
atom chem shift.val err: 0.10

1,17946,1635
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1635
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 139
atom chem shift.comp id: GLU
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 118.38
atom chem shift.val err: 0.05

1,17946,1636
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1636
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 8.52
atom chem shift.val err: 0.01

1,17946,1637
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1637
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 5.51
atom chem shift.val err: 0.01

1,17946,1638
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1638
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 3.15
atom chem shift.val err: 0.02

1,17946,1639
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1639
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 3.17
atom chem shift.val err: 0.02

1,17946,1640
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1640
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 173.16
atom chem shift.val err: 0.01

1,17946,1641
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1641
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 55.27
atom chem shift.val err: 0.10

1,17946,1642
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1642
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 31.64
atom chem shift.val err: 0.08

1,17946,1643
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1643
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 140
atom chem shift.comp id: HIS
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 116.82
atom chem shift.val err: 0.07

1,17946,1644
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1644
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 8.87
atom chem shift.val err: 0.01

1,17946,1645
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1645
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 4.46
atom chem shift.val err: 0.00

1,17946,1646
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1646
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 1.86
atom chem shift.val err: 0.01

1,17946,1647
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1647
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 2.15
atom chem shift.val err: 0.00

1,17946,1648
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1648
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 1.98
atom chem shift.val err: 0.03

1,17946,1649
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1649
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 2.01
atom chem shift.val err: 0.03

1,17946,1650
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1650
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 174.03
atom chem shift.val err: 0.02

1,17946,1651
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1651
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 56.09
atom chem shift.val err: 0.12

1,17946,1652
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1652
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 34.08
atom chem shift.val err: 0.11

1,17946,1653
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1653
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 35.53
atom chem shift.val err: 0.14

1,17946,1654
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1654
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 141
atom chem shift.comp id: GLU
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 120.53
atom chem shift.val err: 0.09

1,17946,1655
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1655
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 8.82
atom chem shift.val err: 0.01

1,17946,1656
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1656
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 4.78
atom chem shift.val err: 0.01

1,17946,1657
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1657
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 3.63
atom chem shift.val err: 0.01

1,17946,1658
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1658
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 3.78
atom chem shift.val err: 0.00

1,17946,1659
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1659
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 172.12
atom chem shift.val err: 0.01

1,17946,1660
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1660
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 58.38
atom chem shift.val err: 0.07

1,17946,1661
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1661
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 64.54
atom chem shift.val err: 0.16

1,17946,1662
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1662
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 142
atom chem shift.comp id: SER
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 120.16
atom chem shift.val err: 0.10

1,17946,1663
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1663
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 8.77
atom chem shift.val err: 0.01

1,17946,1664
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1664
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 4.35
atom chem shift.val err: 0.01

1,17946,1665
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1665
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 1.14
atom chem shift.val err: 0.01

1,17946,1666
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1666
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 2.12
atom chem shift.val err: 0.01

1,17946,1667
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1667
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 174.29
atom chem shift.val err: 0.02

1,17946,1668
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1668
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 57.37
atom chem shift.val err: 0.14

1,17946,1669
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1669
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 39.31
atom chem shift.val err: 0.11

1,17946,1670
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1670
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 143
atom chem shift.comp id: TYR
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 123.28
atom chem shift.val err: 0.04

1,17946,1671
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1671
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 8.30
atom chem shift.val err: 0.01

1,17946,1672
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1672
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 4.61
atom chem shift.val err: 0.01

1,17946,1673
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1673
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 1.35
atom chem shift.val err: 0.00

1,17946,1674
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1674
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 1.35
atom chem shift.val err: 0.00

1,17946,1675
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1675
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 1.35
atom chem shift.val err: 0.00

1,17946,1676
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1676
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 177.45
atom chem shift.val err: 0.00

1,17946,1677
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1677
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 50.57
atom chem shift.val err: 0.09

1,17946,1678
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1678
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 20.53
atom chem shift.val err: 0.11

1,17946,1679
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1679
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 144
atom chem shift.comp id: ALA
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 127.26
atom chem shift.val err: 0.05

1,17946,1680
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1680
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 8.26
atom chem shift.val err: 0.01

1,17946,1681
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1681
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 4.36
atom chem shift.val err: 0.01

1,17946,1682
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1682
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 1.16
atom chem shift.val err: 0.01

1,17946,1683
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1683
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 1.16
atom chem shift.val err: 0.01

1,17946,1684
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1684
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB#
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 1.16
atom chem shift.val err: 0.01

1,17946,1685
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1685
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 177.49
atom chem shift.val err: 0.03

1,17946,1686
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1686
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 52.38
atom chem shift.val err: 0.20

1,17946,1687
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1687
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 19.67
atom chem shift.val err: 0.14

1,17946,1688
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1688
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 145
atom chem shift.comp id: ALA
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 123.33
atom chem shift.val err: 0.05

1,17946,1689
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1689
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 8.72
atom chem shift.val err: 0.01

1,17946,1690
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1690
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 4.66
atom chem shift.val err: 0.01

1,17946,1691
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1691
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 2.79
atom chem shift.val err: 0.01

1,17946,1692
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1692
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 3.15
atom chem shift.val err: 0.01

1,17946,1693
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1693
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 176.63
atom chem shift.val err: 0.00

1,17946,1694
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1694
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 52.96
atom chem shift.val err: 0.14

1,17946,1695
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1695
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 41.66
atom chem shift.val err: 0.10

1,17946,1696
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1696
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 146
atom chem shift.comp id: ASP
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 121.46
atom chem shift.val err: 0.06

1,17946,1697
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1697
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 8.41
atom chem shift.val err: 0.01

1,17946,1698
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1698
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 4.25
atom chem shift.val err: 0.01

1,17946,1699
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1699
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 2.67
atom chem shift.val err: 0.01

1,17946,1700
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1700
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 2.67
atom chem shift.val err: 0.01

1,17946,1701
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1701
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 177.24
atom chem shift.val err: 0.02

1,17946,1702
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1702
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 56.92
atom chem shift.val err: 0.12

1,17946,1703
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1703
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 40.11
atom chem shift.val err: 0.06

1,17946,1704
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1704
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 147
atom chem shift.comp id: ASP
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 115.54
atom chem shift.val err: 0.03

1,17946,1705
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1705
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 7.88
atom chem shift.val err: 0.01

1,17946,1706
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1706
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 4.44
atom chem shift.val err: 0.01

1,17946,1707
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1707
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 1.69
atom chem shift.val err: 0.01

1,17946,1708
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1708
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 1.88
atom chem shift.val err: 0.01

1,17946,1709
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1709
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 1.43
atom chem shift.val err: 0.02

1,17946,1710
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1710
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 1.43
atom chem shift.val err: 0.02

1,17946,1711
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1711
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 1.67
atom chem shift.val err: 0.01

1,17946,1712
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1712
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 1.67
atom chem shift.val err: 0.01

1,17946,1713
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1713
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 2.98
atom chem shift.val err: 0.01

1,17946,1714
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1714
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 2.98
atom chem shift.val err: 0.01

1,17946,1715
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1715
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 175.25
atom chem shift.val err: 0.01

1,17946,1716
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1716
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 55.88
atom chem shift.val err: 0.09

1,17946,1717
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1717
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 34.34
atom chem shift.val err: 0.11

1,17946,1718
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1718
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 25.21
atom chem shift.val err: 0.02

1,17946,1719
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1719
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 28.81
atom chem shift.val err: 0.11

1,17946,1720
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1720
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 42.24
atom chem shift.val err: 0.25

1,17946,1721
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1721
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 148
atom chem shift.comp id: LYS
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 116.96
atom chem shift.val err: 0.03

1,17946,1722
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1722
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 7.81
atom chem shift.val err: 0.01

1,17946,1723
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1723
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 5.29
atom chem shift.val err: 0.01

1,17946,1724
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1724
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 2.27
atom chem shift.val err: 0.01

1,17946,1725
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1725
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 3.11
atom chem shift.val err: 0.01

1,17946,1726
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1726
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 6.92
atom chem shift.val err: 0.01

1,17946,1727
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1727
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 8.53
atom chem shift.val err: 0.01

1,17946,1728
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1728
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 173.18
atom chem shift.val err: 0.00

1,17946,1729
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1729
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 50.96
atom chem shift.val err: 0.19

1,17946,1730
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1730
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 41.18
atom chem shift.val err: 0.23

1,17946,1731
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1731
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 176.51
atom chem shift.val err: 0.08

1,17946,1732
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1732
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 118.01
atom chem shift.val err: 0.03

1,17946,1733
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1733
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 149
atom chem shift.comp id: ASN
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 117.72
atom chem shift.val err: 0.26

1,17946,1734
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1734
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 4.49
atom chem shift.val err: 0.01

1,17946,1735
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1735
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 1.52
atom chem shift.val err: 0.02

1,17946,1736
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1736
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 2.13
atom chem shift.val err: 0.01

1,17946,1737
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1737
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 1.50
atom chem shift.val err: 0.02

1,17946,1738
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1738
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 1.92
atom chem shift.val err: 0.01

1,17946,1739
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1739
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 3.65
atom chem shift.val err: 0.01

1,17946,1740
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1740
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 3.75
atom chem shift.val err: 0.01

1,17946,1741
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1741
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 174.87
atom chem shift.val err: 0.00

1,17946,1742
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1742
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 65.11
atom chem shift.val err: 0.12

1,17946,1743
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1743
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 31.80
atom chem shift.val err: 0.17

1,17946,1744
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1744
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 26.79
atom chem shift.val err: 0.06

1,17946,1745
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1745
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 150
atom chem shift.comp id: PRO
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 50.87
atom chem shift.val err: 0.24

1,17946,1746
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1746
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 6.70
atom chem shift.val err: 0.01

1,17946,1747
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1747
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 5.12
atom chem shift.val err: 0.01

1,17946,1748
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1748
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 2.45
atom chem shift.val err: 0.01

1,17946,1749
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1749
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 3.08
atom chem shift.val err: 0.01

1,17946,1750
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1750
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 173.48
atom chem shift.val err: 0.02

1,17946,1751
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1751
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 53.38
atom chem shift.val err: 0.22

1,17946,1752
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1752
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 33.01
atom chem shift.val err: 0.06

1,17946,1753
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1753
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 151
atom chem shift.comp id: HIS
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 115.35
atom chem shift.val err: 0.05

1,17946,1754
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1754
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 8.95
atom chem shift.val err: 0.00

1,17946,1755
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1755
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 4.75
atom chem shift.val err: 0.00

1,17946,1756
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1756
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 2.75
atom chem shift.val err: 0.01

1,17946,1757
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1757
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 2.98
atom chem shift.val err: 0.01

1,17946,1758
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1758
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 6.94
atom chem shift.val err: 0.01

1,17946,1759
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1759
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 7.76
atom chem shift.val err: 0.01

1,17946,1760
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1760
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 174.82
atom chem shift.val err: 0.01

1,17946,1761
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1761
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 53.14
atom chem shift.val err: 0.06

1,17946,1762
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1762
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 39.04
atom chem shift.val err: 0.08

1,17946,1763
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1763
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 176.53
atom chem shift.val err: 0.01

1,17946,1764
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1764
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 118.90
atom chem shift.val err: 0.05

1,17946,1765
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1765
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 152
atom chem shift.comp id: ASN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 114.47
atom chem shift.val err: 0.17

1,17946,1766
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1766
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 8.17
atom chem shift.val err: 0.01

1,17946,1767
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1767
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 5.40
atom chem shift.val err: 0.01

1,17946,1768
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1768
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 2.50
atom chem shift.val err: 0.01

1,17946,1769
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1769
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 2.85
atom chem shift.val err: 0.00

1,17946,1770
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1770
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 172.58
atom chem shift.val err: 0.05

1,17946,1771
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1771
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 56.18
atom chem shift.val err: 0.14

1,17946,1772
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1772
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 40.46
atom chem shift.val err: 0.10

1,17946,1773
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1773
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 153
atom chem shift.comp id: TYR
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 113.98
atom chem shift.val err: 0.04

1,17946,1774
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1774
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 8.82
atom chem shift.val err: 0.01

1,17946,1775
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1775
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 5.34
atom chem shift.val err: 0.01

1,17946,1776
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1776
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 1.85
atom chem shift.val err: 0.01

1,17946,1777
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1777
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 1.85
atom chem shift.val err: 0.01

1,17946,1778
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1778
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 1.62
atom chem shift.val err: 0.01

1,17946,1779
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1779
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 1.62
atom chem shift.val err: 0.01

1,17946,1780
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1780
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,1781
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1781
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 3.12
atom chem shift.val err: 0.01

1,17946,1782
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1782
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 174.08
atom chem shift.val err: 0.02

1,17946,1783
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1783
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 54.58
atom chem shift.val err: 0.23

1,17946,1784
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1784
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 33.65
atom chem shift.val err: 0.19

1,17946,1785
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1785
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 27.65
atom chem shift.val err: 0.14

1,17946,1786
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1786
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 43.58
atom chem shift.val err: 0.07

1,17946,1787
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1787
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 154
atom chem shift.comp id: ARG
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 119.52
atom chem shift.val err: 0.20

1,17946,1788
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1788
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 9.79
atom chem shift.val err: 0.00

1,17946,1789
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1789
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 5.48
atom chem shift.val err: 0.03

1,17946,1790
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1790
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 3.02
atom chem shift.val err: 0.01

1,17946,1791
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1791
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 3.32
atom chem shift.val err: 0.01

1,17946,1792
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1792
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 173.82
atom chem shift.val err: 0.05

1,17946,1793
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1793
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 56.92
atom chem shift.val err: 0.09

1,17946,1794
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1794
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 42.98
atom chem shift.val err: 0.19

1,17946,1795
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1795
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 155
atom chem shift.comp id: PHE
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 127.50
atom chem shift.val err: 0.07

1,17946,1796
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1796
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 8.80
atom chem shift.val err: 0.02

1,17946,1797
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1797
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 4.58
atom chem shift.val err: 0.01

1,17946,1798
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1798
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 3.50
atom chem shift.val err: 0.02

1,17946,1799
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1799
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 3.52
atom chem shift.val err: 0.01

1,17946,1800
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1800
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 169.90
atom chem shift.val err: 0.00

1,17946,1801
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1801
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 56.82
atom chem shift.val err: 0.08

1,17946,1802
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1802
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 65.56
atom chem shift.val err: 0.05

1,17946,1803
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1803
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 156
atom chem shift.comp id: SER
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 124.33
atom chem shift.val err: 0.11

1,17946,1804
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1804
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 7.86
atom chem shift.val err: 0.01

1,17946,1805
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1805
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 4.82
atom chem shift.val err: 0.02

1,17946,1806
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1806
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 1.18
atom chem shift.val err: 0.01

1,17946,1807
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1807
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 1.70
atom chem shift.val err: 0.01

1,17946,1808
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1808
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.97
atom chem shift.val err: 0.01

1,17946,1809
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1809
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.19
atom chem shift.val err: 0.01

1,17946,1810
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1810
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.19
atom chem shift.val err: 0.01

1,17946,1811
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1811
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.19
atom chem shift.val err: 0.01

1,17946,1812
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1812
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.56
atom chem shift.val err: 0.01

1,17946,1813
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1813
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.56
atom chem shift.val err: 0.01

1,17946,1814
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1814
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 0.56
atom chem shift.val err: 0.01

1,17946,1815
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1815
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 174.99
atom chem shift.val err: 0.10

1,17946,1816
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1816
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 53.34
atom chem shift.val err: 0.16

1,17946,1817
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1817
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 44.16
atom chem shift.val err: 0.19

1,17946,1818
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1818
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 28.00
atom chem shift.val err: 0.08

1,17946,1819
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1819
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 23.07
atom chem shift.val err: 0.18

1,17946,1820
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1820
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 24.83
atom chem shift.val err: 0.06

1,17946,1821
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1821
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 157
atom chem shift.comp id: LEU
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 126.77
atom chem shift.val err: 0.05

1,17946,1822
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1822
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 9.27
atom chem shift.val err: 0.01

1,17946,1823
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1823
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 5.18
atom chem shift.val err: 0.01

1,17946,1824
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1824
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 1.42
atom chem shift.val err: 0.01

1,17946,1825
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1825
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 1.42
atom chem shift.val err: 0.01

1,17946,1826
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1826
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 1.44
atom chem shift.val err: 0.02

1,17946,1827
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1827
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 0.35
atom chem shift.val err: 0.01

1,17946,1828
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1828
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 0.35
atom chem shift.val err: 0.01

1,17946,1829
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1829
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 0.35
atom chem shift.val err: 0.01

1,17946,1830
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1830
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 0.68
atom chem shift.val err: 0.01

1,17946,1831
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1831
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 0.68
atom chem shift.val err: 0.01

1,17946,1832
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1832
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2#
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 0.68
atom chem shift.val err: 0.01

1,17946,1833
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1833
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 175.83
atom chem shift.val err: 0.00

1,17946,1834
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1834
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 52.91
atom chem shift.val err: 0.15

1,17946,1835
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1835
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 44.92
atom chem shift.val err: 0.23

1,17946,1836
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1836
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 26.06
atom chem shift.val err: 0.33

1,17946,1837
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1837
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 25.78
atom chem shift.val err: 0.19

1,17946,1838
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1838
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 22.83
atom chem shift.val err: 0.16

1,17946,1839
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1839
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 158
atom chem shift.comp id: LEU
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 126.52
atom chem shift.val err: 0.06

1,17946,1840
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1840
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 9.46
atom chem shift.val err: 0.00

1,17946,1841
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1841
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 5.44
atom chem shift.val err: 0.01

1,17946,1842
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1842
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 1.97
atom chem shift.val err: 0.01

1,17946,1843
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1843
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 2.19
atom chem shift.val err: 0.01

1,17946,1844
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1844
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 2.37
atom chem shift.val err: 0.01

1,17946,1845
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1845
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 2.37
atom chem shift.val err: 0.01

1,17946,1846
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1846
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 176.07
atom chem shift.val err: 0.06

1,17946,1847
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1847
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 54.55
atom chem shift.val err: 0.24

1,17946,1848
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1848
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 33.78
atom chem shift.val err: 0.15

1,17946,1849
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1849
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 37.60
atom chem shift.val err: 0.06

1,17946,1850
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1850
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 159
atom chem shift.comp id: GLU
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 121.26
atom chem shift.val err: 0.04

1,17946,1851
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1851
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 8.71
atom chem shift.val err: 0.01

1,17946,1852
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1852
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 3.66
atom chem shift.val err: 0.01

1,17946,1853
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1853
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 1.78
atom chem shift.val err: 0.01

1,17946,1854
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1854
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 1.78
atom chem shift.val err: 0.01

1,17946,1855
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1855
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 0.99
atom chem shift.val err: 0.01

1,17946,1856
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1856
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 1.36
atom chem shift.val err: 0.01

1,17946,1857
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1857
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 1.99
atom chem shift.val err: 0.01

1,17946,1858
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1858
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 2.35
atom chem shift.val err: 0.01

1,17946,1859
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1859
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 176.06
atom chem shift.val err: 0.02

1,17946,1860
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1860
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 56.17
atom chem shift.val err: 0.18

1,17946,1861
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1861
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 31.01
atom chem shift.val err: 0.25

1,17946,1862
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1862
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 26.82
atom chem shift.val err: 0.19

1,17946,1863
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1863
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 40.65
atom chem shift.val err: 0.23

1,17946,1864
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1864
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 160
atom chem shift.comp id: ARG
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 128.05
atom chem shift.val err: 0.10

1,17946,1865
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1865
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 8.08
atom chem shift.val err: 0.01

1,17946,1866
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1866
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 4.02
atom chem shift.val err: 0.01

1,17946,1867
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1867
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 1.66
atom chem shift.val err: 0.01

1,17946,1868
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1868
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 0.83
atom chem shift.val err: 0.02

1,17946,1869
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1869
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 0.83
atom chem shift.val err: 0.02

1,17946,1870
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1870
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 0.83
atom chem shift.val err: 0.02

1,17946,1871
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1871
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 0.86
atom chem shift.val err: 0.02

1,17946,1872
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1872
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 0.86
atom chem shift.val err: 0.02

1,17946,1873
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1873
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2#
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 0.86
atom chem shift.val err: 0.02

1,17946,1874
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1874
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 175.20
atom chem shift.val err: 0.01

1,17946,1875
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1875
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 62.38
atom chem shift.val err: 0.15

1,17946,1876
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1876
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 32.31
atom chem shift.val err: 0.06

1,17946,1877
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1877
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 20.80
atom chem shift.val err: 0.17

1,17946,1878
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1878
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 20.79
atom chem shift.val err: 0.17

1,17946,1879
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1879
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 161
atom chem shift.comp id: VAL
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 128.41
atom chem shift.val err: 0.12

1,17946,1880
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1880
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 8.28
atom chem shift.val err: 0.01

1,17946,1881
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1881
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 4.08
atom chem shift.val err: 0.01

1,17946,1882
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1882
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 1.67
atom chem shift.val err: 0.02

1,17946,1883
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1883
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 1.76
atom chem shift.val err: 0.00

1,17946,1884
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1884
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 1.27
atom chem shift.val err: 0.01

1,17946,1885
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1885
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 1.30
atom chem shift.val err: 0.02

1,17946,1886
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1886
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 1.61
atom chem shift.val err: 0.01

1,17946,1887
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1887
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 1.61
atom chem shift.val err: 0.01

1,17946,1888
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1888
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 2.93
atom chem shift.val err: 0.00

1,17946,1889
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1889
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 2.93
atom chem shift.val err: 0.00

1,17946,1890
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1890
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 181.16
atom chem shift.val err: 0.00

1,17946,1891
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1891
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 58.05
atom chem shift.val err: 0.19

1,17946,1892
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1892
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 33.56
atom chem shift.val err: 0.14

1,17946,1893
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1893
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 25.32
atom chem shift.val err: 0.12

1,17946,1894
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1894
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 29.20
atom chem shift.val err: 0.14

1,17946,1895
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1895
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 42.04
atom chem shift.val err: 0.05

1,17946,1896
type: atom chem shift
of datablock: info:bmrb/17946
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17946
atom chem shift.id: 1896
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 162
atom chem shift.comp id: LYS
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 133.51
atom chem shift.val err: 0.04

17946,NAP
type: chem comp
of datablock: info:bmrb/17946
reference to entry: entry
chem comp.entry id: 17946
chem comp.id: NAP
chem comp.ambiguous flag: no
chem comp.aromatic: yes
chem comp.details: Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Sep 20 13:54:35 2011
chem comp.formal charge: 0
chem comp.formula: C21 H28 N7 O17 P3
chem comp.formula weight: 743.405
chem comp.ideal coordinates missing flag: no
chem comp.initial date: 1999-07-07Z
chem comp.model coordinates db code: 1D4O
chem comp.model coordinates missing flag: no
chem comp.modified date: 2011-06-03Z
chem comp.name: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
chem comp.pdb code: NAP
chem comp.processing site: RCSB
chem comp.provenance: na
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_NAP
chem comp.synonyms: 2'-MONOPHOSPHOADENOSINE 5'-DIPHOSPHORIBOSE
chem comp.three letter code: NAP
chem comp.type: NON-POLYMER

info:pdb-ccd/NAP

pdb-ccd:NAP

info:pdb.ligand/NAP

pdb.ligand:NAP

17946,FOL
type: chem comp
of datablock: info:bmrb/17946
reference to entry: entry
chem comp.entry id: 17946
chem comp.id: FOL
chem comp.ambiguous flag: no
chem comp.aromatic: yes
chem comp.details: Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Sep 20 13:56:57 2011
chem comp.formal charge: 0
chem comp.formula: C19 H19 N7 O6
chem comp.formula weight: 441.397
chem comp.ideal coordinates missing flag: no
chem comp.initial date: 1999-07-07Z
chem comp.model coordinates db code: 4CD2
chem comp.model coordinates missing flag: no
chem comp.modified date: 2011-06-03Z
chem comp.name: FOLIC ACID
chem comp.pdb code: FOL
chem comp.processing site: RCSB
chem comp.provenance: na
chem comp.release status: REL
chem comp.replaces: FA
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_FOL
chem comp.three letter code: FOL
chem comp.type: NON-POLYMER

info:pdb-ccd/FOL

pdb-ccd:FOL

info:pdb.ligand/FOL

pdb.ligand:FOL

PA,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: PA
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.174
chem comp atom.model cartn x ideal: -0.035
chem comp atom.model cartn y: 26.134
chem comp atom.model cartn y ideal: -0.972
chem comp atom.model cartn z: 12.040
chem comp atom.model cartn z ideal: 0.719
chem comp atom.pdb atom id: PA
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: R
chem comp atom.type symbol: P

O1A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O1A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.048
chem comp atom.model cartn x ideal: 0.490
chem comp atom.model cartn y: 25.314
chem comp atom.model cartn y ideal: -0.256
chem comp atom.model cartn z: 12.500
chem comp atom.model cartn z ideal: 1.903
chem comp atom.pdb atom id: O1A
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O2A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.478
chem comp atom.model cartn x ideal: -0.725
chem comp atom.model cartn y: 26.114
chem comp atom.model cartn y ideal: -2.349
chem comp atom.model cartn z: 12.670
chem comp atom.model cartn z ideal: 1.187
chem comp atom.pdb atom id: O2A
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O5B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O5B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.317
chem comp atom.model cartn x ideal: -1.126
chem comp atom.model cartn y: 25.889
chem comp atom.model cartn y ideal: -0.051
chem comp atom.model cartn z: 10.437
chem comp atom.model cartn z ideal: -0.026
chem comp atom.pdb atom id: O5B
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C5B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C5B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.813
chem comp atom.model cartn x ideal: -2.109
chem comp atom.model cartn y: 26.990
chem comp atom.model cartn y ideal: 0.297
chem comp atom.model cartn z: 9.495
chem comp atom.model cartn z ideal: 0.952
chem comp atom.pdb atom id: C5B
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C4B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.962
chem comp atom.model cartn x ideal: -3.181
chem comp atom.model cartn y: 26.155
chem comp atom.model cartn y ideal: 1.177
chem comp atom.model cartn z: 8.345
chem comp atom.model cartn z ideal: 0.307
chem comp atom.pdb atom id: C4B
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O4B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O4B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.859
chem comp atom.model cartn x ideal: -3.920
chem comp atom.model cartn y: 27.351
chem comp atom.model cartn y ideal: 0.416
chem comp atom.model cartn z: 7.294
chem comp atom.model cartn z ideal: -0.663
chem comp atom.pdb atom id: O4B
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C3B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C3B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.840
chem comp atom.model cartn x ideal: -4.181
chem comp atom.model cartn y: 25.789
chem comp atom.model cartn y ideal: 1.655
chem comp atom.model cartn z: 7.535
chem comp atom.model cartn z ideal: 1.377
chem comp atom.pdb atom id: C3B
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O3B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O3B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.208
chem comp atom.model cartn x ideal: -4.196
chem comp atom.model cartn y: 24.597
chem comp atom.model cartn y ideal: 3.082
chem comp atom.model cartn z: 7.839
chem comp atom.model cartn z ideal: 1.456
chem comp atom.pdb atom id: O3B
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C2B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C2B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.276
chem comp atom.model cartn x ideal: -5.550
chem comp atom.model cartn y: 25.751
chem comp atom.model cartn y ideal: 1.124
chem comp atom.model cartn z: 6.147
chem comp atom.model cartn z ideal: 0.876
chem comp atom.pdb atom id: C2B
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O2B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O2B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.883
chem comp atom.model cartn x ideal: -6.576
chem comp atom.model cartn y: 24.739
chem comp atom.model cartn y ideal: 2.099
chem comp atom.model cartn z: 5.481
chem comp atom.model cartn z ideal: 1.071
chem comp atom.pdb atom id: O2B
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C1B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C1B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.394
chem comp atom.model cartn x ideal: -5.279
chem comp atom.model cartn y: 26.894
chem comp atom.model cartn y ideal: 0.901
chem comp atom.model cartn z: 5.988
chem comp atom.model cartn z ideal: -0.633
chem comp atom.pdb atom id: C1B
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: R
chem comp atom.type symbol: C

N9A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N9A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.237
chem comp atom.model cartn x ideal: -6.196
chem comp atom.model cartn y: 28.090
chem comp atom.model cartn y ideal: -0.101
chem comp atom.model cartn z: 5.590
chem comp atom.model cartn z ideal: -1.183
chem comp atom.pdb atom id: N9A
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C8A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C8A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.466
chem comp atom.model cartn x ideal: -5.978
chem comp atom.model cartn y: 28.637
chem comp atom.model cartn y ideal: -1.445
chem comp atom.model cartn z: 6.011
chem comp atom.model cartn z ideal: -1.249
chem comp atom.pdb atom id: C8A
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N7A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N7A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.935
chem comp atom.model cartn x ideal: -7.000
chem comp atom.model cartn y: 29.548
chem comp atom.model cartn y ideal: -2.036
chem comp atom.model cartn z: 5.192
chem comp atom.model cartn z ideal: -1.795
chem comp atom.pdb atom id: N7A
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C5A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C5A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.003
chem comp atom.model cartn x ideal: -7.938
chem comp atom.model cartn y: 29.624
chem comp atom.model cartn y ideal: -1.111
chem comp atom.model cartn z: 4.173
chem comp atom.model cartn z ideal: -2.114
chem comp atom.pdb atom id: C5A
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C6A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C6A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.935
chem comp atom.model cartn x ideal: -9.210
chem comp atom.model cartn y: 30.402
chem comp atom.model cartn y ideal: -1.158
chem comp atom.model cartn z: 2.975
chem comp atom.model cartn z ideal: -2.708
chem comp atom.pdb atom id: C6A
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N6A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N6A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.889
chem comp atom.model cartn x ideal: -9.759
chem comp atom.model cartn y: 31.262
chem comp atom.model cartn y ideal: -2.363
chem comp atom.model cartn z: 2.635
chem comp atom.model cartn z ideal: -3.112
chem comp atom.pdb atom id: N6A
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N1A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N1A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.841
chem comp atom.model cartn x ideal: -9.874
chem comp atom.model cartn y: 30.230
chem comp atom.model cartn y ideal: -0.019
chem comp atom.model cartn z: 2.153
chem comp atom.model cartn z ideal: -2.874
chem comp atom.pdb atom id: N1A
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C2A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C2A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.867
chem comp atom.model cartn x ideal: -9.358
chem comp atom.model cartn y: 29.350
chem comp atom.model cartn y ideal: 1.135
chem comp atom.model cartn z: 2.480
chem comp atom.model cartn z ideal: -2.492
chem comp atom.pdb atom id: C2A
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N3A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N3A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.859
chem comp atom.model cartn x ideal: -8.171
chem comp atom.model cartn y: 28.574
chem comp atom.model cartn y ideal: 1.227
chem comp atom.model cartn z: 3.579
chem comp atom.model cartn z ideal: -1.931
chem comp atom.pdb atom id: N3A
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C4A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C4A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.962
chem comp atom.model cartn x ideal: -7.435
chem comp atom.model cartn y: 28.758
chem comp atom.model cartn y ideal: 0.141
chem comp atom.model cartn z: 4.395
chem comp atom.model cartn z ideal: -1.720
chem comp atom.pdb atom id: C4A
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O3,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O3
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.458
chem comp atom.model cartn x ideal: 1.175
chem comp atom.model cartn y: 27.566
chem comp atom.model cartn y ideal: -1.294
chem comp atom.model cartn z: 12.208
chem comp atom.model cartn z ideal: -0.293
chem comp atom.pdb atom id: O3
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: O

PN,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: PN
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.216
chem comp atom.model cartn x ideal: 2.390
chem comp atom.model cartn y: 28.068
chem comp atom.model cartn y ideal: -1.858
chem comp atom.model cartn z: 13.153
chem comp atom.model cartn z ideal: 0.599
chem comp atom.pdb atom id: PN
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O1N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.983
chem comp atom.model cartn x ideal: 2.142
chem comp atom.model cartn y: 27.417
chem comp atom.model cartn y ideal: -3.348
chem comp atom.model cartn z: 12.642
chem comp atom.model cartn z ideal: 0.925
chem comp atom.pdb atom id: O1N
chem comp atom.pdbx ordinal: 25
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O2N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: -1
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.308
chem comp atom.model cartn x ideal: 2.481
chem comp atom.model cartn y: 29.554
chem comp atom.model cartn y ideal: -1.051
chem comp atom.model cartn z: 13.093
chem comp atom.model cartn z ideal: 1.914
chem comp atom.pdb atom id: O2N
chem comp atom.pdbx ordinal: 26
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O5D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O5D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.487
chem comp atom.model cartn x ideal: 3.770
chem comp atom.model cartn y: 27.658
chem comp atom.model cartn y ideal: -1.710
chem comp atom.model cartn z: 14.685
chem comp atom.model cartn z ideal: -0.218
chem comp atom.pdb atom id: O5D
chem comp atom.pdbx ordinal: 27
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C5D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C5D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.599
chem comp atom.model cartn x ideal: 4.818
chem comp atom.model cartn y: 28.169
chem comp atom.model cartn y ideal: -2.114
chem comp atom.model cartn z: 15.475
chem comp atom.model cartn z ideal: 0.665
chem comp atom.pdb atom id: C5D
chem comp atom.pdbx ordinal: 28
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C4D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.395
chem comp atom.model cartn x ideal: 6.164
chem comp atom.model cartn y: 26.968
chem comp atom.model cartn y ideal: -1.997
chem comp atom.model cartn z: 16.025
chem comp atom.model cartn z ideal: -0.053
chem comp atom.pdb atom id: C4D
chem comp atom.pdbx ordinal: 29
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O4D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O4D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.653
chem comp atom.model cartn x ideal: 6.466
chem comp atom.model cartn y: 27.366
chem comp atom.model cartn y ideal: -0.613
chem comp atom.model cartn z: 16.614
chem comp atom.model cartn z ideal: -0.332
chem comp atom.pdb atom id: O4D
chem comp atom.pdbx ordinal: 30
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C3D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C3D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.694
chem comp atom.model cartn x ideal: 7.310
chem comp atom.model cartn y: 26.193
chem comp atom.model cartn y ideal: -2.474
chem comp atom.model cartn z: 17.167
chem comp atom.model cartn z ideal: 0.866
chem comp atom.pdb atom id: C3D
chem comp atom.pdbx ordinal: 31
chem comp atom.stereo config: S
chem comp atom.type symbol: C

O3D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O3D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.085
chem comp atom.model cartn x ideal: 7.670
chem comp atom.model cartn y: 24.806
chem comp atom.model cartn y ideal: -3.822
chem comp atom.model cartn z: 17.287
chem comp atom.model cartn z ideal: 0.559
chem comp atom.pdb atom id: O3D
chem comp atom.pdbx ordinal: 32
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C2D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C2D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.093
chem comp atom.model cartn x ideal: 8.478
chem comp atom.model cartn y: 26.936
chem comp atom.model cartn y ideal: -1.513
chem comp atom.model cartn z: 18.393
chem comp atom.model cartn z ideal: 0.540
chem comp atom.pdb atom id: C2D
chem comp atom.pdbx ordinal: 33
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O2D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O2D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.979
chem comp atom.model cartn x ideal: 9.595
chem comp atom.model cartn y: 26.205
chem comp atom.model cartn y ideal: -2.239
chem comp atom.model cartn z: 19.588
chem comp atom.model cartn z ideal: 0.025
chem comp atom.pdb atom id: O2D
chem comp atom.pdbx ordinal: 34
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C1D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C1D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.569
chem comp atom.model cartn x ideal: 7.895
chem comp atom.model cartn y: 27.243
chem comp atom.model cartn y ideal: -0.568
chem comp atom.model cartn z: 18.038
chem comp atom.model cartn z ideal: -0.534
chem comp atom.pdb atom id: C1D
chem comp atom.pdbx ordinal: 35
chem comp atom.stereo config: R
chem comp atom.type symbol: C

N1N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N1N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 1
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.125
chem comp atom.model cartn x ideal: 8.395
chem comp atom.model cartn y: 28.361
chem comp atom.model cartn y ideal: 0.795
chem comp atom.model cartn z: 18.811
chem comp atom.model cartn z ideal: -0.341
chem comp atom.pdb atom id: N1N
chem comp atom.pdbx ordinal: 36
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C2N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C2N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.555
chem comp atom.model cartn x ideal: 9.364
chem comp atom.model cartn y: 29.641
chem comp atom.model cartn y ideal: 1.237
chem comp atom.model cartn z: 18.667
chem comp atom.model cartn z ideal: -1.116
chem comp atom.pdb atom id: C2N
chem comp atom.pdbx ordinal: 37
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C3N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C3N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.141
chem comp atom.model cartn x ideal: 9.869
chem comp atom.model cartn y: 30.683
chem comp atom.model cartn y ideal: 2.527
chem comp atom.model cartn z: 19.465
chem comp atom.model cartn z ideal: -0.955
chem comp atom.pdb atom id: C3N
chem comp atom.pdbx ordinal: 38
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C7N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C7N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.652
chem comp atom.model cartn x ideal: 10.961
chem comp atom.model cartn y: 32.050
chem comp atom.model cartn y ideal: 3.021
chem comp atom.model cartn z: 19.414
chem comp atom.model cartn z ideal: -1.820
chem comp atom.pdb atom id: C7N
chem comp atom.pdbx ordinal: 39
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O7N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O7N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.161
chem comp atom.model cartn x ideal: 11.430
chem comp atom.model cartn y: 32.943
chem comp atom.model cartn y ideal: 2.299
chem comp atom.model cartn z: 20.102
chem comp atom.model cartn z ideal: -2.678
chem comp atom.pdb atom id: O7N
chem comp atom.pdbx ordinal: 40
chem comp atom.stereo config: N
chem comp atom.type symbol: O

N7N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N7N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.622
chem comp atom.model cartn x ideal: 11.437
chem comp atom.model cartn y: 32.390
chem comp atom.model cartn y ideal: 4.272
chem comp atom.model cartn z: 18.616
chem comp atom.model cartn z ideal: -1.658
chem comp atom.pdb atom id: N7N
chem comp atom.pdbx ordinal: 41
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C4N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C4N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.222
chem comp atom.model cartn x ideal: 9.320
chem comp atom.model cartn y: 30.376
chem comp atom.model cartn y ideal: 3.349
chem comp atom.model cartn z: 20.317
chem comp atom.model cartn z ideal: 0.037
chem comp atom.pdb atom id: C4N
chem comp atom.pdbx ordinal: 42
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C5N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C5N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.746
chem comp atom.model cartn x ideal: 8.300
chem comp atom.model cartn y: 29.139
chem comp atom.model cartn y ideal: 2.840
chem comp atom.model cartn z: 20.435
chem comp atom.model cartn z ideal: 0.821
chem comp atom.pdb atom id: C5N
chem comp atom.pdbx ordinal: 43
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C6N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C6N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.202
chem comp atom.model cartn x ideal: 7.859
chem comp atom.model cartn y: 28.129
chem comp atom.model cartn y ideal: 1.547
chem comp atom.model cartn z: 19.681
chem comp atom.model cartn z ideal: 0.601
chem comp atom.pdb atom id: C6N
chem comp atom.pdbx ordinal: 44
chem comp atom.stereo config: N
chem comp atom.type symbol: C

P2B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: P2B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.664
chem comp atom.model cartn x ideal: -7.765
chem comp atom.model cartn y: 24.555
chem comp atom.model cartn y ideal: 1.370
chem comp atom.model cartn z: 4.097
chem comp atom.model cartn z ideal: 1.875
chem comp atom.pdb atom id: P2B
chem comp atom.pdbx ordinal: 45
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1X,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O1X
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 21.117
chem comp atom.model cartn x ideal: -7.226
chem comp atom.model cartn y: 24.360
chem comp atom.model cartn y ideal: 0.774
chem comp atom.model cartn z: 4.404
chem comp atom.model cartn z ideal: 3.119
chem comp atom.pdb atom id: O1X
chem comp atom.pdbx ordinal: 46
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2X,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O2X
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.964
chem comp atom.model cartn x ideal: -8.903
chem comp atom.model cartn y: 23.410
chem comp atom.model cartn y ideal: 2.447
chem comp atom.model cartn z: 3.543
chem comp atom.model cartn z ideal: 2.246
chem comp atom.pdb atom id: O2X
chem comp atom.pdbx ordinal: 47
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3X,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O3X
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.391
chem comp atom.model cartn x ideal: -8.402
chem comp atom.model cartn y: 25.798
chem comp atom.model cartn y ideal: 0.211
chem comp atom.model cartn z: 3.381
chem comp atom.model cartn z ideal: 0.957
chem comp atom.pdb atom id: O3X
chem comp atom.pdbx ordinal: 48
chem comp atom.stereo config: N
chem comp atom.type symbol: O

HOA2,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HOA2
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.207
chem comp atom.model cartn x ideal: -1.053
chem comp atom.model cartn y: 26.645
chem comp atom.model cartn y ideal: -2.783
chem comp atom.model cartn z: 12.372
chem comp atom.model cartn z ideal: 0.387
chem comp atom.pdb atom id: HOA2
chem comp atom.pdbx ordinal: 49
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H51A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H51A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.176
chem comp atom.model cartn x ideal: -2.570
chem comp atom.model cartn y: 27.899
chem comp atom.model cartn y ideal: -0.610
chem comp atom.model cartn z: 9.389
chem comp atom.model cartn z ideal: 1.343
chem comp atom.pdb atom id: H51A
chem comp atom.pdbx ordinal: 50
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H52A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H52A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.702
chem comp atom.model cartn x ideal: -1.633
chem comp atom.model cartn y: 27.579
chem comp atom.model cartn y ideal: 0.843
chem comp atom.model cartn z: 9.819
chem comp atom.model cartn z ideal: 1.767
chem comp atom.pdb atom id: H52A
chem comp atom.pdbx ordinal: 51
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H4B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.494
chem comp atom.model cartn x ideal: -2.714
chem comp atom.model cartn y: 25.243
chem comp atom.model cartn y ideal: 2.037
chem comp atom.model cartn z: 8.784
chem comp atom.model cartn z ideal: -0.175
chem comp atom.pdb atom id: H4B
chem comp atom.pdbx ordinal: 52
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H3B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H3B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.753
chem comp atom.model cartn x ideal: -3.936
chem comp atom.model cartn y: 26.421
chem comp atom.model cartn y ideal: 1.223
chem comp atom.model cartn z: 7.625
chem comp atom.model cartn z ideal: 2.347
chem comp atom.pdb atom id: H3B
chem comp atom.pdbx ordinal: 53
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO3A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HO3A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.875
chem comp atom.model cartn x ideal: -3.323
chem comp atom.model cartn y: 24.318
chem comp atom.model cartn y ideal: 3.353
chem comp atom.model cartn z: 7.223
chem comp atom.model cartn z ideal: 1.772
chem comp atom.pdb atom id: HO3A
chem comp atom.pdbx ordinal: 54
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H2B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.353
chem comp atom.model cartn x ideal: -5.809
chem comp atom.model cartn y: 25.734
chem comp atom.model cartn y ideal: 0.186
chem comp atom.model cartn z: 5.862
chem comp atom.model cartn z ideal: 1.368
chem comp atom.pdb atom id: H2B
chem comp atom.pdbx ordinal: 55
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H1B,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H1B
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.599
chem comp atom.model cartn x ideal: -5.364
chem comp atom.model cartn y: 26.587
chem comp atom.model cartn y ideal: 1.839
chem comp atom.model cartn z: 5.268
chem comp atom.model cartn z ideal: -1.182
chem comp atom.pdb atom id: H1B
chem comp atom.pdbx ordinal: 56
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H8A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H8A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 21.025
chem comp atom.model cartn x ideal: -5.087
chem comp atom.model cartn y: 28.369
chem comp atom.model cartn y ideal: -1.946
chem comp atom.model cartn z: 6.923
chem comp atom.model cartn z ideal: -0.899
chem comp atom.pdb atom id: H8A
chem comp atom.pdbx ordinal: 57
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H61A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H61A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.840
chem comp atom.model cartn x ideal: -9.265
chem comp atom.model cartn y: 31.816
chem comp atom.model cartn y ideal: -3.187
chem comp atom.model cartn z: 1.780
chem comp atom.model cartn z ideal: -2.985
chem comp atom.pdb atom id: H61A
chem comp atom.pdbx ordinal: 58
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H62A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H62A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 21.774
chem comp atom.model cartn x ideal: -10.638
chem comp atom.model cartn y: 30.755
chem comp atom.model cartn y ideal: -2.382
chem comp atom.model cartn z: 2.625
chem comp atom.model cartn z ideal: -3.521
chem comp atom.pdb atom id: H62A
chem comp atom.pdbx ordinal: 59
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2A,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H2A
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.008
chem comp atom.model cartn x ideal: -9.932
chem comp atom.model cartn y: 29.257
chem comp atom.model cartn y ideal: 2.037
chem comp atom.model cartn z: 1.793
chem comp atom.model cartn z ideal: -2.646
chem comp atom.pdb atom id: H2A
chem comp atom.pdbx ordinal: 60
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H51N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H51N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.238
chem comp atom.model cartn x ideal: 4.658
chem comp atom.model cartn y: 28.882
chem comp atom.model cartn y ideal: -3.148
chem comp atom.model cartn z: 14.904
chem comp atom.model cartn z ideal: 0.970
chem comp atom.pdb atom id: H51N
chem comp atom.pdbx ordinal: 61
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H52N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H52N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.269
chem comp atom.model cartn x ideal: 4.819
chem comp atom.model cartn y: 28.869
chem comp atom.model cartn y ideal: -1.472
chem comp atom.model cartn z: 16.277
chem comp atom.model cartn z ideal: 1.546
chem comp atom.pdb atom id: H52N
chem comp atom.pdbx ordinal: 62
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H4D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.508
chem comp atom.model cartn x ideal: 6.152
chem comp atom.model cartn y: 26.330
chem comp atom.model cartn y ideal: -2.577
chem comp atom.model cartn z: 15.117
chem comp atom.model cartn z ideal: -0.976
chem comp atom.pdb atom id: H4D
chem comp atom.pdbx ordinal: 63
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H3D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H3D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.595
chem comp atom.model cartn x ideal: 7.022
chem comp atom.model cartn y: 26.147
chem comp atom.model cartn y ideal: -2.385
chem comp atom.model cartn z: 16.979
chem comp atom.model cartn z ideal: 1.913
chem comp atom.pdb atom id: H3D
chem comp atom.pdbx ordinal: 64
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO3N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HO3N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.654
chem comp atom.model cartn x ideal: 8.387
chem comp atom.model cartn y: 24.330
chem comp atom.model cartn y ideal: -4.064
chem comp atom.model cartn z: 17.987
chem comp atom.model cartn z ideal: 1.162
chem comp atom.pdb atom id: HO3N
chem comp atom.pdbx ordinal: 65
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H2D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.445
chem comp atom.model cartn x ideal: 8.766
chem comp atom.model cartn y: 27.817
chem comp atom.model cartn y ideal: -0.948
chem comp atom.model cartn z: 18.610
chem comp atom.model cartn z ideal: 1.427
chem comp atom.pdb atom id: H2D
chem comp atom.pdbx ordinal: 66
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO2N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HO2N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.233
chem comp atom.model cartn x ideal: 9.874
chem comp atom.model cartn y: 26.679
chem comp atom.model cartn y ideal: -2.852
chem comp atom.model cartn z: 20.370
chem comp atom.model cartn z ideal: 0.719
chem comp atom.pdb atom id: HO2N
chem comp atom.pdbx ordinal: 67
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H1D,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H1D
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.235
chem comp atom.model cartn x ideal: 8.149
chem comp atom.model cartn y: 26.404
chem comp atom.model cartn y ideal: -0.927
chem comp atom.model cartn z: 18.346
chem comp atom.model cartn z ideal: -1.532
chem comp atom.pdb atom id: H1D
chem comp atom.pdbx ordinal: 68
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H2N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.710
chem comp atom.model cartn x ideal: 9.778
chem comp atom.model cartn y: 29.814
chem comp atom.model cartn y ideal: 0.591
chem comp atom.model cartn z: 17.978
chem comp atom.model cartn z ideal: -1.876
chem comp atom.pdb atom id: H2N
chem comp atom.pdbx ordinal: 69
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H71N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H71N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.202
chem comp atom.model cartn x ideal: 12.153
chem comp atom.model cartn y: 31.653
chem comp atom.model cartn y ideal: 4.595
chem comp atom.model cartn z: 18.048
chem comp atom.model cartn z ideal: -2.226
chem comp atom.pdb atom id: H71N
chem comp atom.pdbx ordinal: 70
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H72N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H72N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.278
chem comp atom.model cartn x ideal: 11.060
chem comp atom.model cartn y: 33.349
chem comp atom.model cartn y ideal: 4.849
chem comp atom.model cartn z: 18.580
chem comp atom.model cartn z ideal: -0.976
chem comp atom.pdb atom id: H72N
chem comp atom.pdbx ordinal: 71
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H4N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.691
chem comp atom.model cartn x ideal: 9.684
chem comp atom.model cartn y: 31.159
chem comp atom.model cartn y ideal: 4.355
chem comp atom.model cartn z: 20.935
chem comp atom.model cartn z ideal: 0.187
chem comp atom.pdb atom id: H4N
chem comp atom.pdbx ordinal: 72
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H5N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 21.589
chem comp atom.model cartn x ideal: 7.853
chem comp atom.model cartn y: 28.959
chem comp atom.model cartn y ideal: 3.445
chem comp atom.model cartn z: 21.123
chem comp atom.model cartn z ideal: 1.596
chem comp atom.pdb atom id: H5N
chem comp atom.pdbx ordinal: 73
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H6N,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H6N
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 20.635
chem comp atom.model cartn x ideal: 7.063
chem comp atom.model cartn y: 27.119
chem comp atom.model cartn y ideal: 1.146
chem comp atom.model cartn z: 19.775
chem comp atom.model cartn z ideal: 1.211
chem comp atom.pdb atom id: H6N
chem comp atom.pdbx ordinal: 74
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOP2,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HOP2
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.427
chem comp atom.model cartn x ideal: -9.594
chem comp atom.model cartn y: 23.300
chem comp atom.model cartn y ideal: 1.970
chem comp atom.model cartn z: 2.721
chem comp atom.model cartn z ideal: 2.725
chem comp atom.pdb atom id: HOP2
chem comp atom.pdbx ordinal: 75
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOP3,NAP,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HOP3
chem comp atom.comp id: NAP
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.854
chem comp atom.model cartn x ideal: -8.740
chem comp atom.model cartn y: 25.688
chem comp atom.model cartn y ideal: 0.640
chem comp atom.model cartn z: 2.559
chem comp atom.model cartn z ideal: 0.160
chem comp atom.pdb atom id: HOP3
chem comp atom.pdbx ordinal: 76
chem comp atom.stereo config: N
chem comp atom.type symbol: H

N1,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N1
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.955
chem comp atom.model cartn x ideal: -1.069
chem comp atom.model cartn y: 57.995
chem comp atom.model cartn y ideal: 0.579
chem comp atom.model cartn z: 30.200
chem comp atom.model cartn z ideal: 7.888
chem comp atom.pdb atom id: N1
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.906
chem comp atom.model cartn x ideal: -0.146
chem comp atom.model cartn y: 57.055
chem comp atom.model cartn y ideal: -0.159
chem comp atom.model cartn z: 29.224
chem comp atom.model cartn z ideal: 8.558
chem comp atom.pdb atom id: C2
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: N
chem comp atom.type symbol: C

NA2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: NA2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.752
chem comp atom.model cartn x ideal: -0.209
chem comp atom.model cartn y: 57.222
chem comp atom.model cartn y ideal: -0.199
chem comp atom.model cartn z: 28.285
chem comp atom.model cartn z ideal: 9.922
chem comp atom.pdb atom id: NA2
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N3,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N3
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.978
chem comp atom.model cartn x ideal: 0.802
chem comp atom.model cartn y: 56.090
chem comp atom.model cartn y ideal: -0.841
chem comp atom.model cartn z: 29.236
chem comp atom.model cartn z ideal: 7.952
chem comp atom.pdb atom id: N3
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C4,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C4
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.177
chem comp atom.model cartn x ideal: 0.922
chem comp atom.model cartn y: 55.992
chem comp atom.model cartn y ideal: -0.847
chem comp atom.model cartn z: 30.277
chem comp atom.model cartn z ideal: 6.618
chem comp atom.pdb atom id: C4
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O4,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O4
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.284
chem comp atom.model cartn x ideal: 1.807
chem comp atom.model cartn y: 55.048
chem comp atom.model cartn y ideal: -1.485
chem comp atom.model cartn z: 30.396
chem comp atom.model cartn z ideal: 6.073
chem comp atom.pdb atom id: O4
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C4A,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C4A
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.242
chem comp atom.model cartn x ideal: -0.043
chem comp atom.model cartn y: 56.932
chem comp atom.model cartn y ideal: -0.061
chem comp atom.model cartn z: 31.411
chem comp atom.model cartn z ideal: 5.822
chem comp atom.pdb atom id: C4A
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N5,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N5
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.439
chem comp atom.model cartn x ideal: 0.011
chem comp atom.model cartn y: 56.784
chem comp atom.model cartn y ideal: -0.018
chem comp atom.model cartn z: 32.478
chem comp atom.model cartn z ideal: 4.498
chem comp atom.pdb atom id: N5
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C6,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C6
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.578
chem comp atom.model cartn x ideal: -0.874
chem comp atom.model cartn y: 57.733
chem comp atom.model cartn y ideal: 0.697
chem comp atom.model cartn z: 33.395
chem comp atom.model cartn z ideal: 3.834
chem comp atom.pdb atom id: C6
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C7,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C7
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.511
chem comp atom.model cartn x ideal: -1.860
chem comp atom.model cartn y: 58.751
chem comp atom.model cartn y ideal: 1.403
chem comp atom.model cartn z: 33.255
chem comp atom.model cartn z ideal: 4.512
chem comp atom.pdb atom id: C7
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N8,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N8
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.345
chem comp atom.model cartn x ideal: -1.924
chem comp atom.model cartn y: 58.864
chem comp atom.model cartn y ideal: 1.368
chem comp atom.model cartn z: 32.244
chem comp atom.model cartn z ideal: 5.831
chem comp atom.pdb atom id: N8
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C8A,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C8A
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.173
chem comp atom.model cartn x ideal: -1.040
chem comp atom.model cartn y: 57.960
chem comp atom.model cartn y ideal: 0.652
chem comp atom.model cartn z: 31.300
chem comp atom.model cartn z ideal: 6.511
chem comp atom.pdb atom id: C8A
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C9,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C9
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.687
chem comp atom.model cartn x ideal: -0.817
chem comp atom.model cartn y: 57.700
chem comp atom.model cartn y ideal: 0.750
chem comp atom.model cartn z: 34.637
chem comp atom.model cartn z ideal: 2.329
chem comp atom.pdb atom id: C9
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N10,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N10
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.022
chem comp atom.model cartn x ideal: 0.300
chem comp atom.model cartn y: 56.471
chem comp atom.model cartn y ideal: -0.068
chem comp atom.model cartn z: 34.831
chem comp atom.model cartn z ideal: 1.853
chem comp atom.pdb atom id: N10
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C11,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C11
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.734
chem comp atom.model cartn x ideal: 1.060
chem comp atom.model cartn y: 52.635
chem comp atom.model cartn y ideal: -0.385
chem comp atom.model cartn z: 35.405
chem comp atom.model cartn z ideal: -2.225
chem comp atom.pdb atom id: C11
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C12,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C12
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.366
chem comp atom.model cartn x ideal: 1.870
chem comp atom.model cartn y: 52.838
chem comp atom.model cartn y ideal: -1.059
chem comp atom.model cartn z: 35.477
chem comp atom.model cartn z ideal: -1.307
chem comp atom.pdb atom id: C12
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C13,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C13
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 5.823
chem comp atom.model cartn x ideal: 1.616
chem comp atom.model cartn y: 54.121
chem comp atom.model cartn y ideal: -0.953
chem comp atom.model cartn z: 35.322
chem comp atom.model cartn z ideal: 0.040
chem comp atom.pdb atom id: C13
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C14,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C14
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.630
chem comp atom.model cartn x ideal: 0.554
chem comp atom.model cartn y: 55.243
chem comp atom.model cartn y ideal: -0.174
chem comp atom.model cartn z: 35.059
chem comp atom.model cartn z ideal: 0.490
chem comp atom.pdb atom id: C14
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C15,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C15
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.005
chem comp atom.model cartn x ideal: -0.257
chem comp atom.model cartn y: 55.010
chem comp atom.model cartn y ideal: 0.494
chem comp atom.model cartn z: 35.019
chem comp atom.model cartn z ideal: -0.421
chem comp atom.pdb atom id: C15
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C16,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C16
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: yes
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.501
chem comp atom.model cartn x ideal: -0.005
chem comp atom.model cartn y: 53.758
chem comp atom.model cartn y ideal: 0.396
chem comp atom.model cartn z: 35.220
chem comp atom.model cartn z ideal: -1.770
chem comp atom.pdb atom id: C16
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: C
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.325
chem comp atom.model cartn x ideal: 1.330
chem comp atom.model cartn y: 51.302
chem comp atom.model cartn y ideal: -0.497
chem comp atom.model cartn z: 35.580
chem comp atom.model cartn z ideal: -3.671
chem comp atom.pdb atom id: C
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.710
chem comp atom.model cartn x ideal: 2.258
chem comp atom.model cartn y: 50.238
chem comp atom.model cartn y ideal: -1.176
chem comp atom.model cartn z: 35.775
chem comp atom.model cartn z ideal: -4.065
chem comp atom.pdb atom id: O
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: O

N,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: N
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.608
chem comp atom.model cartn x ideal: 0.548
chem comp atom.model cartn y: 51.094
chem comp atom.model cartn y ideal: 0.153
chem comp atom.model cartn z: 35.612
chem comp atom.model cartn z ideal: -4.555
chem comp atom.pdb atom id: N
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: N

CA,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: CA
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.299
chem comp atom.model cartn x ideal: 0.816
chem comp atom.model cartn y: 49.867
chem comp atom.model cartn y ideal: 0.042
chem comp atom.model cartn z: 35.882
chem comp atom.model cartn z ideal: -5.991
chem comp atom.pdb atom id: CA
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: S
chem comp atom.type symbol: C

CB,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: CB
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.308
chem comp atom.model cartn x ideal: -0.494
chem comp atom.model cartn y: 48.900
chem comp atom.model cartn y ideal: 0.181
chem comp atom.model cartn z: 34.685
chem comp atom.model cartn z ideal: -6.767
chem comp atom.pdb atom id: CB
chem comp atom.pdbx ordinal: 25
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CG,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: CG
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.966
chem comp atom.model cartn x ideal: -1.459
chem comp atom.model cartn y: 48.247
chem comp atom.model cartn y ideal: -0.926
chem comp atom.model cartn z: 34.539
chem comp atom.model cartn z ideal: -6.340
chem comp atom.pdb atom id: CG
chem comp atom.pdbx ordinal: 26
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CD,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: CD
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.166
chem comp atom.model cartn x ideal: -2.751
chem comp atom.model cartn y: 47.106
chem comp atom.model cartn y ideal: -0.789
chem comp atom.model cartn z: 33.629
chem comp atom.model cartn z ideal: -7.105
chem comp atom.pdb atom id: CD
chem comp atom.pdbx ordinal: 27
chem comp atom.stereo config: N
chem comp atom.type symbol: C

OE1,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: OE1
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.212
chem comp atom.model cartn x ideal: -2.886
chem comp atom.model cartn y: 46.558
chem comp atom.model cartn y ideal: 0.103
chem comp atom.model cartn z: 33.108
chem comp atom.model cartn z ideal: -7.908
chem comp atom.pdb atom id: OE1
chem comp atom.pdbx ordinal: 28
chem comp atom.stereo config: N
chem comp atom.type symbol: O

OE2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: OE2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.166
chem comp atom.model cartn x ideal: -3.751
chem comp atom.model cartn y: 46.393
chem comp atom.model cartn y ideal: -1.659
chem comp atom.model cartn z: 33.207
chem comp atom.model cartn z ideal: -6.893
chem comp atom.pdb atom id: OE2
chem comp atom.pdbx ordinal: 29
chem comp atom.stereo config: N
chem comp atom.type symbol: O

CT,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: CT
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.747
chem comp atom.model cartn x ideal: 1.766
chem comp atom.model cartn y: 50.216
chem comp atom.model cartn y ideal: 1.134
chem comp atom.model cartn z: 36.245
chem comp atom.model cartn z ideal: -6.410
chem comp atom.pdb atom id: CT
chem comp atom.pdbx ordinal: 30
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O1,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O1
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.251
chem comp atom.model cartn x ideal: 2.527
chem comp atom.model cartn y: 49.334
chem comp atom.model cartn y ideal: 0.952
chem comp atom.model cartn z: 36.953
chem comp atom.model cartn z ideal: -7.331
chem comp atom.pdb atom id: O1
chem comp atom.pdbx ordinal: 31
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: O2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.199
chem comp atom.model cartn x ideal: 1.768
chem comp atom.model cartn y: 51.216
chem comp atom.model cartn y ideal: 2.309
chem comp atom.model cartn z: 35.728
chem comp atom.model cartn z ideal: -5.761
chem comp atom.pdb atom id: O2
chem comp atom.pdbx ordinal: 32
chem comp atom.stereo config: N
chem comp atom.type symbol: O

HN1,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HN1
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.814
chem comp atom.model cartn x ideal: -1.752
chem comp atom.model cartn y: 58.902
chem comp atom.model cartn y ideal: 1.060
chem comp atom.model cartn z: 29.755
chem comp atom.model cartn z ideal: 8.381
chem comp atom.pdb atom id: HN1
chem comp atom.pdbx ordinal: 33
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN21,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HN21
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.715
chem comp atom.model cartn x ideal: 0.436
chem comp atom.model cartn y: 56.514
chem comp atom.model cartn y ideal: -0.722
chem comp atom.model cartn z: 27.550
chem comp atom.model cartn z ideal: 10.422
chem comp atom.pdb atom id: HN21
chem comp atom.pdbx ordinal: 34
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN22,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HN22
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.695
chem comp atom.model cartn x ideal: -0.897
chem comp atom.model cartn y: 57.289
chem comp atom.model cartn y ideal: 0.298
chem comp atom.model cartn z: 28.665
chem comp atom.model cartn z ideal: 10.391
chem comp atom.pdb atom id: HN22
chem comp atom.pdbx ordinal: 35
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H7,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H7
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.597
chem comp atom.model cartn x ideal: -2.580
chem comp atom.model cartn y: 59.543
chem comp atom.model cartn y ideal: 1.985
chem comp atom.model cartn z: 34.017
chem comp atom.model cartn z ideal: 3.957
chem comp atom.pdb atom id: H7
chem comp atom.pdbx ordinal: 36
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H91,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H91
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.270
chem comp atom.model cartn x ideal: -1.750
chem comp atom.model cartn y: 57.977
chem comp atom.model cartn y ideal: 0.366
chem comp atom.model cartn z: 35.545
chem comp atom.model cartn z ideal: 1.916
chem comp atom.pdb atom id: H91
chem comp atom.pdbx ordinal: 37
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H92,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H92
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 5.956
chem comp atom.model cartn x ideal: -0.674
chem comp atom.model cartn y: 58.542
chem comp atom.model cartn y ideal: 1.782
chem comp atom.model cartn z: 34.618
chem comp atom.model cartn z ideal: 2.007
chem comp atom.pdb atom id: H92
chem comp atom.pdbx ordinal: 38
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN0,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HN0
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 5.409
chem comp atom.model cartn x ideal: 0.863
chem comp atom.model cartn y: 56.344
chem comp atom.model cartn y ideal: -0.536
chem comp atom.model cartn z: 34.025
chem comp atom.model cartn z ideal: 2.490
chem comp atom.pdb atom id: HN0
chem comp atom.pdbx ordinal: 39
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H12,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H12
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 5.705
chem comp atom.model cartn x ideal: 2.695
chem comp atom.model cartn y: 51.973
chem comp atom.model cartn y ideal: -1.663
chem comp atom.model cartn z: 35.658
chem comp atom.model cartn z ideal: -1.655
chem comp atom.pdb atom id: H12
chem comp atom.pdbx ordinal: 40
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H13,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H13
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.731
chem comp atom.model cartn x ideal: 2.242
chem comp atom.model cartn y: 54.251
chem comp atom.model cartn y ideal: -1.473
chem comp atom.model cartn z: 35.409
chem comp atom.model cartn z ideal: 0.750
chem comp atom.pdb atom id: H13
chem comp atom.pdbx ordinal: 41
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H15,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H15
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.714
chem comp atom.model cartn x ideal: -1.081
chem comp atom.model cartn y: 55.832
chem comp atom.model cartn y ideal: 1.097
chem comp atom.model cartn z: 34.824
chem comp atom.model cartn z ideal: -0.068
chem comp atom.pdb atom id: H15
chem comp atom.pdbx ordinal: 42
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H16,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: H16
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.598
chem comp atom.model cartn x ideal: -0.633
chem comp atom.model cartn y: 53.645
chem comp atom.model cartn y ideal: 0.918
chem comp atom.model cartn z: 35.233
chem comp atom.model cartn z ideal: -2.477
chem comp atom.pdb atom id: H16
chem comp atom.pdbx ordinal: 43
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HN
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.110
chem comp atom.model cartn x ideal: -0.191
chem comp atom.model cartn y: 51.958
chem comp atom.model cartn y ideal: 0.696
chem comp atom.model cartn z: 35.410
chem comp atom.model cartn z ideal: -4.240
chem comp atom.pdb atom id: HN
chem comp atom.pdbx ordinal: 44
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HA,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HA
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.765
chem comp atom.model cartn x ideal: 1.262
chem comp atom.model cartn y: 49.348
chem comp atom.model cartn y ideal: -0.928
chem comp atom.model cartn z: 36.712
chem comp atom.model cartn z ideal: -6.203
chem comp atom.pdb atom id: HA
chem comp atom.pdbx ordinal: 45
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB1,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HB1
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.631
chem comp atom.model cartn x ideal: -0.941
chem comp atom.model cartn y: 49.403
chem comp atom.model cartn y ideal: 1.153
chem comp atom.model cartn z: 33.744
chem comp atom.model cartn z ideal: -6.554
chem comp atom.pdb atom id: HB1
chem comp atom.pdbx ordinal: 46
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HB2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.130
chem comp atom.model cartn x ideal: -0.295
chem comp atom.model cartn y: 48.150
chem comp atom.model cartn y ideal: 0.099
chem comp atom.model cartn z: 34.760
chem comp atom.model cartn z ideal: -7.835
chem comp atom.pdb atom id: HB2
chem comp atom.pdbx ordinal: 47
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HG1,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HG1
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.501
chem comp atom.model cartn x ideal: -1.013
chem comp atom.model cartn y: 47.963
chem comp atom.model cartn y ideal: -1.898
chem comp atom.model cartn z: 35.512
chem comp atom.model cartn z ideal: -6.553
chem comp atom.pdb atom id: HG1
chem comp atom.pdbx ordinal: 48
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HG2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HG2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.164
chem comp atom.model cartn x ideal: -1.659
chem comp atom.model cartn y: 48.946
chem comp atom.model cartn y ideal: -0.843
chem comp atom.model cartn z: 34.205
chem comp atom.model cartn z ideal: -5.272
chem comp atom.pdb atom id: HG2
chem comp atom.pdbx ordinal: 49
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOE2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HOE2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.295
chem comp atom.model cartn x ideal: -4.580
chem comp atom.model cartn y: 45.657
chem comp atom.model cartn y ideal: -1.571
chem comp atom.model cartn z: 32.620
chem comp atom.model cartn z ideal: -7.383
chem comp atom.pdb atom id: HOE2
chem comp atom.pdbx ordinal: 50
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO2,FOL,17946
type: chem comp atom
of datablock: info:bmrb/17946
reference to entry: entry
chem comp atom.atom id: HO2
chem comp atom.comp id: FOL
chem comp atom.entry id: 17946
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.096
chem comp atom.model cartn x ideal: 2.377
chem comp atom.model cartn y: 51.432
chem comp atom.model cartn y ideal: 3.009
chem comp atom.model cartn z: 35.952
chem comp atom.model cartn z ideal: -6.030
chem comp atom.pdb atom id: HO2
chem comp atom.pdbx ordinal: 51
chem comp atom.stereo config: N
chem comp atom.type symbol: H

NAP,17946,1
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 1
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O1A
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

FOL,17946,2
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 2
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: C2
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,3
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 3
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: C8A
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,4
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 4
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O2A
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,5
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 5
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: HN1
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,6
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 6
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O5B
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,7
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 7
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: NA2
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,8
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O3
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,9
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 9
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2A
chem comp bond.atom id 2: HOA2
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,10
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 10
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N3
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,11
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 11
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O5B
chem comp bond.atom id 2: C5B
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,12
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 12
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: NA2
chem comp bond.atom id 2: HN21
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,13
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 13
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5B
chem comp bond.atom id 2: C4B
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,14
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 14
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: NA2
chem comp bond.atom id 2: HN22
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,15
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 15
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5B
chem comp bond.atom id 2: H51A
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,16
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 16
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,17
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 17
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: O4
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,18
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 18
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5B
chem comp bond.atom id 2: H52A
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,19
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 19
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4B
chem comp bond.atom id 2: O4B
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,20
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 20
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: C4A
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,21
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 21
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C4A
chem comp bond.atom id 2: N5
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,22
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 22
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4B
chem comp bond.atom id 2: C3B
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,23
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 23
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C4A
chem comp bond.atom id 2: C8A
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,24
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 24
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4B
chem comp bond.atom id 2: H4B
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,25
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 25
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O4B
chem comp bond.atom id 2: C1B
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,26
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 26
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N5
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,27
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 27
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3B
chem comp bond.atom id 2: O3B
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,28
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 28
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: C7
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,29
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 29
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3B
chem comp bond.atom id 2: C2B
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,30
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 30
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: C9
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,31
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 31
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: N8
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,32
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 32
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3B
chem comp bond.atom id 2: H3B
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,33
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 33
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3B
chem comp bond.atom id 2: HO3A
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,34
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 34
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: H7
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,35
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 35
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2B
chem comp bond.atom id 2: O2B
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,36
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 36
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N8
chem comp bond.atom id 2: C8A
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,37
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 37
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: N10
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,38
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 38
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2B
chem comp bond.atom id 2: C1B
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,39
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 39
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2B
chem comp bond.atom id 2: H2B
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,40
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 40
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: H91
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,41
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 41
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: H92
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,42
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 42
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2B
chem comp bond.atom id 2: P2B
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,43
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 43
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1B
chem comp bond.atom id 2: N9A
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,44
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 44
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N10
chem comp bond.atom id 2: C14
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,45
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 45
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1B
chem comp bond.atom id 2: H1B
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,46
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 46
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N10
chem comp bond.atom id 2: HN0
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,47
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 47
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N9A
chem comp bond.atom id 2: C8A
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,48
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 48
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: C12
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,49
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 49
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N9A
chem comp bond.atom id 2: C4A
chem comp bond.ordinal: 25
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,50
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 50
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: C16
chem comp bond.ordinal: 25
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,51
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 51
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: C
chem comp bond.ordinal: 26
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,52
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 52
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C8A
chem comp bond.atom id 2: N7A
chem comp bond.ordinal: 26
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,53
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 53
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C8A
chem comp bond.atom id 2: H8A
chem comp bond.ordinal: 27
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,54
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 54
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: C13
chem comp bond.ordinal: 27
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,55
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 55
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: H12
chem comp bond.ordinal: 28
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,56
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 56
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N7A
chem comp bond.atom id 2: C5A
chem comp bond.ordinal: 28
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,57
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 57
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: C14
chem comp bond.ordinal: 29
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,58
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 58
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C5A
chem comp bond.atom id 2: C6A
chem comp bond.ordinal: 29
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,59
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 59
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: H13
chem comp bond.ordinal: 30
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,60
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 60
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C5A
chem comp bond.atom id 2: C4A
chem comp bond.ordinal: 30
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,61
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 61
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6A
chem comp bond.atom id 2: N6A
chem comp bond.ordinal: 31
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,62
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 62
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C14
chem comp bond.atom id 2: C15
chem comp bond.ordinal: 31
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,63
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 63
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C15
chem comp bond.atom id 2: C16
chem comp bond.ordinal: 32
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,64
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 64
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C6A
chem comp bond.atom id 2: N1A
chem comp bond.ordinal: 32
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,65
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 65
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N6A
chem comp bond.atom id 2: H61A
chem comp bond.ordinal: 33
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,66
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 66
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C15
chem comp bond.atom id 2: H15
chem comp bond.ordinal: 33
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,67
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 67
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N6A
chem comp bond.atom id 2: H62A
chem comp bond.ordinal: 34
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,68
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 68
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C16
chem comp bond.atom id 2: H16
chem comp bond.ordinal: 34
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,69
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 69
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.ordinal: 35
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,70
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 70
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N1A
chem comp bond.atom id 2: C2A
chem comp bond.ordinal: 35
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,71
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 71
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C
chem comp bond.atom id 2: N
chem comp bond.ordinal: 36
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,72
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 72
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C2A
chem comp bond.atom id 2: N3A
chem comp bond.ordinal: 36
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

FOL,17946,73
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 73
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.ordinal: 37
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,74
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 74
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2A
chem comp bond.atom id 2: H2A
chem comp bond.ordinal: 37
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,75
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 75
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N3A
chem comp bond.atom id 2: C4A
chem comp bond.ordinal: 38
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,76
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 76
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N
chem comp bond.atom id 2: HN
chem comp bond.ordinal: 38
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,77
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 77
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3
chem comp bond.atom id 2: PN
chem comp bond.ordinal: 39
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,78
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 78
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.ordinal: 39
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,79
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 79
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CT
chem comp bond.ordinal: 40
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,80
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 80
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PN
chem comp bond.atom id 2: O1N
chem comp bond.ordinal: 40
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

FOL,17946,81
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 81
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.ordinal: 41
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,82
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 82
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PN
chem comp bond.atom id 2: O2N
chem comp bond.ordinal: 41
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,83
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 83
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PN
chem comp bond.atom id 2: O5D
chem comp bond.ordinal: 42
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,84
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 84
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.ordinal: 42
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,85
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 85
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB1
chem comp bond.ordinal: 43
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,86
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 86
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O5D
chem comp bond.atom id 2: C5D
chem comp bond.ordinal: 43
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,87
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 87
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.ordinal: 44
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,88
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 88
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5D
chem comp bond.atom id 2: C4D
chem comp bond.ordinal: 44
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,89
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 89
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5D
chem comp bond.atom id 2: H51N
chem comp bond.ordinal: 45
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,90
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 90
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD
chem comp bond.ordinal: 45
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,91
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 91
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG1
chem comp bond.ordinal: 46
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,92
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 92
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5D
chem comp bond.atom id 2: H52N
chem comp bond.ordinal: 46
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,93
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 93
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG2
chem comp bond.ordinal: 47
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,94
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 94
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4D
chem comp bond.atom id 2: O4D
chem comp bond.ordinal: 47
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,95
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 95
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: OE1
chem comp bond.ordinal: 48
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,96
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 96
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4D
chem comp bond.atom id 2: C3D
chem comp bond.ordinal: 48
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,97
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 97
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4D
chem comp bond.atom id 2: H4D
chem comp bond.ordinal: 49
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,98
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 98
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: OE2
chem comp bond.ordinal: 49
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,99
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 99
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: OE2
chem comp bond.atom id 2: HOE2
chem comp bond.ordinal: 50
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,100
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 100
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O4D
chem comp bond.atom id 2: C1D
chem comp bond.ordinal: 50
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,101
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 101
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3D
chem comp bond.atom id 2: O3D
chem comp bond.ordinal: 51
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,102
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 102
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CT
chem comp bond.atom id 2: O1
chem comp bond.ordinal: 51
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

FOL,17946,103
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 103
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: CT
chem comp bond.atom id 2: O2
chem comp bond.ordinal: 52
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,104
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 104
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3D
chem comp bond.atom id 2: C2D
chem comp bond.ordinal: 52
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,105
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 105
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3D
chem comp bond.atom id 2: H3D
chem comp bond.ordinal: 53
chem comp bond.stereo config: N
chem comp bond.value order: SING

FOL,17946,106
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: FOL
chem comp bond.entry id: 17946
chem comp bond.id: 106
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2
chem comp bond.atom id 2: HO2
chem comp bond.ordinal: 53
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,107
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 107
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3D
chem comp bond.atom id 2: HO3N
chem comp bond.ordinal: 54
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,108
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 108
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2D
chem comp bond.atom id 2: O2D
chem comp bond.ordinal: 55
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,109
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 109
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2D
chem comp bond.atom id 2: C1D
chem comp bond.ordinal: 56
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,110
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 110
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2D
chem comp bond.atom id 2: H2D
chem comp bond.ordinal: 57
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,111
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 111
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2D
chem comp bond.atom id 2: HO2N
chem comp bond.ordinal: 58
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,112
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 112
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1D
chem comp bond.atom id 2: N1N
chem comp bond.ordinal: 59
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,113
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 113
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1D
chem comp bond.atom id 2: H1D
chem comp bond.ordinal: 60
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,114
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 114
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N1N
chem comp bond.atom id 2: C2N
chem comp bond.ordinal: 61
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,115
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 115
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N1N
chem comp bond.atom id 2: C6N
chem comp bond.ordinal: 62
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,116
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 116
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C2N
chem comp bond.atom id 2: C3N
chem comp bond.ordinal: 63
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,117
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 117
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2N
chem comp bond.atom id 2: H2N
chem comp bond.ordinal: 64
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,118
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 118
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3N
chem comp bond.atom id 2: C7N
chem comp bond.ordinal: 65
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,119
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 119
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C3N
chem comp bond.atom id 2: C4N
chem comp bond.ordinal: 66
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,120
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 120
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C7N
chem comp bond.atom id 2: O7N
chem comp bond.ordinal: 67
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,121
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 121
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C7N
chem comp bond.atom id 2: N7N
chem comp bond.ordinal: 68
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,122
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 122
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N7N
chem comp bond.atom id 2: H71N
chem comp bond.ordinal: 69
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,123
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 123
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N7N
chem comp bond.atom id 2: H72N
chem comp bond.ordinal: 70
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,124
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 124
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C4N
chem comp bond.atom id 2: C5N
chem comp bond.ordinal: 71
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,125
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 125
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4N
chem comp bond.atom id 2: H4N
chem comp bond.ordinal: 72
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,126
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 126
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C5N
chem comp bond.atom id 2: C6N
chem comp bond.ordinal: 73
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,127
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 127
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5N
chem comp bond.atom id 2: H5N
chem comp bond.ordinal: 74
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,128
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 128
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6N
chem comp bond.atom id 2: H6N
chem comp bond.ordinal: 75
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,129
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 129
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: P2B
chem comp bond.atom id 2: O1X
chem comp bond.ordinal: 76
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

NAP,17946,130
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 130
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: P2B
chem comp bond.atom id 2: O2X
chem comp bond.ordinal: 77
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,131
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 131
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: P2B
chem comp bond.atom id 2: O3X
chem comp bond.ordinal: 78
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,132
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 132
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2X
chem comp bond.atom id 2: HOP2
chem comp bond.ordinal: 79
chem comp bond.stereo config: N
chem comp bond.value order: SING

NAP,17946,133
type: chem comp bond
of datablock: info:bmrb/17946
chem comp bond.comp id: NAP
chem comp bond.entry id: 17946
chem comp bond.id: 133
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3X
chem comp bond.atom id 2: HOP3
chem comp bond.ordinal: 80
chem comp bond.stereo config: N
chem comp bond.value order: SING

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/NAP,c1cc(c%5Bn%2B%5D(c1)C2C(C(C(O2)COP(%3DO)(%5BO-%5D)OP(%3DO)(O)OCC3C(C(C(O3)n4cn,17946,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: NAP
chem comp descriptor.descriptor: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=O)N
chem comp descriptor.entry id: 17946
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/NAP,c1cc(c%5Bn%2B%5D(c1)%5BC%40H%5D2%5BC%40%40H%5D(%5BC%40%40H%5D(%5BC%40H%5D(O2)CO%5BP%40%40%5D(%3DO)(%5BO-%5D)O%5BP%40,17946,OECHEM,1.5.0,SM[cell cut: 214 characters, first 200 kept]
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: NAP
chem comp descriptor.descriptor: c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[P@@](=O)([O-])O[P@](=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=O)N
chem comp descriptor.entry id: 17946
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

NAP,,17946,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: NAP
chem comp descriptor.descriptor: InChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
chem comp descriptor.entry id: 17946
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/NAP,NC(%3DO)c1ccc%5Bn%2B%5D(c1)%5BC%40%40H%5D2O%5BC%40H%5D(CO%5BP%5D(%5BO-%5D)(%3DO)O%5BP%40%40%5D(O)(%3DO)OC%5B,17946,CACTVS,3.341,SMILES_CAN[cell cut: 206 characters, first 200 kept]
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: NAP
chem comp descriptor.descriptor: NC(=O)c1ccc[n+](c1)[C@@H]2O[C@H](CO[P]([O-])(=O)O[P@@](O)(=O)OC[C@H]3O[C@H]([C@H](O[P](O)(O)=O)[C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O
chem comp descriptor.entry id: 17946
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/NAP,NC(%3DO)c1ccc%5Bn%2B%5D(c1)%5BCH%5D2O%5BCH%5D(CO%5BP%5D(%5BO-%5D)(%3DO)O%5BP%5D(O)(%3DO)OC%5BCH%5D3O,17946,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: NAP
chem comp descriptor.descriptor: NC(=O)c1ccc[n+](c1)[CH]2O[CH](CO[P]([O-])(=O)O[P](O)(=O)OC[CH]3O[CH]([CH](O[P](O)(O)=O)[CH]3O)n4cnc5c(N)ncnc45)[CH](O)[CH]2O
chem comp descriptor.entry id: 17946
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

NAP,XJLXINKUBYWONI-NNYOXOHSSA-N,17946,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: NAP
chem comp descriptor.descriptor: XJLXINKUBYWONI-NNYOXOHSSA-N
chem comp descriptor.entry id: 17946
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/FOL,c1cc(ccc1C(%3DO)NC(CCC(%3DO)O)C(%3DO)O)NCc2cnc3c(n2)C(%3DO)N%3DC(N3)N,17946,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCc2cnc3c(n2)C(=O)N=C(N3)N
chem comp descriptor.entry id: 17946
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/FOL,c1cc(ccc1C(%3DO)N%5BC%40%40H%5D(CCC(%3DO)O)C(%3DO)O)NCc2cnc3c(n2)C(%3DO)N%3DC(N3)N,17946,OECHEM,1.5.0,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCc2cnc3c(n2)C(=O)N=C(N3)N
chem comp descriptor.entry id: 17946
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

FOL,,17946,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/t12-/m0/s1
chem comp descriptor.entry id: 17946
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/FOL,NC1%3DNC(%3DO)c2nc(CNc3ccc(cc3)C(%3DO)N%5BC%40%40H%5D(CCC(O)%3DO)C(O)%3DO)cnc2N1,17946,CACTVS,3.341,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: NC1=NC(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2N1
chem comp descriptor.entry id: 17946
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/FOL,NC1%3DNC(%3DO)c2nc(CNc3ccc(cc3)C(%3DO)N%5BCH%5D(CCC(O)%3DO)C(O)%3DO)cnc2N1,17946,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: NC1=NC(=O)c2nc(CNc3ccc(cc3)C(=O)N[CH](CCC(O)=O)C(O)=O)cnc2N1
chem comp descriptor.entry id: 17946
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr17946/chem_comp_descriptor/FOL,O%3DC(O)C(NC(%3DO)c1ccc(cc1)NCc2nc3c(nc2)NC(%3DNC3%3DO)N)CCC(%3DO)O,17946,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: O=C(O)C(NC(=O)c1ccc(cc1)NCc2nc3c(nc2)NC(=NC3=O)N)CCC(=O)O
chem comp descriptor.entry id: 17946
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

FOL,OVBPIULPVIDEAO-LBPRGKRZSA-N,17946,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/17946
chem comp descriptor.comp id: FOL
chem comp descriptor.descriptor: OVBPIULPVIDEAO-LBPRGKRZSA-N
chem comp descriptor.entry id: 17946
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

NAP,17946,[(2R,3S,4R,5R)-5-(3-aminocarbonylpyridin-1-ium-1-yl)-3,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/17946
chem comp identifier.comp id: NAP
chem comp identifier.entry id: 17946
chem comp identifier.identifier: [(2R,3S,4R,5R)-5-(3-aminocarbonylpyridin-1-ium-1-yl)-3,4-dihydroxy-oxolan-2-yl]methyl [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphate
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

FOL,17946,(2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]c,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/17946
chem comp identifier.comp id: FOL
chem comp identifier.entry id: 17946
chem comp identifier.identifier: (2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

FOL,17946,N-[(4-{[(2-amino-4-oxo-1,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/17946
chem comp identifier.comp id: FOL
chem comp identifier.entry id: 17946
chem comp identifier.identifier: N-[(4-{[(2-amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}phenyl)carbonyl]-L-glutamic acid
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

1,17946,1
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 1
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 40
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,2
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 2
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.714
chem shift completeness char.chem shift coverage: 0.786
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 41
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.600
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 179460301

1,17946,3
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 3
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 42
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,4
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 4
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 43
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,5
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 5
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 44
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,6
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 6
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.600
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 45
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.667
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.400
chem shift completeness char.sf id: 179460301

1,17946,7
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 7
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 46
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,8
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 8
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 47
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,9
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 9
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.375
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.444
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 48
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 179460301

1,17946,10
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 10
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 49
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,11
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 11
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 50
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,12
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 12
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 51
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,13
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 13
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 52
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,14
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 14
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 53
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,15
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 15
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 54
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,16
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 16
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.286
chem shift completeness char.chem shift coverage: 0.643
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 55
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.400
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 179460301

1,17946,17
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 17
chem shift completeness char.bb chem shift 13c coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 13c coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 56
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 179460301

1,17946,18
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 18
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 57
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,19
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 19
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 58
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,20
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 20
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 59
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.778
chem shift completeness char.sf id: 179460301

1,17946,21
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 21
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 60
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,22
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 22
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 61
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,23
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 23
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 62
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,24
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 24
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 63
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,25
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 25
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 64
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,26
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 26
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 65
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,27
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 27
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 66
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,28
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 28
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 67
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,29
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 29
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 68
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,30
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 30
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 69
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 179460301

1,17946,31
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 31
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 70
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,32
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 32
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 71
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,33
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 33
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 72
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,34
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 34
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 73
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,35
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 35
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 74
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,36
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 36
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 75
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,37
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 37
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 76
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,38
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 38
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 77
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,39
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 39
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 78
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,40
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 40
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 79
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,41
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 41
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 80
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.778
chem shift completeness char.sf id: 179460301

1,17946,42
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 42
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 81
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,43
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 43
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 82
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,44
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 44
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 83
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,45
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 45
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 84
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,46
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 46
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 85
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,47
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 47
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 86
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,48
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 48
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 87
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,49
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 49
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 88
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,50
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 50
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 89
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,51
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 51
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 90
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,52
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 52
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 91
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,53
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 53
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 92
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,54
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 54
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 93
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.889
chem shift completeness char.sf id: 179460301

1,17946,55
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 55
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.846
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 94
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.667
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.750
chem shift completeness char.sf id: 179460301

1,17946,56
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 56
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 95
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,57
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 57
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.714
chem shift completeness char.chem shift coverage: 0.786
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 96
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.600
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 179460301

1,17946,58
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 58
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 97
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,59
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 59
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 98
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,60
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 60
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 99
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,61
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 61
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.846
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 1
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,62
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 62
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 2
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,63
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 63
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 3
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,64
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 64
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 4
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,65
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 65
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.714
chem shift completeness char.chem shift coverage: 0.846
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 5
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.600
chem shift completeness char.sc chem shift coverage: 0.750
chem shift completeness char.sf id: 179460301

1,17946,66
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 66
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 6
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,67
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 67
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 7
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,68
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 68
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 8
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,69
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 69
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 9
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,70
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 70
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,71
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 71
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 11
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,72
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 72
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 12
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,73
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 73
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.222
chem shift completeness char.chem shift coverage: 0.533
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 13
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.300
chem shift completeness char.sf id: 179460301

1,17946,74
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 74
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,75
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 75
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 15
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,76
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 76
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 16
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,77
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 77
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 17
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,78
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 78
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 18
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,79
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 79
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 19
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,80
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 80
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 20
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,81
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 81
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.714
chem shift completeness char.chem shift coverage: 0.769
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 21
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.667
chem shift completeness char.sc chem shift 1h coverage: 0.600
chem shift completeness char.sc chem shift coverage: 0.625
chem shift completeness char.sf id: 179460301

1,17946,82
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 82
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 22
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,83
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 83
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 15n coverage: 1.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.083
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.375
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.400
chem shift completeness char.chem shift coverage: 0.450
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 23
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.250
chem shift completeness char.sc chem shift coverage: 0.267
chem shift completeness char.sf id: 179460301

1,17946,84
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 84
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.600
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 24
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.429
chem shift completeness char.sf id: 179460301

1,17946,85
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 85
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 25
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.778
chem shift completeness char.sf id: 179460301

1,17946,86
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 86
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 26
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,87
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 87
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 27
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,88
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 88
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 28
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,89
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 89
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 29
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,90
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 90
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 30
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,91
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 91
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 31
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,92
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 92
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.375
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.444
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 32
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 179460301

1,17946,93
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 93
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.600
chem shift completeness char.chem shift coverage: 0.706
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.583
chem shift completeness char.sf id: 179460301

1,17946,94
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 94
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 34
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,95
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 95
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 35
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,96
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 96
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 36
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,97
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 97
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 37
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,98
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 98
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 38
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,99
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 99
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.600
chem shift completeness char.chem shift coverage: 0.647
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 39
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 179460301

1,17946,100
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 100
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 158
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,101
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 101
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 159
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,102
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 102
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 160
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,103
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 103
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 161
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,104
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 104
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 162
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,105
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 105
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 100
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,106
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 106
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 101
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,107
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 107
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 102
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.636
chem shift completeness char.sf id: 179460301

1,17946,108
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 108
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 103
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,109
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 109
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 104
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,110
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 110
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 105
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,111
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 111
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 106
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,112
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 112
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 107
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,113
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 113
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 108
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,114
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 114
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 109
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,115
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 115
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 110
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,116
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 116
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 111
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,117
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 117
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 112
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,118
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 118
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 113
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 179460301

1,17946,119
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 119
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 114
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,120
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 120
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 115
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,121
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 121
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.600
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 116
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.429
chem shift completeness char.sf id: 179460301

1,17946,122
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 122
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 117
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,123
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 123
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.727
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 118
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.750
chem shift completeness char.sc chem shift coverage: 0.833
chem shift completeness char.sf id: 179460301

1,17946,124
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 124
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 119
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,125
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 125
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 120
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,126
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 126
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 121
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,127
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 127
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 122
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,128
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 128
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 123
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 179460301

1,17946,129
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 129
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 124
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,130
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 130
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 125
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,131
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 131
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 15n coverage: 1.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.083
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.375
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.400
chem shift completeness char.chem shift coverage: 0.450
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 126
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.250
chem shift completeness char.sc chem shift coverage: 0.267
chem shift completeness char.sf id: 179460301

1,17946,132
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 132
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.389
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 127
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 179460301

1,17946,133
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 133
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 128
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,134
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 134
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 129
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,135
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 135
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 130
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 179460301

1,17946,136
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 136
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 131
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,137
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 137
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 132
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,138
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 138
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 133
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 179460301

1,17946,139
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 139
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 134
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,140
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 140
chem shift completeness char.arom chem shift 13c coverage: 1.000
chem shift completeness char.arom chem shift 15n coverage: 1.000
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 135
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,141
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 141
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 136
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,142
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 142
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 137
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,143
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 143
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 138
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,144
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 144
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 139
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,145
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 145
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.600
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 140
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.429
chem shift completeness char.sf id: 179460301

1,17946,146
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 146
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 141
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,147
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 147
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 142
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,148
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 148
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 143
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 179460301

1,17946,149
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 149
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 144
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,150
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 150
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 145
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,151
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 151
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 146
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,152
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 152
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 147
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,153
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 153
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 148
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,154
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 154
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 149
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,155
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 155
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 150
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,156
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 156
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.250
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.600
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.833
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 151
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.750
chem shift completeness char.sc chem shift coverage: 0.571
chem shift completeness char.sf id: 179460301

1,17946,157
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 157
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 152
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,158
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 158
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 153
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 179460301

1,17946,159
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 159
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.933
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 154
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.900
chem shift completeness char.sf id: 179460301

1,17946,160
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 160
chem shift completeness char.arom chem shift 13c coverage: 0.800
chem shift completeness char.arom chem shift 1h coverage: 0.800
chem shift completeness char.arom chem shift coverage: 0.800
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.875
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 155
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.833
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.846
chem shift completeness char.sf id: 179460301

1,17946,161
type: chem shift completeness char
of datablock: info:bmrb/17946
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17946
chem shift completeness char.id: 161
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 156
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946,162
type: chem shift completeness char
of datablock: info:bmrb/17946
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chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
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chem shift completeness char.methyl chem shift 13c coverage: 1.000
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chem shift completeness char.methyl chem shift coverage: 1.000
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chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 179460301

1,17946
type: chem shift completeness list
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reference to entry: entry
chem shift completeness list.assigned chem shift list id: 1
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chem shift completeness list.arom chem shift 13c fraction: 9/71
chem shift completeness list.arom chem shift 15n fraction: 3/3
chem shift completeness list.arom chem shift 1h fraction: 15/74
chem shift completeness list.arom chem shift fraction: 27/148
chem shift completeness list.assigned residue coverage: 0.994
chem shift completeness list.bb chem shift 13c fraction: 472/476
chem shift completeness list.bb chem shift 15n fraction: 153/154
chem shift completeness list.bb chem shift 1h fraction: 320/326
chem shift completeness list.bb chem shift fraction: 945/956
chem shift completeness list.chem shift 13c fraction: 661/741
chem shift completeness list.chem shift 15n fraction: 171/172
chem shift completeness list.chem shift 1h fraction: 860/974
chem shift completeness list.chem shift fraction: 1692/1887
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr17946_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 13c fraction: 103/103
chem shift completeness list.methyl chem shift 1h fraction: 103/103
chem shift completeness list.methyl chem shift fraction: 206/206
chem shift completeness list.output file name: bmr17946_chem_shift_completeness.str
chem shift completeness list.queried date: 2020-07-22Z
chem shift completeness list.sc chem shift 13c fraction: 340/417
chem shift completeness list.sc chem shift 15n fraction: 18/18
chem shift completeness list.sc chem shift 1h fraction: 540/648
chem shift completeness list.sc chem shift fraction: 898/1083
chem shift completeness list.sf category: chem_shift_completeness_list
chem shift completeness list.sf framecode: chem_shift_completeness_list_1
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1,17946,1
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1,17946,2
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1,17946,4
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13,C,1,17946,DSS
type: chem shift ref
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chem shift ref.atom isotope number: 13
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chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 0.2514495
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
chem shift ref.ref type: indirect

1,H,1,17946,DSS
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chem shift ref.mol common name: DSS
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chem shift ref.indirect shift ratio: 1.000000
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

15,N,1,17946,DSS
type: chem shift ref
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chem shift ref.atom isotope number: 15
chem shift ref.atom type: N
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chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 0.1013291
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
chem shift ref.ref type: indirect

17946,1
type: chem shift reference
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chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chemical_shift_reference_1

17946,1
type: citation
of datablock: info:bmrb/17946
reference to entry: entry
citation.entry id: 17946
citation.id: 1
citation.class: entry citation
citation.doi: 10.1007/s12104-012-9378-x
citation.journal abbrev: Biomol. NMR Assign.
citation.journal issn: 1874-2718
citation.journal issue: 1
citation.journal name full: Biomolecular NMR assignments
citation.journal volume: 7
citation.page first: 61
citation.page last: 64
citation.pubmed id: 22415546
citation.sf category: citations
citation.sf framecode: entry_citation
citation.status: published
citation.title: Aliphatic (1)H, (13)C and (15)N chemical shift assignments of dihydrofolate reductase from the psychropiezophile Moritella profunda in complex with NADP(+) and folate.
citation.type: journal
citation.year: 2013

info:doi/10.1007/s12104-012-9378-x

doi:10.1007/s12104-012-9378-x

urn:ISSN:1874-2718

issn:1874-2718

info:pmid/22415546

pubmed:22415546

1,17946,1
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 1
citation author.family name: Loveridge
citation author.given name: E. Joel
citation author.pdbx name: Loveridge, E.

1,17946,2
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 2
citation author.family name: Matthews
citation author.given name: Stella
citation author.middle initials: M.
citation author.pdbx name: Matthews, S.M.

1,17946,3
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 3
citation author.family name: Williams
citation author.given name: Christopher
citation author.pdbx name: Williams, C.

1,17946,4
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 4
citation author.family name: Whittaker
citation author.given name: Sara B-M
citation author.pdbx name: Whittaker, S.

1,17946,5
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 5
citation author.family name: Gunther
citation author.given name: Ulrich
citation author.middle initials: L.
citation author.pdbx name: Gunther, U.L.

1,17946,6
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 6
citation author.family name: Evans
citation author.given name: Rhiannon
citation author.middle initials: M.
citation author.pdbx name: Evans, R.M.

1,17946,7
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 7
citation author.family name: Dawson
citation author.given name: William
citation author.middle initials: M.
citation author.pdbx name: Dawson, W.M.

1,17946,8
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 8
citation author.family name: Crump
citation author.given name: Matthew
citation author.middle initials: P.
citation author.pdbx name: Crump, M.P.

1,17946,9
type: citation author
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citation author.citation id: 1
citation author.entry id: 17946
citation author.ordinal: 9
citation author.family name: Allemann
citation author.given name: Rudolf
citation author.middle initials: K.
citation author.pdbx name: Allemann, R.K.

1,17946,Conformational heterogeneity
type: citation keyword
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citation keyword.citation id: 1
citation keyword.entry id: 17946
citation keyword.keyword: Conformational heterogeneity

1,17946,Dihydrofolate reductase
type: citation keyword
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citation keyword.citation id: 1
citation keyword.entry id: 17946
citation keyword.keyword: Dihydrofolate reductase

1,17946,Moritella profunda
type: citation keyword
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citation keyword.citation id: 1
citation keyword.entry id: 17946
citation keyword.keyword: Moritella profunda

17946,assigned chemical shifts
type: data set
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reference to entry: entry
data set.entry id: 17946
data set.type: assigned_chemical_shifts
data set.count: 1

17946,13C chemical shifts
type: datum
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reference to entry: entry
datum.entry id: 17946
datum.type: 13C chemical shifts
datum.count: 665

17946,15N chemical shifts
type: datum
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reference to entry: entry
datum.entry id: 17946
datum.type: 15N chemical shifts
datum.count: 169

17946,1H chemical shifts
type: datum
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reference to entry: entry
datum.entry id: 17946
datum.type: 1H chemical shifts
datum.count: 1062

17946,1
type: entity
of datablock: info:bmrb/17946
reference to entry: entry
entity.entry id: 17946
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: yes
entity.db query revised last date: 2015-11-24Z
entity.ec number: 1.5.1.3
entity.formula weight: 18290.61
entity.name: Dihydrofolate reductase from Moritella profunda
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 162
entity.paramagnetic: no
entity.parent entity id: 0
entity.polymer seq one letter code: MIVSMIAALANNRVIGLDNKMPWHLPAELQLFKRATLGKPIVMGRNTFESIGRPLPGRLNIVLSRQTDYQPEGVTVVATLEDAVVAAGDVEELMIIGGATIYNQCLAAADRLYLTHIELTTEGDTWFPDYEQYNWQEIEHESYAADDKNPHNYRFSLLERVK
entity.polymer seq one letter code can: MIVSMIAALANNRVIGLDNKMPWHLPAELQLFKRATLGKPIVMGRNTFESIGRPLPGRLNIVLSRQTDYQPEGVTVVATLEDAVVAAGDVEELMIIGGATIYNQCLAAADRLYLTHIELTTEGDTWFPDYEQYNWQEIEHESYAADDKNPHNYRFSLLERVK
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: Dihydrofolate_reductase_from_Moritella_profunda
entity.thiol state: free and disulfide bound
entity.type: polymer

17946,2
type: entity
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reference to entry: entry
entity.entry id: 17946
entity.id: 2
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 743.405
entity.name: NAP
entity.nonpolymer comp id: NAP
entity.nonpolymer comp label: chem_comp_NAP
entity.nstd chirality: no
entity.nstd linkage: no
entity.parent entity id: 2
entity.polymer seq one letter code can: (NAP)
entity.sf category: entity
entity.sf framecode: NAP
entity.type: non-polymer

17946,3
type: entity
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reference to entry: entry
entity.entry id: 17946
entity.id: 3
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 441.397
entity.name: FOL
entity.nonpolymer comp id: FOL
entity.nonpolymer comp label: chem_comp_FOL
entity.nstd chirality: no
entity.nstd linkage: no
entity.parent entity id: 3
entity.polymer seq one letter code can: (FOL)
entity.sf category: entity
entity.sf framecode: FOL
entity.type: non-polymer

1,17946,1
type: entity assembly
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entity assembly.assembly id: 1
entity assembly.entry id: 17946
entity assembly.id: 1
entity assembly.asym id: A
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Dihydrofolate reductase from Moritella profunda
entity assembly.entity id: 1
entity assembly.entity label: Dihydrofolate_reductase_from_Moritella_profunda
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,17946,2
type: entity assembly
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entity assembly.assembly id: 1
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entity assembly.id: 2
entity assembly.asym id: A
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: NADP+
entity assembly.entity id: 2
entity assembly.entity label: NAP
entity assembly.experimental data reported: no
entity assembly.physical state: native

1,17946,3
type: entity assembly
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entity assembly.assembly id: 1
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entity assembly.id: 3
entity assembly.asym id: A
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Folate
entity assembly.entity id: 3
entity assembly.entity label: FOL
entity assembly.experimental data reported: no
entity assembly.physical state: native

5,6,7,8-tetrahydrofolate : NADP+ oxidoreductase,1,17946
type: entity biological function
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entity biological function.biological function: 5,6,7,8-tetrahydrofolate : NADP+ oxidoreductase
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reductase,1,17946
type: entity biological function
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entity biological function.biological function: reductase
entity biological function.entity id: 1
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1,17946,1
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entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 151
entity comp index.comp id: HIS

1,17946,152
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 152
entity comp index.comp id: ASN

1,17946,153
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 153
entity comp index.comp id: TYR

1,17946,154
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 154
entity comp index.comp id: ARG

1,17946,155
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 155
entity comp index.comp id: PHE

1,17946,156
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 156
entity comp index.comp id: SER

1,17946,157
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 157
entity comp index.comp id: LEU

1,17946,158
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 158
entity comp index.comp id: LEU

1,17946,159
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 159
entity comp index.comp id: GLU

1,17946,160
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 160
entity comp index.comp id: ARG

1,17946,161
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 161
entity comp index.comp id: VAL

1,17946,162
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 1
entity comp index.entry id: 17946
entity comp index.id: 162
entity comp index.comp id: LYS

2,17946,163
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 2
entity comp index.entry id: 17946
entity comp index.id: 163
entity comp index.comp id: NAP

3,17946,164
type: entity comp index
of datablock: info:bmrb/17946
entity comp index.entity id: 3
entity comp index.entry id: 17946
entity comp index.id: 164
entity comp index.comp id: FOL

2ZZA,PDB,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: 2ZZA
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: Moritella Profunda Dihydrofolate Reductase Complex With Nadp+ And Folate
entity db link.ordinal: 1
entity db link.seq homology expectation val: 3.64E-115
entity db link.seq identity: 99.38
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 162

info:pdb/2ZZA

pdb:2ZZA

3IA4,PDB,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: 3IA4
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: Moritella Profunda Dihydrofolate Reductase (Dhfr) In Complex With Nadph And Methotrexate (Mtx)
entity db link.ordinal: 2
entity db link.seq homology expectation val: 5.86E-116
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 162

info:pdb/3IA4

pdb:3IA4

3IA5,PDB,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: 3IA5
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: Moritella Profunda Dihydrofolate Reductase (Dhfr)
entity db link.ordinal: 3
entity db link.seq homology expectation val: 5.86E-116
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 162

info:pdb/3IA5

pdb:3IA5

BAI50910,DBJ,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: BAI50910
entity db link.database code: DBJ
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: dihydrofolate reductase [Moritella yayanosii]
entity db link.ordinal: 4
entity db link.seq homology expectation val: 8.68E-109
entity db link.seq identity: 97.47
entity db link.seq positive: 98.73
entity db link.seq query to submitted percent: 97.53
entity db link.seq subject length: 158

info:ddbj-embl-genbank/BAI50910

ncbiprotein:BAI50910

BAO02847,DBJ,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: BAO02847
entity db link.database code: DBJ
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: dihydrofolate reductase [Moritella abyssi]
entity db link.ordinal: 5
entity db link.seq homology expectation val: 3.05E-111
entity db link.seq identity: 98.73
entity db link.seq positive: 99.37
entity db link.seq query to submitted percent: 97.53
entity db link.seq subject length: 158

info:ddbj-embl-genbank/BAO02847

ncbiprotein:BAO02847

CAD32276,EMBL,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: CAD32276
entity db link.database code: EMBL
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: dihydrofolate reductase [Moritella profunda]
entity db link.ordinal: 6
entity db link.seq homology expectation val: 5.86E-116
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 162

info:ddbj-embl-genbank/CAD32276

ncbiprotein:CAD32276

EDM69127,GB,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: EDM69127
entity db link.database code: GB
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: putative Dihydrofolate reductase [Moritella sp. PE36]
entity db link.ordinal: 7
entity db link.seq homology expectation val: 1.46E-110
entity db link.seq identity: 98.10
entity db link.seq positive: 98.73
entity db link.seq query to submitted percent: 97.53
entity db link.seq subject length: 158

info:ddbj-embl-genbank/EDM69127

ncbiprotein:EDM69127

WP 043993544,REF,1,17946
type: entity db link
of datablock: info:bmrb/17946
entity db link.accession code: WP_043993544
entity db link.database code: REF
entity db link.entity id: 1
entity db link.entry id: 17946
entity db link.author supplied: no
entity db link.entry mol name: diacylglycerol kinase [Moritella sp. PE36]
entity db link.ordinal: 8
entity db link.seq homology expectation val: 1.5E-113
entity db link.seq identity: 98.15
entity db link.seq positive: 98.77
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 162

info:refseq/WP_043993544

refseq:WP_043993544

1,17946,1
type: entity experimental src
of datablock: info:bmrb/17946
entity experimental src.entity experimental src list id: 1
entity experimental src.entry id: 17946
entity experimental src.id: 1
entity experimental src.citation id: 0
entity experimental src.entity chimera segment id: 0
entity experimental src.entity id: 1
entity experimental src.entity label: Dihydrofolate_reductase_from_Moritella_profunda
entity experimental src.host org genus: Escherichia
entity experimental src.host org name common: E. coli
entity experimental src.host org ncbi taxonomy id: 562
entity experimental src.host org scientific name: Escherichia coli
entity experimental src.host org species: coli
entity experimental src.host org strain: BL21-CodonPlus(DE3)-RIL
entity experimental src.production method: recombinant technology
entity experimental src.vector name: pJGetit

info:taxonomy/562

taxonomy:562

17946,1
type: entity experimental src list
of datablock: info:bmrb/17946
reference to entry: entry
entity experimental src list.entry id: 17946
entity experimental src list.id: 1
entity experimental src list.sf category: experimental_source
entity experimental src list.sf framecode: experimental_source

1,17946,1
type: entity natural src
of datablock: info:bmrb/17946
reference to entry: entry
entity natural src.entity natural src list id: 1
entity natural src.entry id: 17946
entity natural src.id: 1
entity natural src.citation id: 0
entity natural src.entity chimera segment id: 0
entity natural src.entity id: 1
entity natural src.entity label: Dihydrofolate_reductase_from_Moritella_profunda
entity natural src.gene mnemonic: dyrA
entity natural src.genus: Moritella
entity natural src.kingdom: Not applicable
entity natural src.ncbi taxonomy id: 111291
entity natural src.organism name common: Moritella profunda
entity natural src.organism name scientific: Moritella profunda
entity natural src.species: profunda
entity natural src.superkingdom: Bacteria
entity natural src.type: organism

info:taxonomy/111291

taxonomy:111291

17946,1
type: entity natural src list
of datablock: info:bmrb/17946
reference to entry: entry
entity natural src list.entry id: 17946
entity natural src list.id: 1
entity natural src list.sf category: natural_source
entity natural src list.sf framecode: natural_source

1,17946,1
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 1
entity poly seq.comp index id: 1
entity poly seq.mon id: MET

1,17946,2
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 2
entity poly seq.comp index id: 2
entity poly seq.mon id: ILE

1,17946,3
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 3
entity poly seq.comp index id: 3
entity poly seq.mon id: VAL

1,17946,4
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 4
entity poly seq.comp index id: 4
entity poly seq.mon id: SER

1,17946,5
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 5
entity poly seq.comp index id: 5
entity poly seq.mon id: MET

1,17946,6
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 6
entity poly seq.comp index id: 6
entity poly seq.mon id: ILE

1,17946,7
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 7
entity poly seq.comp index id: 7
entity poly seq.mon id: ALA

1,17946,8
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 8
entity poly seq.comp index id: 8
entity poly seq.mon id: ALA

1,17946,9
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 9
entity poly seq.comp index id: 9
entity poly seq.mon id: LEU

1,17946,10
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 10
entity poly seq.comp index id: 10
entity poly seq.mon id: ALA

1,17946,11
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 11
entity poly seq.comp index id: 11
entity poly seq.mon id: ASN

1,17946,12
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 12
entity poly seq.comp index id: 12
entity poly seq.mon id: ASN

1,17946,13
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 13
entity poly seq.comp index id: 13
entity poly seq.mon id: ARG

1,17946,14
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 14
entity poly seq.comp index id: 14
entity poly seq.mon id: VAL

1,17946,15
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 15
entity poly seq.comp index id: 15
entity poly seq.mon id: ILE

1,17946,16
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 16
entity poly seq.comp index id: 16
entity poly seq.mon id: GLY

1,17946,17
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 17
entity poly seq.comp index id: 17
entity poly seq.mon id: LEU

1,17946,18
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 18
entity poly seq.comp index id: 18
entity poly seq.mon id: ASP

1,17946,19
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 19
entity poly seq.comp index id: 19
entity poly seq.mon id: ASN

1,17946,20
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 20
entity poly seq.comp index id: 20
entity poly seq.mon id: LYS

1,17946,21
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 21
entity poly seq.comp index id: 21
entity poly seq.mon id: MET

1,17946,22
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 22
entity poly seq.comp index id: 22
entity poly seq.mon id: PRO

1,17946,23
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 23
entity poly seq.comp index id: 23
entity poly seq.mon id: TRP

1,17946,24
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 24
entity poly seq.comp index id: 24
entity poly seq.mon id: HIS

1,17946,25
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 25
entity poly seq.comp index id: 25
entity poly seq.mon id: LEU

1,17946,26
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 26
entity poly seq.comp index id: 26
entity poly seq.mon id: PRO

1,17946,27
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 27
entity poly seq.comp index id: 27
entity poly seq.mon id: ALA

1,17946,28
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 28
entity poly seq.comp index id: 28
entity poly seq.mon id: GLU

1,17946,29
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 29
entity poly seq.comp index id: 29
entity poly seq.mon id: LEU

1,17946,30
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 30
entity poly seq.comp index id: 30
entity poly seq.mon id: GLN

1,17946,31
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 31
entity poly seq.comp index id: 31
entity poly seq.mon id: LEU

1,17946,32
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 32
entity poly seq.comp index id: 32
entity poly seq.mon id: PHE

1,17946,33
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 33
entity poly seq.comp index id: 33
entity poly seq.mon id: LYS

1,17946,34
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 34
entity poly seq.comp index id: 34
entity poly seq.mon id: ARG

1,17946,35
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 35
entity poly seq.comp index id: 35
entity poly seq.mon id: ALA

1,17946,36
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 36
entity poly seq.comp index id: 36
entity poly seq.mon id: THR

1,17946,37
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 37
entity poly seq.comp index id: 37
entity poly seq.mon id: LEU

1,17946,38
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 38
entity poly seq.comp index id: 38
entity poly seq.mon id: GLY

1,17946,39
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 39
entity poly seq.comp index id: 39
entity poly seq.mon id: LYS

1,17946,40
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 40
entity poly seq.comp index id: 40
entity poly seq.mon id: PRO

1,17946,41
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 41
entity poly seq.comp index id: 41
entity poly seq.mon id: ILE

1,17946,42
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 42
entity poly seq.comp index id: 42
entity poly seq.mon id: VAL

1,17946,43
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 43
entity poly seq.comp index id: 43
entity poly seq.mon id: MET

1,17946,44
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 44
entity poly seq.comp index id: 44
entity poly seq.mon id: GLY

1,17946,45
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 45
entity poly seq.comp index id: 45
entity poly seq.mon id: ARG

1,17946,46
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 46
entity poly seq.comp index id: 46
entity poly seq.mon id: ASN

1,17946,47
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 47
entity poly seq.comp index id: 47
entity poly seq.mon id: THR

1,17946,48
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 48
entity poly seq.comp index id: 48
entity poly seq.mon id: PHE

1,17946,49
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 49
entity poly seq.comp index id: 49
entity poly seq.mon id: GLU

1,17946,50
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 50
entity poly seq.comp index id: 50
entity poly seq.mon id: SER

1,17946,51
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 51
entity poly seq.comp index id: 51
entity poly seq.mon id: ILE

1,17946,52
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 52
entity poly seq.comp index id: 52
entity poly seq.mon id: GLY

1,17946,53
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 53
entity poly seq.comp index id: 53
entity poly seq.mon id: ARG

1,17946,54
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 54
entity poly seq.comp index id: 54
entity poly seq.mon id: PRO

1,17946,55
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 55
entity poly seq.comp index id: 55
entity poly seq.mon id: LEU

1,17946,56
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 56
entity poly seq.comp index id: 56
entity poly seq.mon id: PRO

1,17946,57
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 57
entity poly seq.comp index id: 57
entity poly seq.mon id: GLY

1,17946,58
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 58
entity poly seq.comp index id: 58
entity poly seq.mon id: ARG

1,17946,59
type: entity poly seq
of datablock: info:bmrb/17946
entity poly seq.entity id: 1
entity poly seq.entry id: 17946
entity poly seq.num: 59
entity poly seq.comp index id: 59
entity poly seq.mon id: LEU

1,17946,60
type: entity poly seq
of datablock: info:bmrb/17946
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entry.id: 17946
entry.accession date: 2011-09-18Z
entry.details: Aliphatic resonance assignments
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2013-04-11Z
entry.nmr star version: 3.1.1.61
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entry.original release date: 2011-09-22Z
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entry.submission date: 2011-09-18Z
entry.title: Aliphatic 1H, 13C, and 15N chemical shift assignments of dihydrofolate reductase from the psychropiezophile Moritella profunda in complex with NADP+ and folate
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17946,23,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 23
lacs char.lacs plot id: 1
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.69
lacs char.y coord val: -0.51

17946,24,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 24
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: GLU
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lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -0.66
lacs char.y coord val: 0.08

17946,25,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 25
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: SER
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lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.04
lacs char.y coord val: -0.53

17946,26,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 26
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: TYR
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lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -3.36
lacs char.y coord val: -1.93

17946,27,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 27
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ALA
lacs char.comp index id: 144
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -0.69
lacs char.y coord val: -0.12

17946,28,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 28
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ALA
lacs char.comp index id: 145
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.80
lacs char.y coord val: -1.24

17946,29,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 29
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASP
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lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 3.71
lacs char.y coord val: 2.72

17946,30,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 30
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASP
lacs char.comp index id: 147
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.56
lacs char.y coord val: -0.32

17946,31,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 31
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LYS
lacs char.comp index id: 148
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -2.82
lacs char.y coord val: -0.34

17946,32,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 32
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASN
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lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -5.63
lacs char.y coord val: -1.62

17946,33,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 33
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: HIS
lacs char.comp index id: 151
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -0.10
lacs char.y coord val: 0.04

17946,34,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 34
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASN
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lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -3.38
lacs char.y coord val: -1.72

17946,35,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 35
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: TYR
lacs char.comp index id: 153
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.17
lacs char.y coord val: -1.42

17946,36,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 36
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ARG
lacs char.comp index id: 154
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.16
lacs char.y coord val: -0.78

17946,37,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 37
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: PHE
lacs char.comp index id: 155
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -3.24
lacs char.y coord val: -1.48

17946,38,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 38
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: SER
lacs char.comp index id: 156
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -3.52
lacs char.y coord val: -1.76

17946,39,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 39
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 157
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.71
lacs char.y coord val: -2.19

17946,40,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 40
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 158
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -5.93
lacs char.y coord val: -2.05

17946,41,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 41
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: GLU
lacs char.comp index id: 159
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 0.06
lacs char.y coord val: 0.17

17946,42,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 42
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ARG
lacs char.comp index id: 160
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 0.77
lacs char.y coord val: 0.18

17946,43,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 43
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: VAL
lacs char.comp index id: 161
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 1.39
lacs char.y coord val: 1.85

17946,44,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 44
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASN
lacs char.comp index id: 46
lacs char.designator: 0
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 5.54
lacs char.y coord val: 6.99

17946,45,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 45
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ALA
lacs char.comp index id: 10
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.87
lacs char.y coord val: -2.19

17946,46,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 46
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASN
lacs char.comp index id: 11
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 2.31
lacs char.y coord val: 1.42

17946,47,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 47
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASN
lacs char.comp index id: 12
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 3.03
lacs char.y coord val: 1.75

17946,48,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 48
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ARG
lacs char.comp index id: 13
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 4.59
lacs char.y coord val: 1.95

17946,49,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 49
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: VAL
lacs char.comp index id: 14
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 3.56
lacs char.y coord val: 3.71

17946,50,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 50
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ILE
lacs char.comp index id: 15
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.72
lacs char.y coord val: -0.85

17946,51,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 51
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 17
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.26
lacs char.y coord val: 0.57

17946,52,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 52
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASP
lacs char.comp index id: 18
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 3.57
lacs char.y coord val: 1.54

17946,53,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 53
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ASN
lacs char.comp index id: 19
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 1.00
lacs char.y coord val: 1.53

17946,54,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 54
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LYS
lacs char.comp index id: 20
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.50
lacs char.y coord val: -1.93

17946,55,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 55
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: MET
lacs char.comp index id: 21
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -0.58
lacs char.y coord val: -1.20

17946,56,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 56
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: TRP
lacs char.comp index id: 23
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -0.23
lacs char.y coord val: -0.19

17946,57,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 57
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: HIS
lacs char.comp index id: 24
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -0.18
lacs char.y coord val: 1.72

17946,58,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 58
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 25
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -4.66
lacs char.y coord val: -1.87

17946,59,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 59
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ALA
lacs char.comp index id: 27
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 3.48
lacs char.y coord val: 2.37

17946,60,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 60
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: GLU
lacs char.comp index id: 28
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 2.89
lacs char.y coord val: 3.53

17946,61,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 61
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 29
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 2.58
lacs char.y coord val: 2.09

17946,62,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 62
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: GLN
lacs char.comp index id: 30
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 4.20
lacs char.y coord val: 2.28

17946,63,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 63
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 31
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 5.39
lacs char.y coord val: 3.36

17946,64,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 64
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: PHE
lacs char.comp index id: 32
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 5.42
lacs char.y coord val: 3.48

17946,65,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 65
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LYS
lacs char.comp index id: 33
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 4.07
lacs char.y coord val: 4.03

17946,66,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 66
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ARG
lacs char.comp index id: 34
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 4.08
lacs char.y coord val: 3.28

17946,67,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 67
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: ALA
lacs char.comp index id: 35
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 0.75
lacs char.y coord val: 1.15

17946,68,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 68
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: THR
lacs char.comp index id: 36
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.47
lacs char.y coord val: -0.01

17946,69,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 69
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LEU
lacs char.comp index id: 37
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: 3.21
lacs char.y coord val: 2.66

17946,70,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 70
lacs char.lacs plot id: 1
lacs char.assembly id: 1
lacs char.comp id: LYS
lacs char.comp index id: 39
lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460101
lacs char.x coord val: -1.49
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17946,71,1
type: lacs char
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reference to entry: entry
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17946,72,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,73,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,74,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,75,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,76,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,77,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,78,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,79,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,80,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,81,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,82,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,83,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,84,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,85,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,86,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,87,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,88,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,89,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,90,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,91,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,92,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,93,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,94,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,95,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,96,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 1
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17946,97,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,98,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 1
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17946,99,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,100,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,101,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,102,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 1
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17946,103,1
type: lacs char
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reference to entry: entry
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17946,104,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,105,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,106,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,107,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,108,1
type: lacs char
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reference to entry: entry
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17946,109,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,110,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,111,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,112,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,113,1
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,114,1
type: lacs char
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reference to entry: entry
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17946,115,1
type: lacs char
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reference to entry: entry
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17946,116,1
type: lacs char
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reference to entry: entry
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17946,117,1
type: lacs char
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reference to entry: entry
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17946,118,1
type: lacs char
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reference to entry: entry
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17946,119,1
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17946,120,1
type: lacs char
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17946,121,1
type: lacs char
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17946,122,1
type: lacs char
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17946,123,1
type: lacs char
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17946,124,1
type: lacs char
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17946,125,1
type: lacs char
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17946,126,1
type: lacs char
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17946,127,1
type: lacs char
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17946,128,1
type: lacs char
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17946,129,1
type: lacs char
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17946,130,1
type: lacs char
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17946,131,1
type: lacs char
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17946,132,1
type: lacs char
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17946,133,1
type: lacs char
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17946,134,2
type: lacs char
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17946,135,2
type: lacs char
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reference to entry: entry
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17946,136,2
type: lacs char
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17946,137,2
type: lacs char
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17946,138,2
type: lacs char
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17946,139,2
type: lacs char
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17946,140,2
type: lacs char
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reference to entry: entry
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17946,141,2
type: lacs char
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17946,142,2
type: lacs char
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17946,143,2
type: lacs char
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17946,144,2
type: lacs char
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reference to entry: entry
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17946,145,2
type: lacs char
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17946,146,2
type: lacs char
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17946,147,2
type: lacs char
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17946,148,2
type: lacs char
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17946,149,2
type: lacs char
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17946,150,2
type: lacs char
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17946,151,2
type: lacs char
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17946,152,2
type: lacs char
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17946,153,2
type: lacs char
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17946,154,2
type: lacs char
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17946,155,2
type: lacs char
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17946,156,2
type: lacs char
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17946,157,2
type: lacs char
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17946,158,2
type: lacs char
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17946,159,2
type: lacs char
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17946,160,2
type: lacs char
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17946,161,2
type: lacs char
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17946,162,2
type: lacs char
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17946,163,2
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17946,164,2
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17946,165,2
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17946,166,2
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17946,167,2
type: lacs char
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reference to entry: entry
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lacs char.y coord val: 3.97

17946,168,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.y coord val: 2.64

17946,169,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.y coord val: 4.18

17946,170,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: 0.74

17946,171,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: 0.51

17946,172,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.y coord val: 1.43

17946,173,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,174,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
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17946,175,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: -0.99

17946,176,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: 1.24

17946,177,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: 2.48

17946,178,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -5.63
lacs char.y coord val: 4.01

17946,179,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
lacs char.id: 179
lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.designator: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -0.10
lacs char.y coord val: 0.14

17946,180,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -3.38
lacs char.y coord val: 1.66

17946,181,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -4.17
lacs char.y coord val: 2.75

17946,182,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -4.16
lacs char.y coord val: 3.38

17946,183,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -3.24
lacs char.y coord val: 1.76

17946,184,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.designator: 1
lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -3.52
lacs char.y coord val: 1.76

17946,185,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -4.71
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17946,186,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
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17946,187,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: 0.06
lacs char.y coord val: 0.11

17946,188,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: 0.77
lacs char.y coord val: -0.59

17946,189,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity assembly id: 1
lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: 0.46

17946,190,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: 1.45

17946,191,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.y coord val: -0.32

17946,192,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: -0.89

17946,193,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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17946,194,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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17946,195,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.y coord val: 0.15

17946,196,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,197,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,198,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,199,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,200,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,201,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,202,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,203,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,204,2
type: lacs char
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reference to entry: entry
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17946,205,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,206,2
type: lacs char
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reference to entry: entry
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17946,207,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,208,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,209,2
type: lacs char
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reference to entry: entry
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17946,210,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,211,2
type: lacs char
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reference to entry: entry
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17946,212,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,213,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,214,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,215,2
type: lacs char
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reference to entry: entry
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17946,216,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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17946,217,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.y coord val: 2.23

17946,218,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.y coord val: 1.30

17946,219,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: -1.45

17946,220,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
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17946,221,2
type: lacs char
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reference to entry: entry
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lacs char.lacs plot id: 2
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17946,222,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
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lacs char.y coord val: -1.28

17946,223,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.y coord val: -0.22

17946,224,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: -0.10

17946,225,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.sf id: 179460102
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lacs char.y coord val: -1.84

17946,226,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: -2.01

17946,227,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: 5.42

17946,228,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: -0.66

17946,229,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
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17946,230,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -1.04
lacs char.y coord val: 0.37

17946,231,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: 1.90

17946,232,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
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lacs char.y coord val: -0.60

17946,233,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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lacs char.entity id: 1
lacs char.sf id: 179460102
lacs char.x coord val: -1.72
lacs char.y coord val: 2.12

17946,234,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
lacs char.assembly id: 1
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lacs char.entity id: 1
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17946,235,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,236,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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17946,237,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,238,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,239,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,240,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
lacs char.entry id: 17946
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lacs char.lacs plot id: 2
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17946,241,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,242,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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lacs char.lacs plot id: 2
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17946,243,2
type: lacs char
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reference to entry: entry
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lacs char.lacs plot id: 2
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17946,244,2
type: lacs char
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reference to entry: entry
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17946,245,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,246,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,247,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,248,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,249,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,250,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,251,2
type: lacs char
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reference to entry: entry
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17946,252,2
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,253,2
type: lacs char
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17946,254,2
type: lacs char
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17946,255,2
type: lacs char
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reference to entry: entry
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17946,256,2
type: lacs char
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17946,257,2
type: lacs char
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17946,258,2
type: lacs char
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reference to entry: entry
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17946,259,2
type: lacs char
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17946,260,2
type: lacs char
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reference to entry: entry
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17946,261,2
type: lacs char
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17946,262,2
type: lacs char
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17946,263,2
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17946,264,2
type: lacs char
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17946,265,2
type: lacs char
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17946,266,2
type: lacs char
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17946,267,3
type: lacs char
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17946,268,3
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17946,269,3
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17946,270,3
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17946,271,3
type: lacs char
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17946,272,3
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17946,273,3
type: lacs char
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17946,274,3
type: lacs char
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17946,275,3
type: lacs char
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17946,276,3
type: lacs char
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17946,277,3
type: lacs char
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17946,278,3
type: lacs char
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17946,279,3
type: lacs char
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17946,280,3
type: lacs char
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17946,281,3
type: lacs char
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17946,282,3
type: lacs char
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17946,283,3
type: lacs char
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17946,284,3
type: lacs char
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17946,285,3
type: lacs char
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17946,286,3
type: lacs char
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17946,287,3
type: lacs char
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17946,288,3
type: lacs char
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17946,289,3
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17946,290,3
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17946,291,3
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17946,292,3
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17946,293,3
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17946,294,3
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17946,295,3
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17946,296,3
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17946,314,3
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type: lacs char
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17946,333,3
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17946,335,3
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17946,337,3
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17946,359,3
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17946,360,3
type: lacs char
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17946,361,3
type: lacs char
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17946,362,3
type: lacs char
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17946,363,3
type: lacs char
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17946,364,3
type: lacs char
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17946,365,3
type: lacs char
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17946,366,3
type: lacs char
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17946,367,3
type: lacs char
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17946,368,3
type: lacs char
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17946,369,3
type: lacs char
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17946,370,3
type: lacs char
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17946,371,3
type: lacs char
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17946,372,3
type: lacs char
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17946,373,3
type: lacs char
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17946,374,3
type: lacs char
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17946,375,3
type: lacs char
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17946,376,3
type: lacs char
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17946,377,3
type: lacs char
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17946,378,3
type: lacs char
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17946,379,3
type: lacs char
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17946,380,3
type: lacs char
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17946,381,3
type: lacs char
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17946,382,3
type: lacs char
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17946,383,3
type: lacs char
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17946,384,3
type: lacs char
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17946,385,3
type: lacs char
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17946,386,3
type: lacs char
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17946,387,3
type: lacs char
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17946,388,3
type: lacs char
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17946,389,3
type: lacs char
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17946,390,3
type: lacs char
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17946,391,3
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17946,392,3
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17946,393,3
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17946,394,3
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17946,395,3
type: lacs char
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17946,396,3
type: lacs char
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17946,397,3
type: lacs char
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17946,398,3
type: lacs char
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17946,399,3
type: lacs char
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17946,400,4
type: lacs char
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17946,401,4
type: lacs char
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17946,402,4
type: lacs char
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17946,403,4
type: lacs char
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17946,404,4
type: lacs char
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17946,405,4
type: lacs char
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17946,406,4
type: lacs char
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reference to entry: entry
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17946,407,4
type: lacs char
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reference to entry: entry
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17946,408,4
type: lacs char
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reference to entry: entry
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17946,409,4
type: lacs char
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reference to entry: entry
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17946,410,4
type: lacs char
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reference to entry: entry
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17946,411,4
type: lacs char
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reference to entry: entry
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17946,412,4
type: lacs char
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17946,413,4
type: lacs char
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reference to entry: entry
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17946,414,4
type: lacs char
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reference to entry: entry
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17946,415,4
type: lacs char
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reference to entry: entry
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17946,416,4
type: lacs char
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reference to entry: entry
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17946,417,4
type: lacs char
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reference to entry: entry
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lacs char.sf id: 179460104
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17946,418,4
type: lacs char
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reference to entry: entry
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17946,419,4
type: lacs char
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reference to entry: entry
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lacs char.sf id: 179460104
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17946,420,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,421,4
type: lacs char
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reference to entry: entry
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17946,422,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,423,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,424,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,425,4
type: lacs char
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reference to entry: entry
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17946,426,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,427,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,428,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,429,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,430,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,431,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,432,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,433,4
type: lacs char
of datablock: info:bmrb/17946
reference to entry: entry
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17946,434,4
type: lacs char
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reference to entry: entry
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17946,435,4
type: lacs char
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reference to entry: entry
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17946,436,4
type: lacs char
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reference to entry: entry
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17946,437,4
type: lacs char
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reference to entry: entry
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17946,438,4
type: lacs char
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reference to entry: entry
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17946,439,4
type: lacs char
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17946,440,4
type: lacs char
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17946,441,4
type: lacs char
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17946,442,4
type: lacs char
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17946,443,4
type: lacs char
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17946,444,4
type: lacs char
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17946,445,4
type: lacs char
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17946,446,4
type: lacs char
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17946,447,4
type: lacs char
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17946,448,4
type: lacs char
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17946,449,4
type: lacs char
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17946,450,4
type: lacs char
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17946,451,4
type: lacs char
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17946,452,4
type: lacs char
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17946,453,4
type: lacs char
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17946,454,4
type: lacs char
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17946,455,4
type: lacs char
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17946,456,4
type: lacs char
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17946,457,4
type: lacs char
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17946,458,4
type: lacs char
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17946,459,4
type: lacs char
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17946,460,4
type: lacs char
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17946,461,4
type: lacs char
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17946,462,4
type: lacs char
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17946,463,4
type: lacs char
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17946,464,4
type: lacs char
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17946,465,4
type: lacs char
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17946,466,4
type: lacs char
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17946,467,4
type: lacs char
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17946,468,4
type: lacs char
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17946,469,4
type: lacs char
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17946,470,4
type: lacs char
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17946,471,4
type: lacs char
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17946,472,4
type: lacs char
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17946,473,4
type: lacs char
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17946,474,4
type: lacs char
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17946,475,4
type: lacs char
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17946,476,4
type: lacs char
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17946,477,4
type: lacs char
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17946,478,4
type: lacs char
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17946,479,4
type: lacs char
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17946,480,4
type: lacs char
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17946,481,4
type: lacs char
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17946,482,4
type: lacs char
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17946,483,4
type: lacs char
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17946,484,4
type: lacs char
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type: lacs char
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type: lacs char
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type: lacs char
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type: lacs char
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17946,489,4
type: lacs char
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17946,490,4
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type: lacs char
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type: lacs char
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17946,493,4
type: lacs char
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type: lacs char
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17946,498,4
type: lacs char
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17946,499,4
type: lacs char
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17946,500,4
type: lacs char
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17946,501,4
type: lacs char
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17946,502,4
type: lacs char
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17946,503,4
type: lacs char
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17946,504,4
type: lacs char
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17946,505,4
type: lacs char
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reference to entry: entry
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17946,506,4
type: lacs char
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17946,507,4
type: lacs char
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17946,508,4
type: lacs char
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17946,509,4
type: lacs char
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17946,510,4
type: lacs char
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17946,511,4
type: lacs char
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17946,512,4
type: lacs char
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17946,513,4
type: lacs char
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17946,514,4
type: lacs char
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17946,515,4
type: lacs char
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17946,516,4
type: lacs char
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17946,517,4
type: lacs char
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17946,518,4
type: lacs char
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17946,519,4
type: lacs char
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17946,520,4
type: lacs char
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17946,521,4
type: lacs char
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17946,522,4
type: lacs char
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17946,523,4
type: lacs char
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17946,524,4
type: lacs char
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17946,525,4
type: lacs char
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17946,526,4
type: lacs char
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17946,527,4
type: lacs char
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17946,528,4
type: lacs char
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17946,529,4
type: lacs char
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17946,530,4
type: lacs char
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17946,531,4
type: lacs char
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17946,1
type: lacs plot
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reference to entry: entry
lacs plot.entry id: 17946
lacs plot.id: 1
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr17946_LACS.str
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lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: -2.72
lacs plot.line 1 terminator val y 2: 0.83
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lacs plot.line 2 terminator val y 1: -1.45
lacs plot.line 2 terminator val y 2: 5.08
lacs plot.output file name: bmr17946_LACS.str
lacs plot.queried date: 2021-09-30Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CA_output
lacs plot.sf id: 179460101
lacs plot.source release date: 2015-03-31Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: -0.03
lacs plot.y coord name: CA

17946,2
type: lacs plot
of datablock: info:bmrb/17946
reference to entry: entry
lacs plot.entry id: 17946
lacs plot.id: 2
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr17946_LACS.str
lacs plot.input file name: bmr17946_21.str
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lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 4.56
lacs plot.line 1 terminator val y 2: -1.17
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 7.02
lacs plot.line 2 terminator val y 1: 0.55
lacs plot.line 2 terminator val y 2: -1.94
lacs plot.output file name: bmr17946_LACS.str
lacs plot.queried date: 2021-09-30Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CB_output
lacs plot.sf id: 179460102
lacs plot.source release date: 2015-03-31Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: -0.03
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17946,3
type: lacs plot
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reference to entry: entry
lacs plot.entry id: 17946
lacs plot.id: 3
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr17946_LACS.str
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lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 0.90
lacs plot.line 1 terminator val y 2: -0.20
lacs plot.line 2 terminator val x 1: -2.00
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lacs plot.line 2 terminator val y 1: 0.29
lacs plot.line 2 terminator val y 2: -0.77
lacs plot.output file name: bmr17946_LACS.str
lacs plot.queried date: 2021-09-30Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_HA_output
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lacs plot.source release date: 2015-03-31Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: -0.04
lacs plot.y coord name: HA

17946,4
type: lacs plot
of datablock: info:bmrb/17946
reference to entry: entry
lacs plot.entry id: 17946
lacs plot.id: 4
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr17946_LACS.str
lacs plot.input file name: bmr17946_21.str
lacs plot.line 1 terminator val x 1: -7.28
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: -2.98
lacs plot.line 1 terminator val y 2: 0.34
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 7.02
lacs plot.line 2 terminator val y 1: -1.22
lacs plot.line 2 terminator val y 2: 2.43
lacs plot.output file name: bmr17946_LACS.str
lacs plot.queried date: 2021-09-30Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CO_output
lacs plot.sf id: 179460104
lacs plot.source release date: 2015-03-31Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: 0.39
lacs plot.y coord name: CO

17946,1
type: nmr spec expt
of datablock: info:bmrb/17946
reference to entry: entry
nmr spec expt.entry id: 17946
nmr spec expt.id: 1
nmr spec expt.method id: 0
nmr spec expt.name: na
nmr spec expt.nmr spectrometer id: 0
nmr spec expt.nmr spectrometer label: na
nmr spec expt.nmr spectrometer probe id: 0
nmr spec expt.sf category: NMR_spectrometer_expt
nmr spec expt.sf framecode: NMR_spectrometer_expt
nmr spec expt.software id: 1
nmr spec expt.software label: NMRPipe

17946,1
type: nmr spectrometer
of datablock: info:bmrb/17946
reference to entry: entry
nmr spectrometer.entry id: 17946
nmr spectrometer.id: 1
nmr spectrometer.field strength: 600
nmr spectrometer.manufacturer: Varian
nmr spectrometer.model: VNMRS
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: Bristol_VNMRS_600

17946,2
type: nmr spectrometer
of datablock: info:bmrb/17946
reference to entry: entry
nmr spectrometer.entry id: 17946
nmr spectrometer.id: 2
nmr spectrometer.field strength: 900
nmr spectrometer.manufacturer: Varian
nmr spectrometer.model: INOVA
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: Birmingham_INOVA_900

17946,1
type: nmr spectrometer list
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reference to entry: entry
nmr spectrometer list.entry id: 17946
nmr spectrometer list.id: 1
nmr spectrometer list.sf category: NMR_spectrometer_list
nmr spectrometer list.sf framecode: NMR_spectrometer_list

17946,1,Bristol VNMRS 600,1
type: nmr spectrometer view
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nmr spectrometer view.entry id: 17946
nmr spectrometer view.id: 1
nmr spectrometer view.name: Bristol_VNMRS_600
nmr spectrometer view.nmr spectrometer list id: 1
nmr spectrometer view.citation id: 0
nmr spectrometer view.field strength: 600
nmr spectrometer view.manufacturer: Varian
nmr spectrometer view.model: VNMRS

17946,2,Birmingham INOVA 900,1
type: nmr spectrometer view
of datablock: info:bmrb/17946
nmr spectrometer view.entry id: 17946
nmr spectrometer view.id: 2
nmr spectrometer view.name: Birmingham_INOVA_900
nmr spectrometer view.nmr spectrometer list id: 1
nmr spectrometer view.citation id: 0
nmr spectrometer view.field strength: 900
nmr spectrometer view.manufacturer: Varian
nmr spectrometer view.model: INOVA

5740,BMRB,17946
type: related entries
of datablock: info:bmrb/17946
reference to entry: entry
related entries.database accession code: 5740
related entries.database name: BMRB
related entries.entry id: 17946
related entries.relationship: Backbone assignments for the related E. coli DHFR:NADP+:folate complex

info:bmrb/5740

17946,3
type: release
of datablock: info:bmrb/17946
reference to entry: entry
release.entry id: 17946
release.release number: 3
release.author: author
release.date: 2013-04-11Z
release.detail: update entry citation
release.submission date: 2011-09-18Z
release.type: update

17946,2
type: release
of datablock: info:bmrb/17946
reference to entry: entry
release.entry id: 17946
release.release number: 2
release.author: author
release.date: 2012-02-01Z
release.detail: update chemical shifts
release.submission date: 2011-09-18Z
release.type: original

17946,1
type: release
of datablock: info:bmrb/17946
reference to entry: entry
release.entry id: 17946
release.release number: 1
release.author: author
release.date: 2011-09-22Z
release.detail: original release
release.submission date: 2011-09-18Z
release.type: original

17946,1
type: sample
of datablock: info:bmrb/17946
reference to entry: entry
sample.entry id: 17946
sample.id: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: MpDHFR
sample.solvent system: 90% H2O/10% D2O
sample.type: solution

17946,1,1
type: sample component
of datablock: info:bmrb/17946
sample component.entry id: 17946
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 1.3
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: Dihydrofolate_reductase_from_Moritella_profunda
sample component.isotopic labeling: [U-13C; U-15N]
sample component.mol common name: Dihydrofolate reductase from Moritella profunda

17946,2,1
type: sample component
of datablock: info:bmrb/17946
sample component.entry id: 17946
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 6
sample component.concentration val units: mM
sample component.entity id: 2
sample component.entity label: NAP
sample component.isotopic labeling: natural abundance
sample component.mol common name: NADP+

17946,3,1
type: sample component
of datablock: info:bmrb/17946
sample component.entry id: 17946
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 6
sample component.concentration val units: mM
sample component.entity id: 3
sample component.entity label: FOL
sample component.isotopic labeling: natural abundance
sample component.mol common name: Folic acid

17946,4,1
type: sample component
of datablock: info:bmrb/17946
sample component.entry id: 17946
sample component.id: 4
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 50
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: potassium phosphate

17946,5,1
type: sample component
of datablock: info:bmrb/17946
sample component.entry id: 17946
sample component.id: 5
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 1
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

17946,6,1
type: sample component
of datablock: info:bmrb/17946
sample component.entry id: 17946
sample component.id: 6
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 10
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: beta-mercaptoethanol

17946,1
type: sample condition list
of datablock: info:bmrb/17946
reference to entry: entry
sample condition list.entry id: 17946
sample condition list.id: 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

17946,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/17946
sample condition variable.entry id: 17946
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 50
sample condition variable.val units: mM

17946,1,pH
type: sample condition variable
of datablock: info:bmrb/17946
sample condition variable.entry id: 17946
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 7.0
sample condition variable.val units: pH

17946,1,pressure
type: sample condition variable
of datablock: info:bmrb/17946
sample condition variable.entry id: 17946
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

17946,1,temperature
type: sample condition variable
of datablock: info:bmrb/17946
sample condition variable.entry id: 17946
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 291
sample condition variable.val units: K

17946,1
type: software
of datablock: info:bmrb/17946
reference to entry: entry
software.entry id: 17946
software.id: 1
software.name: NMRPipe
software.sf category: software
software.sf framecode: NMRPipe

17946,1,processing
type: task
of datablock: info:bmrb/17946
task.entry id: 17946
task.software id: 1
task.task: processing

17946,Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax,1
type: vendor
of datablock: info:bmrb/17946
vendor.entry id: 17946
vendor.name: Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax
vendor.software id: 1