info:bmrb/17144
type: datablock
references: doi:10.13018/BMR17144
alternative label: bmr17144
title: 1H, 13C, and 15N backbone, side-chain, and heme chemical shift assignments for the oxidized form of the monoheme c-type cytochrome ApcA isolated from the acidophilic metal-reducing bacterium Acidiphilium cryptum
datablock name: 17144
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reference to entry: entry
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assembly.id: 1
assembly.details: c-type cytochrome, heme covalently linked to polypeptide via thioether bonds
assembly.name: ApcA
assembly.non standard bonds: yes
assembly.number of components: 2
assembly.paramagnetic: yes
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1,17144,6
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1,17144,8
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1,17144,9
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1,17144,10
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1,17144,11
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1,17144,13
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1,17144,16
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1,17144,17
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1,17144,18
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1,17144,20
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1,17144,28
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1,17144,29
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1,17144,30
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1,17144,31
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1,17144,32
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atom chem shift.val: 21.7
atom chem shift.val err: 0.2

1,17144,33
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 33
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: 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: 23.0
atom chem shift.val err: 0.2

1,17144,34
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 34
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: 125.7
atom chem shift.val err: 0.2

1,17144,35
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 35
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: 4
atom chem shift.comp id: ALA
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: 8.16
atom chem shift.val err: 0.02

1,17144,36
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 36
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: 4
atom chem shift.comp id: ALA
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: 3.99
atom chem shift.val err: 0.02

1,17144,37
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 37
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: 4
atom chem shift.comp id: ALA
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: 1.40
atom chem shift.val err: 0.02

1,17144,38
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 38
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: 4
atom chem shift.comp id: ALA
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: 1.40
atom chem shift.val err: 0.02

1,17144,39
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 39
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: 4
atom chem shift.comp id: ALA
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: 1.40
atom chem shift.val err: 0.02

1,17144,40
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 40
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: 4
atom chem shift.comp id: ALA
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: 181.2
atom chem shift.val err: 0.2

1,17144,41
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 41
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: 4
atom chem shift.comp id: ALA
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: 55.2
atom chem shift.val err: 0.2

1,17144,42
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 42
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: 4
atom chem shift.comp id: ALA
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: 17.6
atom chem shift.val err: 0.2

1,17144,43
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 43
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: 4
atom chem shift.comp id: ALA
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: 122.9
atom chem shift.val err: 0.2

1,17144,44
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 44
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: 5
atom chem shift.comp id: HIS
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: 8.00
atom chem shift.val err: 0.02

1,17144,45
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 45
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: 5
atom chem shift.comp id: HIS
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: 4.38
atom chem shift.val err: 0.02

1,17144,46
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 46
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: 5
atom chem shift.comp id: HIS
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: 2.94
atom chem shift.val err: 0.02

1,17144,47
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 47
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: 5
atom chem shift.comp id: HIS
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: 3.07
atom chem shift.val err: 0.02

1,17144,48
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 48
atom chem shift.ambiguity code: 1
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: HIS
atom chem shift.auth seq id: 5
atom chem shift.comp id: HIS
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: 7.31
atom chem shift.val err: 0.02

1,17144,49
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 49
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
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atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 5
atom chem shift.comp id: HIS
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: 8.67
atom chem shift.val err: 0.02

1,17144,50
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 50
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: 5
atom chem shift.comp id: HIS
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: 176.8
atom chem shift.val err: 0.2

1,17144,51
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 51
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 atom id: CA
atom chem shift.auth comp id: HIS
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atom chem shift.comp id: HIS
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: 57.8
atom chem shift.val err: 0.2

1,17144,52
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 52
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: 5
atom chem shift.comp id: HIS
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: 27.9
atom chem shift.val err: 0.2

1,17144,53
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 53
atom chem shift.ambiguity code: 1
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
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atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 5
atom chem shift.comp id: HIS
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: 120.0
atom chem shift.val err: 0.2

1,17144,54
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 54
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE1
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 5
atom chem shift.comp id: HIS
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: 135.4
atom chem shift.val err: 0.2

1,17144,55
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 55
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: 5
atom chem shift.comp id: HIS
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: 119.2
atom chem shift.val err: 0.2

1,17144,56
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 56
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: 6
atom chem shift.comp id: GLY
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: 8.20
atom chem shift.val err: 0.02

1,17144,57
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 57
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: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 2.95
atom chem shift.val err: 0.02

1,17144,58
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 58
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: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 3.61
atom chem shift.val err: 0.02

1,17144,59
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 59
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: 6
atom chem shift.comp id: GLY
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: 174.1
atom chem shift.val err: 0.2

1,17144,60
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 60
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: 6
atom chem shift.comp id: GLY
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: 46.4
atom chem shift.val err: 0.2

1,17144,61
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 61
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: 6
atom chem shift.comp id: GLY
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: 107.5
atom chem shift.val err: 0.2

1,17144,62
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 62
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: LYS
atom chem shift.auth seq id: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 8.25
atom chem shift.val err: 0.02

1,17144,63
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 63
atom chem shift.ambiguity code: 1
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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: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 2.41
atom chem shift.val err: 0.02

1,17144,64
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 64
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 atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 0.97
atom chem shift.val err: 0.02

1,17144,65
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 65
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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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: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.54
atom chem shift.val err: 0.02

1,17144,66
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 66
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: HD2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.45
atom chem shift.val err: 0.02

1,17144,67
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 67
atom chem shift.ambiguity code: 2
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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: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.50
atom chem shift.val err: 0.02

1,17144,68
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 68
atom chem shift.ambiguity code: 2
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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: 7
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 2.87
atom chem shift.val err: 0.02

1,17144,69
type: atom chem shift
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atom chem shift.val: 2.89
atom chem shift.val err: 0.02

1,17144,70
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.94
atom chem shift.val err: 0.02

1,17144,71
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,72
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,73
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,74
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,75
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,76
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,77
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.2

1,17144,78
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.2

1,17144,79
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,80
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,81
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,82
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,83
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1,17144,84
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,85
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,86
type: atom chem shift
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1,17144,87
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1,17144,88
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,89
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,90
type: atom chem shift
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1,17144,91
type: atom chem shift
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1,17144,92
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1,17144,93
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1,17144,94
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,95
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,96
type: atom chem shift
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1,17144,97
type: atom chem shift
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1,17144,98
type: atom chem shift
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1,17144,99
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,100
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1,17144,101
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1,17144,102
type: atom chem shift
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1,17144,103
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1,17144,106
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,107
type: atom chem shift
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1,17144,108
type: atom chem shift
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1,17144,109
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1,17144,110
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1,17144,111
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1,17144,112
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1,17144,113
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1,17144,114
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1,17144,115
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1,17144,116
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1,17144,117
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1,17144,118
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1,17144,119
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1,17144,120
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1,17144,121
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1,17144,122
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1,17144,123
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1,17144,124
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1,17144,125
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1,17144,126
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1,17144,127
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1,17144,128
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1,17144,129
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1,17144,130
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1,17144,131
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1,17144,132
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1,17144,133
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1,17144,134
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1,17144,135
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1,17144,137
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1,17144,142
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1,17144,143
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1,17144,148
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1,17144,149
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1,17144,150
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1,17144,151
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1,17144,152
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1,17144,153
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1,17144,155
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1,17144,156
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1,17144,157
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1,17144,158
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1,17144,159
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1,17144,160
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1,17144,161
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1,17144,162
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1,17144,163
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1,17144,164
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1,17144,167
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atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 177
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: 16
atom chem shift.comp id: ALA
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 18.8
atom chem shift.val err: 0.2

1,17144,178
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 178
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: 16
atom chem shift.comp id: ALA
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 120.0
atom chem shift.val err: 0.2

1,17144,179
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 179
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: 17
atom chem shift.comp id: CYS
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: 9.48
atom chem shift.val err: 0.02

1,17144,180
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 180
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: 17
atom chem shift.comp id: CYS
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: 6.60
atom chem shift.val err: 0.02

1,17144,181
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 181
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: 17
atom chem shift.comp id: CYS
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: 3.56
atom chem shift.val err: 0.02

1,17144,182
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 182
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: 17
atom chem shift.comp id: CYS
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: 9.24
atom chem shift.val err: 0.02

1,17144,183
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 183
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: 17
atom chem shift.comp id: CYS
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: 176.1
atom chem shift.val err: 0.2

1,17144,184
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 184
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: 17
atom chem shift.comp id: CYS
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: 59.5
atom chem shift.val err: 0.2

1,17144,185
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 185
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: 17
atom chem shift.comp id: CYS
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: 36.8
atom chem shift.val err: 0.2

1,17144,186
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 186
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: 17
atom chem shift.comp id: CYS
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: 111.5
atom chem shift.val err: 0.2

1,17144,187
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 187
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: 18
atom chem shift.comp id: HIS
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: 11.23
atom chem shift.val err: 0.02

1,17144,188
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 188
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: 18
atom chem shift.comp id: HIS
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: 8.97
atom chem shift.val err: 0.02

1,17144,189
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 189
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: 18
atom chem shift.comp id: HIS
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: 8.18
atom chem shift.val err: 0.02

1,17144,190
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 190
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: 18
atom chem shift.comp id: HIS
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: 17.20
atom chem shift.val err: 0.02

1,17144,191
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 191
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: 18
atom chem shift.comp id: HIS
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: 176.2
atom chem shift.val err: 0.2

1,17144,192
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 192
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: 18
atom chem shift.comp id: HIS
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: 77.9
atom chem shift.val err: 0.2

1,17144,193
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 193
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: 18
atom chem shift.comp id: HIS
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: 22.2
atom chem shift.val err: 0.2

1,17144,194
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 194
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: 18
atom chem shift.comp id: HIS
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: 118.0
atom chem shift.val err: 0.2

1,17144,195
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 195
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: 19
atom chem shift.comp id: SER
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: 10.49
atom chem shift.val err: 0.02

1,17144,196
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 196
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: 19
atom chem shift.comp id: SER
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: 5.82
atom chem shift.val err: 0.02

1,17144,197
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 197
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: 19
atom chem shift.comp id: SER
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: 4.77
atom chem shift.val err: 0.02

1,17144,198
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 198
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: 19
atom chem shift.comp id: SER
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: 4.82
atom chem shift.val err: 0.02

1,17144,199
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 199
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: 19
atom chem shift.comp id: SER
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: 176.1
atom chem shift.val err: 0.2

1,17144,200
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 200
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: 19
atom chem shift.comp id: SER
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: 57.8
atom chem shift.val err: 0.2

1,17144,201
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 201
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: 19
atom chem shift.comp id: SER
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: 64.8
atom chem shift.val err: 0.2

1,17144,202
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 202
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: 19
atom chem shift.comp id: SER
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: 120.3
atom chem shift.val err: 0.2

1,17144,203
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 203
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: 20
atom chem shift.comp id: VAL
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: 8.91
atom chem shift.val err: 0.02

1,17144,204
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 204
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: 20
atom chem shift.comp id: VAL
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: 4.87
atom chem shift.val err: 0.02

1,17144,205
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 205
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: 20
atom chem shift.comp id: VAL
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: 2.59
atom chem shift.val err: 0.02

1,17144,206
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 206
atom chem shift.ambiguity code: 1
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: 20
atom chem shift.comp id: VAL
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: 1.06
atom chem shift.val err: 0.02

1,17144,207
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 207
atom chem shift.ambiguity code: 1
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: 20
atom chem shift.comp id: VAL
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: 1.06
atom chem shift.val err: 0.02

1,17144,208
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 208
atom chem shift.ambiguity code: 1
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: 20
atom chem shift.comp id: VAL
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: 1.06
atom chem shift.val err: 0.02

1,17144,209
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 209
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: VAL
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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: 1.07
atom chem shift.val err: 0.02

1,17144,210
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 210
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: VAL
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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: 1.07
atom chem shift.val err: 0.02

1,17144,211
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 211
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: VAL
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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: 1.07
atom chem shift.val err: 0.02

1,17144,212
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 212
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: 20
atom chem shift.comp id: VAL
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: 175.6
atom chem shift.val err: 0.2

1,17144,213
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 213
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: 20
atom chem shift.comp id: VAL
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: 61.5
atom chem shift.val err: 0.2

1,17144,214
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 214
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: 20
atom chem shift.comp id: VAL
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: 31.0
atom chem shift.val err: 0.2

1,17144,215
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 215
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: VAL
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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: 17.6
atom chem shift.val err: 0.2

1,17144,216
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 216
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: VAL
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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: 23.1
atom chem shift.val err: 0.2

1,17144,217
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 217
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: 20
atom chem shift.comp id: VAL
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: 116.7
atom chem shift.val err: 0.2

1,17144,218
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 218
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 9.27
atom chem shift.val err: 0.02

1,17144,219
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 219
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 5.04
atom chem shift.val err: 0.02

1,17144,220
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 220
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 3.90
atom chem shift.val err: 0.02

1,17144,221
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 221
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 4.07
atom chem shift.val err: 0.02

1,17144,222
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 222
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 174.8
atom chem shift.val err: 0.2

1,17144,223
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 223
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 56.7
atom chem shift.val err: 0.2

1,17144,224
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 224
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 63.0
atom chem shift.val err: 0.2

1,17144,225
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 225
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: 21
atom chem shift.comp id: SER
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 120.2
atom chem shift.val err: 0.2

1,17144,226
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 226
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.37
atom chem shift.val err: 0.02

1,17144,227
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 227
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.03
atom chem shift.val err: 0.02

1,17144,228
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 228
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.31
atom chem shift.val err: 0.02

1,17144,229
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 229
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 3.91
atom chem shift.val err: 0.02

1,17144,230
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 230
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.08
atom chem shift.val err: 0.02

1,17144,231
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 231
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.04
atom chem shift.val err: 0.02

1,17144,232
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 232
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.25
atom chem shift.val err: 0.02

1,17144,233
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 233
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 177.9
atom chem shift.val err: 0.2

1,17144,234
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 234
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 64.0
atom chem shift.val err: 0.2

1,17144,235
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 235
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 31.8
atom chem shift.val err: 0.2

1,17144,236
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 236
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 51.4
atom chem shift.val err: 0.2

1,17144,237
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 237
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: 22
atom chem shift.comp id: PRO
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 27.7
atom chem shift.val err: 0.2

1,17144,238
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 238
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: 23
atom chem shift.comp id: GLY
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 9.43
atom chem shift.val err: 0.02

1,17144,239
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 239
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: 23
atom chem shift.comp id: GLY
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 3.91
atom chem shift.val err: 0.02

1,17144,240
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 240
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
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 23
atom chem shift.comp id: GLY
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 4.17
atom chem shift.val err: 0.02

1,17144,241
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 241
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: 23
atom chem shift.comp id: GLY
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 173.6
atom chem shift.val err: 0.2

1,17144,242
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 242
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: 23
atom chem shift.comp id: GLY
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 45.7
atom chem shift.val err: 0.2

1,17144,243
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 243
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: 23
atom chem shift.comp id: GLY
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 111.5
atom chem shift.val err: 0.2

1,17144,244
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 244
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
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 24
atom chem shift.comp id: GLN
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: 7.22
atom chem shift.val err: 0.02

1,17144,245
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 245
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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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: 24
atom chem shift.comp id: GLN
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: 4.73
atom chem shift.val err: 0.02

1,17144,246
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 246
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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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: 24
atom chem shift.comp id: GLN
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: 2.26
atom chem shift.val err: 0.02

1,17144,247
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 247
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: GLN
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atom chem shift.comp id: GLN
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: 2.55
atom chem shift.val err: 0.02

1,17144,248
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 248
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: GLN
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atom chem shift.comp id: GLN
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: 7.15
atom chem shift.val err: 0.02

1,17144,249
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 249
atom chem shift.ambiguity code: 2
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atom chem shift.val: 7.81
atom chem shift.val err: 0.02

1,17144,250
type: atom chem shift
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1,17144,251
type: atom chem shift
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1,17144,252
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,253
type: atom chem shift
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1,17144,254
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1,17144,255
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1,17144,256
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1,17144,257
type: atom chem shift
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1,17144,258
type: atom chem shift
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1,17144,259
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,260
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,261
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,262
type: atom chem shift
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1,17144,263
type: atom chem shift
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1,17144,264
type: atom chem shift
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1,17144,265
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1,17144,266
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1,17144,267
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1,17144,268
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1,17144,269
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1,17144,270
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1,17144,271
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1,17144,272
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1,17144,273
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1,17144,274
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1,17144,275
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1,17144,276
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1,17144,277
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1,17144,278
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1,17144,279
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1,17144,280
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1,17144,281
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1,17144,282
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atom chem shift.val: 0.22
atom chem shift.val err: 0.02

1,17144,286
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,287
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.22
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1,17144,288
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 175.6
atom chem shift.val err: 0.2

1,17144,289
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,290
type: atom chem shift
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1,17144,291
type: atom chem shift
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1,17144,292
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,293
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,294
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,295
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,296
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,297
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,298
type: atom chem shift
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1,17144,299
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,300
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of datablock: info:bmrb/17144
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1,17144,301
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1,17144,302
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1,17144,303
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1,17144,304
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1,17144,305
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1,17144,306
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1,17144,307
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1,17144,308
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1,17144,309
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1,17144,310
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1,17144,311
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1,17144,312
type: atom chem shift
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1,17144,313
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1,17144,314
type: atom chem shift
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1,17144,315
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1,17144,316
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1,17144,317
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1,17144,318
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1,17144,319
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1,17144,320
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1,17144,321
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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: 4.97
atom chem shift.val err: 0.02

1,17144,322
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 322
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: 1.75
atom chem shift.val err: 0.02

1,17144,323
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 323
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: 1.93
atom chem shift.val err: 0.02

1,17144,324
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 324
atom chem shift.ambiguity code: 1
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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: 0.63
atom chem shift.val err: 0.02

1,17144,325
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 325
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: 0.63
atom chem shift.val err: 0.02

1,17144,326
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 326
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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: 0.63
atom chem shift.val err: 0.02

1,17144,327
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 327
atom chem shift.ambiguity code: 1
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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: -0.28
atom chem shift.val err: 0.02

1,17144,328
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 328
atom chem shift.ambiguity code: 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: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: -0.28
atom chem shift.val err: 0.02

1,17144,329
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 329
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
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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: -0.28
atom chem shift.val err: 0.02

1,17144,330
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 330
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
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atom chem shift.auth atom id: HG
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: 4.35
atom chem shift.val err: 0.02

1,17144,331
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 331
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 atom id: C
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: 175.3
atom chem shift.val err: 0.2

1,17144,332
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 332
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 atom id: CA
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: 53.5
atom chem shift.val err: 0.2

1,17144,333
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 333
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: 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: 42.0
atom chem shift.val err: 0.2

1,17144,334
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 334
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
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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: 20.6
atom chem shift.val err: 0.2

1,17144,335
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 335
atom chem shift.ambiguity code: 1
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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: 25.6
atom chem shift.val err: 0.2

1,17144,336
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 336
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
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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: 27.6
atom chem shift.val err: 0.2

1,17144,337
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 337
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: 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: 125.5
atom chem shift.val err: 0.2

1,17144,338
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 338
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.auth comp id: ALA
atom chem shift.auth seq id: 32
atom chem shift.comp id: ALA
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: 8.11
atom chem shift.val err: 0.02

1,17144,339
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 339
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 32
atom chem shift.comp id: ALA
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: 3.91
atom chem shift.val err: 0.02

1,17144,340
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 340
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 32
atom chem shift.val: 1.32
atom chem shift.val err: 0.02

1,17144,341
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 341
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
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atom chem shift.val: 1.32
atom chem shift.val err: 0.02

1,17144,342
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 32
atom chem shift.val: 1.32
atom chem shift.val err: 0.02

1,17144,343
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 32
atom chem shift.val: 179.4
atom chem shift.val err: 0.2

1,17144,344
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 32
atom chem shift.val: 54.2
atom chem shift.val err: 0.2

1,17144,345
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 32
atom chem shift.val: 17.4
atom chem shift.val err: 0.2

1,17144,346
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 346
atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 32
atom chem shift.comp id: ALA
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 32
atom chem shift.val: 122.7
atom chem shift.val err: 0.2

1,17144,347
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 7.86
atom chem shift.val err: 0.02

1,17144,348
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: GLY
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atom chem shift.val: 3.78
atom chem shift.val err: 0.02

1,17144,349
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 349
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.85
atom chem shift.val err: 0.02

1,17144,350
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 350
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: GLY
atom chem shift.auth seq id: 33
atom chem shift.comp id: GLY
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: 174.1
atom chem shift.val err: 0.2

1,17144,351
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 351
atom chem shift.ambiguity code: 1
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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: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 46.6
atom chem shift.val err: 0.2

1,17144,352
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 352
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: 33
atom chem shift.comp id: GLY
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: 112.2
atom chem shift.val err: 0.2

1,17144,353
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 353
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: 34
atom chem shift.comp id: VAL
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: 7.35
atom chem shift.val err: 0.02

1,17144,354
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 354
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: 34
atom chem shift.comp id: VAL
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: 3.90
atom chem shift.val err: 0.02

1,17144,355
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 355
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: 34
atom chem shift.comp id: VAL
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: 1.87
atom chem shift.val err: 0.02

1,17144,356
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 356
atom chem shift.ambiguity code: 1
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: 34
atom chem shift.comp id: VAL
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: 0.47
atom chem shift.val err: 0.02

1,17144,357
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 357
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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: 34
atom chem shift.comp id: VAL
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: 0.47
atom chem shift.val err: 0.02

1,17144,358
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 358
atom chem shift.ambiguity code: 1
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: 34
atom chem shift.comp id: VAL
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: 0.47
atom chem shift.val err: 0.02

1,17144,359
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 359
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: VAL
atom chem shift.auth seq id: 34
atom chem shift.comp id: VAL
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: 0.55
atom chem shift.val err: 0.02

1,17144,360
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 360
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: VAL
atom chem shift.auth seq id: 34
atom chem shift.comp id: VAL
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: 0.55
atom chem shift.val err: 0.02

1,17144,361
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 361
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: VAL
atom chem shift.auth seq id: 34
atom chem shift.comp id: VAL
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: 0.55
atom chem shift.val err: 0.02

1,17144,362
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 362
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: 34
atom chem shift.comp id: VAL
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: 174.5
atom chem shift.val err: 0.2

1,17144,363
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 363
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: 34
atom chem shift.comp id: VAL
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: 63.6
atom chem shift.val err: 0.2

1,17144,364
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 364
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: 34
atom chem shift.comp id: VAL
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: 31.0
atom chem shift.val err: 0.2

1,17144,365
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 365
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: VAL
atom chem shift.auth seq id: 34
atom chem shift.comp id: VAL
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: 20.6
atom chem shift.val err: 0.2

1,17144,366
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 366
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: VAL
atom chem shift.auth seq id: 34
atom chem shift.comp id: VAL
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: 23.3
atom chem shift.val err: 0.2

1,17144,367
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 367
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: 34
atom chem shift.comp id: VAL
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: 118.9
atom chem shift.val err: 0.2

1,17144,368
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 368
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: 35
atom chem shift.comp id: TYR
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: 8.38
atom chem shift.val err: 0.02

1,17144,369
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 369
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: 35
atom chem shift.comp id: TYR
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: 3.51
atom chem shift.val err: 0.02

1,17144,370
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 370
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: 35
atom chem shift.comp id: TYR
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: 2.00
atom chem shift.val err: 0.02

1,17144,371
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 371
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: 35
atom chem shift.comp id: TYR
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: 3.05
atom chem shift.val err: 0.02

1,17144,372
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 372
atom chem shift.ambiguity code: 3
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD1
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: TYR
atom chem shift.auth seq id: 35
atom chem shift.comp id: TYR
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: 6.58
atom chem shift.val err: 0.02

1,17144,373
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 373
atom chem shift.ambiguity code: 3
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: HE1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 35
atom chem shift.comp id: TYR
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: 6.51
atom chem shift.val err: 0.02

1,17144,374
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 374
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: 35
atom chem shift.comp id: TYR
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: 176.0
atom chem shift.val err: 0.2

1,17144,375
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 375
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: 35
atom chem shift.comp id: TYR
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: 61.4
atom chem shift.val err: 0.2

1,17144,376
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 376
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: 35
atom chem shift.comp id: TYR
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: 38.6
atom chem shift.val err: 0.2

1,17144,377
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 377
atom chem shift.ambiguity code: 3
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: TYR
atom chem shift.auth seq id: 35
atom chem shift.comp id: TYR
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: 132.8
atom chem shift.val err: 0.2

1,17144,378
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 378
atom chem shift.ambiguity code: 3
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 35
atom chem shift.comp id: TYR
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: 118.1
atom chem shift.val err: 0.2

1,17144,379
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 379
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: 35
atom chem shift.comp id: TYR
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: 121.8
atom chem shift.val err: 0.2

1,17144,380
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 380
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: 36
atom chem shift.comp id: GLY
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: 8.27
atom chem shift.val err: 0.02

1,17144,381
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 381
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: 36
atom chem shift.comp id: GLY
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: 3.45
atom chem shift.val err: 0.02

1,17144,382
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 382
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: 36
atom chem shift.comp id: GLY
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: 4.21
atom chem shift.val err: 0.02

1,17144,383
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 383
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: 36
atom chem shift.comp id: GLY
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: 173.3
atom chem shift.val err: 0.2

1,17144,384
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 384
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: 36
atom chem shift.comp id: GLY
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: 44.8
atom chem shift.val err: 0.2

1,17144,385
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 385
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: 36
atom chem shift.comp id: GLY
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: 120.1
atom chem shift.val err: 0.2

1,17144,386
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 386
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: 37
atom chem shift.comp id: ALA
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: 8.11
atom chem shift.val err: 0.02

1,17144,387
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 387
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: 37
atom chem shift.comp id: ALA
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: 4.34
atom chem shift.val err: 0.02

1,17144,388
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 388
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: 37
atom chem shift.comp id: ALA
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: 1.54
atom chem shift.val err: 0.02

1,17144,389
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 389
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: 37
atom chem shift.comp id: ALA
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: 1.54
atom chem shift.val err: 0.02

1,17144,390
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 390
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: 37
atom chem shift.comp id: ALA
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: 1.54
atom chem shift.val err: 0.02

1,17144,391
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 391
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: 37
atom chem shift.comp id: ALA
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: 177.2
atom chem shift.val err: 0.2

1,17144,392
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 392
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: 37
atom chem shift.comp id: ALA
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: 51.3
atom chem shift.val err: 0.2

1,17144,393
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 393
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: 37
atom chem shift.comp id: ALA
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: 20.6
atom chem shift.val err: 0.2

1,17144,394
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 394
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 37
atom chem shift.comp id: ALA
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: 124.4
atom chem shift.val err: 0.2

1,17144,395
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 395
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atom chem shift.comp id: LYS
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: 8.07
atom chem shift.val err: 0.02

1,17144,396
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 396
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atom chem shift.comp id: LYS
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: 4.08
atom chem shift.val err: 0.02

1,17144,397
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 397
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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: 1.47
atom chem shift.val err: 0.02

1,17144,398
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,399
type: atom chem shift
of datablock: info:bmrb/17144
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: 38
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 38
atom chem shift.val: 1.55
atom chem shift.val err: 0.02

1,17144,400
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.60
atom chem shift.val err: 0.02

1,17144,401
type: atom chem shift
of datablock: info:bmrb/17144
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: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 2.88
atom chem shift.val err: 0.02

1,17144,402
type: atom chem shift
of datablock: info:bmrb/17144
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: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 2.91
atom chem shift.val err: 0.02

1,17144,403
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 403
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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: 1.33
atom chem shift.val err: 0.02

1,17144,404
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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: 1.44
atom chem shift.val err: 0.02

1,17144,405
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 175.7
atom chem shift.val err: 0.2

1,17144,406
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 56.6
atom chem shift.val err: 0.2

1,17144,407
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 32.9
atom chem shift.val err: 0.2

1,17144,408
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 29.1
atom chem shift.val err: 0.2

1,17144,409
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 42.0
atom chem shift.val err: 0.2

1,17144,410
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 25.1
atom chem shift.val err: 0.2

1,17144,411
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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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: 119.1
atom chem shift.val err: 0.2

1,17144,412
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,413
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,414
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,415
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,416
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,417
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,418
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,419
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,420
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,421
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,422
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,423
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,424
type: atom chem shift
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1,17144,425
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1,17144,426
type: atom chem shift
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1,17144,427
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1,17144,428
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1,17144,429
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atom chem shift.val: 120.9
atom chem shift.val err: 0.2

1,17144,430
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 8.73
atom chem shift.val err: 0.02

1,17144,431
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 4.32
atom chem shift.val err: 0.02

1,17144,432
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.21
atom chem shift.val err: 0.02

1,17144,433
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,434
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,435
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 178.6
atom chem shift.val err: 0.2

1,17144,436
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,437
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 20.5
atom chem shift.val err: 0.2

1,17144,438
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.2

1,17144,439
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,440
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,441
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,442
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,443
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,444
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of datablock: info:bmrb/17144
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1,17144,445
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1,17144,446
type: atom chem shift
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1,17144,448
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1,17144,449
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1,17144,450
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1,17144,451
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1,17144,452
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1,17144,456
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of datablock: info:bmrb/17144
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1,17144,457
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1,17144,459
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1,17144,460
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1,17144,461
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1,17144,462
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atom chem shift.val err: 0.2

1,17144,466
type: atom chem shift
of datablock: info:bmrb/17144
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: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 45.6
atom chem shift.val err: 0.2

1,17144,467
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 467
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 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: 109.2
atom chem shift.val err: 0.2

1,17144,468
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 468
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atom chem shift.comp id: PHE
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: 6.94
atom chem shift.val err: 0.02

1,17144,469
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 469
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atom chem shift.comp id: PHE
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: 3.90
atom chem shift.val err: 0.02

1,17144,470
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 470
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.87
atom chem shift.val err: 0.02

1,17144,471
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.94
atom chem shift.val err: 0.02

1,17144,472
type: atom chem shift
of datablock: info:bmrb/17144
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: 45
atom chem shift.val: 172.7
atom chem shift.val err: 0.2

1,17144,473
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: PHE
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: 56.6
atom chem shift.val err: 0.2

1,17144,474
type: atom chem shift
of datablock: info:bmrb/17144
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: 45
atom chem shift.val: 41.1
atom chem shift.val err: 0.2

1,17144,475
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 475
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atom chem shift.comp id: PHE
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: 118.8
atom chem shift.val err: 0.2

1,17144,476
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 6.73
atom chem shift.val err: 0.02

1,17144,477
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.90
atom chem shift.val err: 0.02

1,17144,478
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.07
atom chem shift.val err: 0.02

1,17144,479
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.26
atom chem shift.val err: 0.02

1,17144,480
type: atom chem shift
of datablock: info:bmrb/17144
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: 6.58
atom chem shift.val err: 0.02

1,17144,481
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: GLN
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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: 7.17
atom chem shift.val err: 0.02

1,17144,482
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.75
atom chem shift.val err: 0.02

1,17144,483
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.83
atom chem shift.val err: 0.02

1,17144,484
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 172.4
atom chem shift.val err: 0.2

1,17144,485
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 53.5
atom chem shift.val err: 0.2

1,17144,486
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 26.5
atom chem shift.val err: 0.2

1,17144,487
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 180.3
atom chem shift.val err: 0.2

1,17144,488
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 33.1
atom chem shift.val err: 0.2

1,17144,489
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: GLN
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atom chem shift.val: 126.5
atom chem shift.val err: 0.2

1,17144,490
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 112.6
atom chem shift.val err: 0.2

1,17144,491
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.75
atom chem shift.val err: 0.02

1,17144,492
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.98
atom chem shift.val err: 0.02

1,17144,493
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.47
atom chem shift.val err: 0.02

1,17144,494
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,495
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 176.1
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1,17144,496
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,497
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,498
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.comp id: PHE
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atom chem shift.val: 124.5
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1,17144,499
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,500
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,501
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 3.75
atom chem shift.val err: 0.02

1,17144,502
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 502
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: 48
atom chem shift.comp id: SER
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: 0.02

1,17144,503
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 503
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.auth seq id: 48
atom chem shift.comp id: SER
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: 8.34
atom chem shift.val err: 0.02

1,17144,504
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 504
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: 48
atom chem shift.comp id: SER
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: 173.0
atom chem shift.val err: 0.2

1,17144,505
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 505
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
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 48
atom chem shift.comp id: SER
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: 56.9
atom chem shift.val err: 0.2

1,17144,506
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 506
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 atom id: CB
atom chem shift.auth comp id: SER
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atom chem shift.comp id: SER
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: 61.9
atom chem shift.val err: 0.2

1,17144,507
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 507
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: 48
atom chem shift.comp id: SER
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: 119.7
atom chem shift.val err: 0.2

1,17144,508
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 508
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: PRO
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: 4.16
atom chem shift.val err: 0.02

1,17144,509
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 509
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
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atom chem shift.comp id: PRO
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: 1.89
atom chem shift.val err: 0.02

1,17144,510
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 510
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: PRO
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: 2.30
atom chem shift.val err: 0.02

1,17144,511
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 511
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HD2
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atom chem shift.auth seq id: 49
atom chem shift.comp id: PRO
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: 3.72
atom chem shift.val err: 0.02

1,17144,512
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 512
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HD3
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 49
atom chem shift.comp id: PRO
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: 3.89
atom chem shift.val err: 0.02

1,17144,513
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 513
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HG2
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atom chem shift.auth seq id: 49
atom chem shift.comp id: PRO
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 49
atom chem shift.val: 1.97
atom chem shift.val err: 0.02

1,17144,514
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 514
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HG3
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 49
atom chem shift.comp id: PRO
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 49
atom chem shift.val: 2.11
atom chem shift.val err: 0.02

1,17144,515
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 515
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 49
atom chem shift.val: 179.0
atom chem shift.val err: 0.2

1,17144,516
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 516
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atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 49
atom chem shift.val: 64.8
atom chem shift.val err: 0.2

1,17144,517
type: atom chem shift
of datablock: info:bmrb/17144
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: 49
atom chem shift.val: 31.6
atom chem shift.val err: 0.2

1,17144,518
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 518
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 50.2
atom chem shift.val err: 0.2

1,17144,519
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.ambiguity code: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 49
atom chem shift.val: 27.7
atom chem shift.val err: 0.2

1,17144,520
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 520
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.77
atom chem shift.val err: 0.02

1,17144,521
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 521
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atom chem shift.comp id: ALA
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 50
atom chem shift.val: 4.04
atom chem shift.val err: 0.02

1,17144,522
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 50
atom chem shift.val: 1.46
atom chem shift.val err: 0.02

1,17144,523
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.46
atom chem shift.val err: 0.02

1,17144,524
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.46
atom chem shift.val err: 0.02

1,17144,525
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 180.5
atom chem shift.val err: 0.2

1,17144,526
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 50
atom chem shift.val: 54.9
atom chem shift.val err: 0.2

1,17144,527
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 50
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atom chem shift.seq id: 50
atom chem shift.val: 19.5
atom chem shift.val err: 0.2

1,17144,528
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 528
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atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 50
atom chem shift.comp id: ALA
atom chem shift.comp index id: 50
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atom chem shift.val: 116.6
atom chem shift.val err: 0.2

1,17144,529
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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: 51
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 51
atom chem shift.val: 8.62
atom chem shift.val err: 0.02

1,17144,530
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: LEU
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atom chem shift.val: 4.32
atom chem shift.val err: 0.02

1,17144,531
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 531
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.78
atom chem shift.val err: 0.02

1,17144,532
type: atom chem shift
of datablock: info:bmrb/17144
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

1,17144,533
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.46
atom chem shift.val err: 0.02

1,17144,534
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.46
atom chem shift.val err: 0.02

1,17144,535
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,536
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,537
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.66
atom chem shift.val err: 0.02

1,17144,538
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of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,539
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,540
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,541
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,542
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,543
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1,17144,544
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1,17144,545
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,546
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,547
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,548
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,549
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of datablock: info:bmrb/17144
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1,17144,550
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1,17144,551
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1,17144,552
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of datablock: info:bmrb/17144
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1,17144,553
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1,17144,554
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1,17144,555
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1,17144,556
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1,17144,557
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1,17144,558
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1,17144,559
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1,17144,560
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1,17144,561
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1,17144,562
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1,17144,563
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1,17144,564
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atom chem shift.val: 177.4
atom chem shift.val err: 0.2

1,17144,575
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 56.2
atom chem shift.val err: 0.2

1,17144,576
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 32.4
atom chem shift.val err: 0.2

1,17144,577
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,578
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 42.0
atom chem shift.val err: 0.2

1,17144,579
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.2

1,17144,580
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 115.8
atom chem shift.val err: 0.2

1,17144,581
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.41
atom chem shift.val err: 0.02

1,17144,582
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.09
atom chem shift.val err: 0.02

1,17144,583
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,584
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,585
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,586
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,587
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,588
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,589
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,590
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of datablock: info:bmrb/17144
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1,17144,591
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of datablock: info:bmrb/17144
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1,17144,592
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of datablock: info:bmrb/17144
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1,17144,593
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of datablock: info:bmrb/17144
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1,17144,594
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,595
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of datablock: info:bmrb/17144
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1,17144,596
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,597
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,598
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1,17144,599
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of datablock: info:bmrb/17144
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1,17144,600
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1,17144,601
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of datablock: info:bmrb/17144
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1,17144,602
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of datablock: info:bmrb/17144
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1,17144,603
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,604
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,605
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of datablock: info:bmrb/17144
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1,17144,606
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1,17144,607
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1,17144,608
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1,17144,609
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1,17144,610
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 610
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: 56
atom chem shift.comp id: ILE
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 29.9
atom chem shift.val err: 0.2

1,17144,611
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 611
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: 56
atom chem shift.comp id: ILE
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 15.5
atom chem shift.val err: 0.2

1,17144,612
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 612
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: 56
atom chem shift.comp id: ILE
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 121.3
atom chem shift.val err: 0.2

1,17144,613
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 613
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 7.75
atom chem shift.val err: 0.02

1,17144,614
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 614
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 3.97
atom chem shift.val err: 0.02

1,17144,615
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 615
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 1.64
atom chem shift.val err: 0.02

1,17144,616
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 616
atom chem shift.ambiguity code: 1
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 0.50
atom chem shift.val err: 0.02

1,17144,617
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 617
atom chem shift.ambiguity code: 1
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 0.50
atom chem shift.val err: 0.02

1,17144,618
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 618
atom chem shift.ambiguity code: 1
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 0.50
atom chem shift.val err: 0.02

1,17144,619
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 619
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: VAL
atom chem shift.auth seq id: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 0.72
atom chem shift.val err: 0.02

1,17144,620
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 620
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: VAL
atom chem shift.auth seq id: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 0.72
atom chem shift.val err: 0.02

1,17144,621
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 621
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: VAL
atom chem shift.auth seq id: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 0.72
atom chem shift.val err: 0.02

1,17144,622
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 622
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 176.5
atom chem shift.val err: 0.2

1,17144,623
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 623
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 61.0
atom chem shift.val err: 0.2

1,17144,624
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 624
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 33.1
atom chem shift.val err: 0.2

1,17144,625
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 625
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: VAL
atom chem shift.auth seq id: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 20.4
atom chem shift.val err: 0.2

1,17144,626
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 626
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: VAL
atom chem shift.auth seq id: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 21.4
atom chem shift.val err: 0.2

1,17144,627
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 627
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: 57
atom chem shift.comp id: VAL
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 127.5
atom chem shift.val err: 0.2

1,17144,628
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 628
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: 58
atom chem shift.comp id: TRP
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: 8.77
atom chem shift.val err: 0.02

1,17144,629
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 629
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: 58
atom chem shift.comp id: TRP
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: 4.86
atom chem shift.val err: 0.02

1,17144,630
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 630
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: 58
atom chem shift.comp id: TRP
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: 2.42
atom chem shift.val err: 0.02

1,17144,631
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 631
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: 58
atom chem shift.comp id: TRP
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: 3.66
atom chem shift.val err: 0.02

1,17144,632
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 632
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD1
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: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 6.79
atom chem shift.val err: 0.02

1,17144,633
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 633
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: HE1
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 10.46
atom chem shift.val err: 0.02

1,17144,634
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 634
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: HE3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 7.51
atom chem shift.val err: 0.02

1,17144,635
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 635
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HH2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HH2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 6.68
atom chem shift.val err: 0.02

1,17144,636
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 636
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HZ2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HZ2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 7.71
atom chem shift.val err: 0.02

1,17144,637
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 637
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HZ3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HZ3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 7.23
atom chem shift.val err: 0.02

1,17144,638
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 638
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: 58
atom chem shift.comp id: TRP
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: 174.6
atom chem shift.val err: 0.2

1,17144,639
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 639
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: 58
atom chem shift.comp id: TRP
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: 56.1
atom chem shift.val err: 0.2

1,17144,640
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 640
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: 58
atom chem shift.comp id: TRP
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: 29.6
atom chem shift.val err: 0.2

1,17144,641
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 641
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: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 128.1
atom chem shift.val err: 0.2

1,17144,642
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 642
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE3
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 121.6
atom chem shift.val err: 0.2

1,17144,643
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 643
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CH2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CH2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 124.3
atom chem shift.val err: 0.2

1,17144,644
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 644
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CZ2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CZ2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 114.5
atom chem shift.val err: 0.2

1,17144,645
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 645
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CZ3
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CZ3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 58
atom chem shift.comp id: TRP
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: 121.6
atom chem shift.val err: 0.2

1,17144,646
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 646
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: 58
atom chem shift.comp id: TRP
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: 129.0
atom chem shift.val err: 0.2

1,17144,647
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 647
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE1
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atom chem shift.auth comp id: TRP
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atom chem shift.comp id: TRP
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: 128.8
atom chem shift.val err: 0.2

1,17144,648
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 648
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.auth comp id: ASN
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atom chem shift.comp id: ASN
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: 8.44
atom chem shift.val err: 0.02

1,17144,649
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 649
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ASN
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: 3.71
atom chem shift.val err: 0.02

1,17144,650
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 650
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.comp id: ASN
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: 2.73
atom chem shift.val err: 0.02

1,17144,651
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 651
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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: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 3.01
atom chem shift.val err: 0.02

1,17144,652
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 652
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atom chem shift.comp id: ASN
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: 6.93
atom chem shift.val err: 0.02

1,17144,653
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: ASN
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: 7.34
atom chem shift.val err: 0.02

1,17144,654
type: atom chem shift
of datablock: info:bmrb/17144
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: 59
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 174.6
atom chem shift.val err: 0.2

1,17144,655
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 51.4
atom chem shift.val err: 0.2

1,17144,656
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 656
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atom chem shift.comp id: ASN
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 38.9
atom chem shift.val err: 0.2

1,17144,657
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 657
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 175.5
atom chem shift.val err: 0.2

1,17144,658
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 658
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 seq id: 59
atom chem shift.comp id: ASN
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: 123.2
atom chem shift.val err: 0.2

1,17144,659
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 659
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atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 112.8
atom chem shift.val err: 0.2

1,17144,660
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 660
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.20
atom chem shift.val err: 0.02

1,17144,661
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 60
atom chem shift.val: 3.96
atom chem shift.val err: 0.02

1,17144,662
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
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atom chem shift.val: 1.48
atom chem shift.val err: 0.02

1,17144,663
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 1.48
atom chem shift.val err: 0.02

1,17144,664
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 1.48
atom chem shift.val err: 0.02

1,17144,665
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 179.3
atom chem shift.val err: 0.2

1,17144,666
type: atom chem shift
of datablock: info:bmrb/17144
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: 56.7
atom chem shift.val err: 0.2

1,17144,667
type: atom chem shift
of datablock: info:bmrb/17144
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: 17.9
atom chem shift.val err: 0.2

1,17144,668
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 119.8
atom chem shift.val err: 0.2

1,17144,669
type: atom chem shift
of datablock: info:bmrb/17144
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: 8.04
atom chem shift.val err: 0.02

1,17144,670
type: atom chem shift
of datablock: info:bmrb/17144
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: 4.41
atom chem shift.val err: 0.02

1,17144,671
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,672
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,673
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 177.8
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1,17144,674
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 61.1
atom chem shift.val err: 0.2

1,17144,675
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 63.1
atom chem shift.val err: 0.2

1,17144,676
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: SER
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 111.4
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1,17144,677
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,678
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,679
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,680
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,681
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 1.52
atom chem shift.val err: 0.02

1,17144,682
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 682
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
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: 1.52
atom chem shift.val err: 0.02

1,17144,683
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 683
atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: THR
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atom chem shift.comp id: THR
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: 180.4
atom chem shift.val err: 0.2

1,17144,684
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 684
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atom chem shift.comp id: THR
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: 64.7
atom chem shift.val err: 0.2

1,17144,685
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 685
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atom chem shift.auth seq id: 62
atom chem shift.comp id: THR
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: 68.3
atom chem shift.val err: 0.2

1,17144,686
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 686
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atom chem shift.comp id: THR
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: 23.1
atom chem shift.val err: 0.2

1,17144,687
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 687
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: 62
atom chem shift.comp id: THR
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: 114.0
atom chem shift.val err: 0.2

1,17144,688
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 688
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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: 9.18
atom chem shift.val err: 0.02

1,17144,689
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 689
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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: 4.25
atom chem shift.val err: 0.02

1,17144,690
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 690
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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: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 0.57
atom chem shift.val err: 0.02

1,17144,691
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 691
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: 1.90
atom chem shift.val err: 0.02

1,17144,692
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 692
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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
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atom chem shift.seq id: 63
atom chem shift.val: 0.35
atom chem shift.val err: 0.02

1,17144,693
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 693
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: 0.35
atom chem shift.val err: 0.02

1,17144,694
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.35
atom chem shift.val err: 0.02

1,17144,695
type: atom chem shift
of datablock: info:bmrb/17144
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: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: -0.36
atom chem shift.val err: 0.02

1,17144,696
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: -0.36
atom chem shift.val err: 0.02

1,17144,697
type: atom chem shift
of datablock: info:bmrb/17144
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: 63
atom chem shift.val: -0.36
atom chem shift.val err: 0.02

1,17144,698
type: atom chem shift
of datablock: info:bmrb/17144
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: 63
atom chem shift.val: 1.77
atom chem shift.val err: 0.02

1,17144,699
type: atom chem shift
of datablock: info:bmrb/17144
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: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: 177.7
atom chem shift.val err: 0.2

1,17144,700
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 700
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
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atom chem shift.val: 58.2
atom chem shift.val err: 0.2

1,17144,701
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 701
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atom chem shift.comp id: LEU
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atom chem shift.val: 42.9
atom chem shift.val err: 0.2

1,17144,702
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 702
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atom chem shift.comp id: LEU
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atom chem shift.val: 25.9
atom chem shift.val err: 0.2

1,17144,703
type: atom chem shift
of datablock: info:bmrb/17144
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: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: 23.4
atom chem shift.val err: 0.2

1,17144,704
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 63
atom chem shift.val: 27.7
atom chem shift.val err: 0.2

1,17144,705
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 705
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: 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
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atom chem shift.val: 123.4
atom chem shift.val err: 0.2

1,17144,706
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 706
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atom chem shift.comp id: ASP
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.33
atom chem shift.val err: 0.02

1,17144,707
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 707
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 64
atom chem shift.val: 3.78
atom chem shift.val err: 0.02

1,17144,708
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp index id: 64
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atom chem shift.val: 2.85
atom chem shift.val err: 0.02

1,17144,709
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp index id: 64
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atom chem shift.val: 2.89
atom chem shift.val err: 0.02

1,17144,710
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 710
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
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atom chem shift.val: 176.8
atom chem shift.val err: 0.2

1,17144,711
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 711
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
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atom chem shift.val: 59.1
atom chem shift.val err: 0.2

1,17144,712
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: ASP
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 42.9
atom chem shift.val err: 0.2

1,17144,713
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 713
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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: 64
atom chem shift.entity assembly id: 1
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atom chem shift.val: 118.5
atom chem shift.val err: 0.2

1,17144,714
type: atom chem shift
of datablock: info:bmrb/17144
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: 65
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 65
atom chem shift.val: 7.39
atom chem shift.val err: 0.02

1,17144,715
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: LYS
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atom chem shift.val: 4.13
atom chem shift.val err: 0.02

1,17144,716
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,717
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 2.11
atom chem shift.val err: 0.02

1,17144,718
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.86
atom chem shift.val err: 0.02

1,17144,719
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.88
atom chem shift.val err: 0.02

1,17144,720
type: atom chem shift
of datablock: info:bmrb/17144
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: 0.02

1,17144,721
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.17
atom chem shift.val err: 0.02

1,17144,722
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.62
atom chem shift.val err: 0.02

1,17144,723
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.76
atom chem shift.val err: 0.02

1,17144,724
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 179.3
atom chem shift.val err: 0.2

1,17144,725
type: atom chem shift
of datablock: info:bmrb/17144
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: 59.2
atom chem shift.val err: 0.2

1,17144,726
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 33.3
atom chem shift.val err: 0.2

1,17144,727
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 29.3
atom chem shift.val err: 0.2

1,17144,728
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 42.2
atom chem shift.val err: 0.2

1,17144,729
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 25.4
atom chem shift.val err: 0.2

1,17144,730
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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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: 114.9
atom chem shift.val err: 0.2

1,17144,731
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.12
atom chem shift.val err: 0.02

1,17144,732
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 5.32
atom chem shift.val err: 0.02

1,17144,733
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.45
atom chem shift.val err: 0.02

1,17144,734
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,735
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 176.9
atom chem shift.val err: 0.2

1,17144,736
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 62.1
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1,17144,737
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 42.2
atom chem shift.val err: 0.2

1,17144,738
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 119.7
atom chem shift.val err: 0.2

1,17144,739
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,740
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,741
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,742
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,743
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: -0.81
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1,17144,744
type: atom chem shift
of datablock: info:bmrb/17144
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of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,746
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.comp index id: 67
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atom chem shift.val: -2.36
atom chem shift.val err: 0.02

1,17144,747
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: -2.36
atom chem shift.val err: 0.02

1,17144,748
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,749
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,750
type: atom chem shift
of datablock: info:bmrb/17144
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type: atom chem shift
of datablock: info:bmrb/17144
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of datablock: info:bmrb/17144
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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: 67
atom chem shift.val: 24.1
atom chem shift.val err: 0.2

1,17144,754
type: atom chem shift
of datablock: info:bmrb/17144
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: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 20.7
atom chem shift.val err: 0.2

1,17144,755
type: atom chem shift
of datablock: info:bmrb/17144
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: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 25.8
atom chem shift.val err: 0.2

1,17144,756
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.comp id: LEU
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: 112.4
atom chem shift.val err: 0.2

1,17144,757
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.79
atom chem shift.val err: 0.02

1,17144,758
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.06
atom chem shift.val err: 0.02

1,17144,759
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.40
atom chem shift.val err: 0.02

1,17144,760
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.40
atom chem shift.val err: 0.02

1,17144,761
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.40
atom chem shift.val err: 0.02

1,17144,762
type: atom chem shift
of datablock: info:bmrb/17144
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: 178.5
atom chem shift.val err: 0.2

1,17144,763
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ALA
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 55.2
atom chem shift.val err: 0.2

1,17144,764
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 17.8
atom chem shift.val err: 0.2

1,17144,765
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 120.1
atom chem shift.val err: 0.2

1,17144,766
type: atom chem shift
of datablock: info:bmrb/17144
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: 6.85
atom chem shift.val err: 0.02

1,17144,767
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.99
atom chem shift.val err: 0.02

1,17144,768
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.33
atom chem shift.val err: 0.02

1,17144,769
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.39
atom chem shift.val err: 0.02

1,17144,770
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.06
atom chem shift.val err: 0.02

1,17144,771
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.91
atom chem shift.val err: 0.02

1,17144,772
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 172.9
atom chem shift.val err: 0.2

1,17144,773
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 52.9
atom chem shift.val err: 0.2

1,17144,774
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 37.3
atom chem shift.val err: 0.2

1,17144,775
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 178.4
atom chem shift.val err: 0.2

1,17144,776
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ASN
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 104.9
atom chem shift.val err: 0.2

1,17144,777
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 112.9
atom chem shift.val err: 0.2

1,17144,778
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,779
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,780
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,781
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,782
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,783
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,784
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,785
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of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,786
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,787
type: atom chem shift
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1,17144,788
type: atom chem shift
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atom chem shift.val err: 0.2

1,17144,789
type: atom chem shift
of datablock: info:bmrb/17144
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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: 70
atom chem shift.comp id: PRO
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: 29.0
atom chem shift.val err: 0.2

1,17144,790
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 790
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: 71
atom chem shift.comp id: GLN
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: 9.11
atom chem shift.val err: 0.02

1,17144,791
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 791
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: 71
atom chem shift.comp id: GLN
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: 4.83
atom chem shift.val err: 0.02

1,17144,792
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 792
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: 71
atom chem shift.comp id: GLN
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: 2.59
atom chem shift.val err: 0.02

1,17144,793
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 793
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: 71
atom chem shift.comp id: GLN
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: 2.72
atom chem shift.val err: 0.02

1,17144,794
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 794
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: 71
atom chem shift.comp id: GLN
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: 7.52
atom chem shift.val err: 0.02

1,17144,795
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 795
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: 71
atom chem shift.comp id: GLN
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: 8.33
atom chem shift.val err: 0.02

1,17144,796
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 796
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: 71
atom chem shift.comp id: GLN
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: 2.97
atom chem shift.val err: 0.02

1,17144,797
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 797
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: 71
atom chem shift.comp id: GLN
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: 3.17
atom chem shift.val err: 0.02

1,17144,798
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 798
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: 71
atom chem shift.comp id: GLN
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: 178.1
atom chem shift.val err: 0.2

1,17144,799
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 799
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: 71
atom chem shift.comp id: GLN
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: 58.2
atom chem shift.val err: 0.2

1,17144,800
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 800
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: 71
atom chem shift.comp id: GLN
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: 28.8
atom chem shift.val err: 0.2

1,17144,801
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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: 71
atom chem shift.comp id: GLN
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: 180.7
atom chem shift.val err: 0.2

1,17144,802
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 802
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: 71
atom chem shift.comp id: GLN
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: 34.7
atom chem shift.val err: 0.2

1,17144,803
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 803
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: 71
atom chem shift.comp id: GLN
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: 114.4
atom chem shift.val err: 0.2

1,17144,804
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 804
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: 71
atom chem shift.comp id: GLN
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: 113.8
atom chem shift.val err: 0.2

1,17144,805
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 805
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: 72
atom chem shift.comp id: ALA
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: 7.84
atom chem shift.val err: 0.02

1,17144,806
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 806
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: 72
atom chem shift.comp id: ALA
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: 4.50
atom chem shift.val err: 0.02

1,17144,807
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 807
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: 72
atom chem shift.comp id: ALA
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: 1.62
atom chem shift.val err: 0.02

1,17144,808
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 808
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: 72
atom chem shift.comp id: ALA
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: 1.62
atom chem shift.val err: 0.02

1,17144,809
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 809
atom chem shift.ambiguity code: 1
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: HB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 72
atom chem shift.comp id: ALA
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: 1.62
atom chem shift.val err: 0.02

1,17144,810
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 810
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: 72
atom chem shift.comp id: ALA
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: 179.4
atom chem shift.val err: 0.2

1,17144,811
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 811
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: 72
atom chem shift.comp id: ALA
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: 53.5
atom chem shift.val err: 0.2

1,17144,812
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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: ALA
atom chem shift.auth seq id: 72
atom chem shift.comp id: ALA
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: 19.0
atom chem shift.val err: 0.2

1,17144,813
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 813
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: 72
atom chem shift.comp id: ALA
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: 118.8
atom chem shift.val err: 0.2

1,17144,814
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 814
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: 73
atom chem shift.comp id: ASP
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: 8.47
atom chem shift.val err: 0.02

1,17144,815
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 815
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: 73
atom chem shift.comp id: ASP
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: 4.97
atom chem shift.val err: 0.02

1,17144,816
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 816
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: 73
atom chem shift.comp id: ASP
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: 4.00
atom chem shift.val err: 0.02

1,17144,817
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 817
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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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: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 3.63
atom chem shift.val err: 0.02

1,17144,818
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 818
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: 73
atom chem shift.comp id: ASP
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: 176.3
atom chem shift.val err: 0.2

1,17144,819
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 819
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: 73
atom chem shift.comp id: ASP
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: 56.2
atom chem shift.val err: 0.2

1,17144,820
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 820
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: 73
atom chem shift.comp id: ASP
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: 41.1
atom chem shift.val err: 0.2

1,17144,821
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 821
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: 73
atom chem shift.comp id: ASP
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: 115.9
atom chem shift.val err: 0.2

1,17144,822
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 822
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: 9.38
atom chem shift.val err: 0.02

1,17144,823
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 823
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: 4.65
atom chem shift.val err: 0.02

1,17144,824
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 824
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: 3.32
atom chem shift.val err: 0.02

1,17144,825
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 825
atom chem shift.ambiguity code: 1
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: 1.22
atom chem shift.val err: 0.02

1,17144,826
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 826
atom chem shift.ambiguity code: 1
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: 1.22
atom chem shift.val err: 0.02

1,17144,827
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 827
atom chem shift.ambiguity code: 1
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: 1.22
atom chem shift.val err: 0.02

1,17144,828
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 828
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: 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: 1.74
atom chem shift.val err: 0.02

1,17144,829
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 829
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: 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: 1.74
atom chem shift.val err: 0.02

1,17144,830
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 830
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: 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: 1.74
atom chem shift.val err: 0.02

1,17144,831
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 831
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: 170.3
atom chem shift.val err: 0.2

1,17144,832
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 832
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: 59.4
atom chem shift.val err: 0.2

1,17144,833
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 833
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: 33.3
atom chem shift.val err: 0.2

1,17144,834
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 834
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: 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: 22.4
atom chem shift.val err: 0.2

1,17144,835
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 835
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: 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: 21.3
atom chem shift.val err: 0.2

1,17144,836
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 836
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: 117.4
atom chem shift.val err: 0.2

1,17144,837
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 837
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: 75
atom chem shift.comp id: PRO
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: 5.03
atom chem shift.val err: 0.02

1,17144,838
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 838
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: 75
atom chem shift.comp id: PRO
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: 2.05
atom chem shift.val err: 0.02

1,17144,839
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 839
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: 75
atom chem shift.comp id: PRO
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: 2.53
atom chem shift.val err: 0.02

1,17144,840
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 840
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: 75
atom chem shift.comp id: PRO
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: 3.69
atom chem shift.val err: 0.02

1,17144,841
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 841
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: 75
atom chem shift.comp id: PRO
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: 3.82
atom chem shift.val err: 0.02

1,17144,842
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 842
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: 75
atom chem shift.comp id: PRO
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: 2.29
atom chem shift.val err: 0.02

1,17144,843
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 843
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: 75
atom chem shift.comp id: PRO
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: 2.32
atom chem shift.val err: 0.02

1,17144,844
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 844
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: 75
atom chem shift.comp id: PRO
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: 179.2
atom chem shift.val err: 0.2

1,17144,845
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 845
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: 75
atom chem shift.comp id: PRO
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: 64.5
atom chem shift.val err: 0.2

1,17144,846
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 846
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: 75
atom chem shift.comp id: PRO
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: 31.4
atom chem shift.val err: 0.2

1,17144,847
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 847
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: 75
atom chem shift.comp id: PRO
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: 49.8
atom chem shift.val err: 0.2

1,17144,848
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 848
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: 75
atom chem shift.comp id: PRO
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: 27.7
atom chem shift.val err: 0.2

1,17144,849
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 849
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: 76
atom chem shift.comp id: GLY
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: 9.42
atom chem shift.val err: 0.02

1,17144,850
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 850
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: 76
atom chem shift.comp id: GLY
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: 3.90
atom chem shift.val err: 0.02

1,17144,851
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 851
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: 76
atom chem shift.comp id: GLY
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: 4.53
atom chem shift.val err: 0.02

1,17144,852
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 852
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: 76
atom chem shift.comp id: GLY
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: 176.6
atom chem shift.val err: 0.2

1,17144,853
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 853
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: 76
atom chem shift.comp id: GLY
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: 45.0
atom chem shift.val err: 0.2

1,17144,854
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 854
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: 76
atom chem shift.comp id: GLY
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: 112.7
atom chem shift.val err: 0.2

1,17144,855
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 855
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: 77
atom chem shift.comp id: THR
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: 9.12
atom chem shift.val err: 0.02

1,17144,856
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 856
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: 77
atom chem shift.comp id: THR
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: 4.94
atom chem shift.val err: 0.02

1,17144,857
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 857
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: 77
atom chem shift.comp id: THR
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: 5.57
atom chem shift.val err: 0.02

1,17144,858
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 858
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: 77
atom chem shift.comp id: THR
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: 2.86
atom chem shift.val err: 0.02

1,17144,859
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 859
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: 77
atom chem shift.comp id: THR
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: 2.86
atom chem shift.val err: 0.02

1,17144,860
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 860
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: 77
atom chem shift.comp id: THR
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: 2.86
atom chem shift.val err: 0.02

1,17144,861
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 861
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atom chem shift.val: 173.8
atom chem shift.val err: 0.2

1,17144,862
type: atom chem shift
of datablock: info:bmrb/17144
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: 62.4
atom chem shift.val err: 0.2

1,17144,863
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: THR
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: 70.2
atom chem shift.val err: 0.2

1,17144,864
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 77
atom chem shift.val: 21.5
atom chem shift.val err: 0.2

1,17144,865
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 865
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atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.comp id: THR
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: 117.2
atom chem shift.val err: 0.2

1,17144,866
type: atom chem shift
of datablock: info:bmrb/17144
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: 78
atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.93
atom chem shift.val err: 0.02

1,17144,867
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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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: 4.33
atom chem shift.val err: 0.02

1,17144,868
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: LYS
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atom chem shift.val: 1.03
atom chem shift.val err: 0.02

1,17144,869
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.20
atom chem shift.val err: 0.02

1,17144,870
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.96
atom chem shift.val err: 0.02

1,17144,871
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.02
atom chem shift.val err: 0.02

1,17144,872
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.15
atom chem shift.val err: 0.02

1,17144,873
type: atom chem shift
of datablock: info:bmrb/17144
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: 2.30
atom chem shift.val err: 0.02

1,17144,874
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.27
atom chem shift.val err: 0.02

1,17144,875
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.82
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1,17144,876
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 173.6
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1,17144,877
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,878
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,879
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 28.7
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1,17144,880
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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1,17144,881
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,882
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,883
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,884
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,885
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,886
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,887
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,888
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,889
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,890
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,891
type: atom chem shift
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1,17144,892
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1,17144,893
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of datablock: info:bmrb/17144
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1,17144,895
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1,17144,896
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atom chem shift.comp id: PRO
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: 2.52
atom chem shift.val err: 0.02

1,17144,898
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 1.29
atom chem shift.val err: 0.02

1,17144,899
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 899
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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: 1.42
atom chem shift.val err: 0.02

1,17144,900
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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: 174.1
atom chem shift.val err: 0.2

1,17144,901
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 62.5
atom chem shift.val err: 0.2

1,17144,902
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 28.1
atom chem shift.val err: 0.2

1,17144,903
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 50.8
atom chem shift.val err: 0.2

1,17144,904
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 80
atom chem shift.val: 26.0
atom chem shift.val err: 0.2

1,17144,905
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 905
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.10
atom chem shift.val err: 0.02

1,17144,906
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 906
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.70
atom chem shift.val err: 0.02

1,17144,907
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 907
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atom chem shift.auth comp id: TYR
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atom chem shift.comp id: TYR
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: 2.69
atom chem shift.val err: 0.02

1,17144,908
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 908
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atom chem shift.auth comp id: TYR
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 81
atom chem shift.val: 4.25
atom chem shift.val err: 0.02

1,17144,909
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 909
atom chem shift.ambiguity code: 3
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 6.62
atom chem shift.val err: 0.02

1,17144,910
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.98
atom chem shift.val err: 0.02

1,17144,911
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 175.5
atom chem shift.val err: 0.2

1,17144,912
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 912
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 57.8
atom chem shift.val err: 0.2

1,17144,913
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 42.8
atom chem shift.val err: 0.2

1,17144,914
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 914
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 81
atom chem shift.val: 131.4
atom chem shift.val err: 0.2

1,17144,915
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 915
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 117.4
atom chem shift.val err: 0.2

1,17144,916
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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: TYR
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 123.9
atom chem shift.val err: 0.2

1,17144,917
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 8.78
atom chem shift.val err: 0.02

1,17144,918
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 4.52
atom chem shift.val err: 0.02

1,17144,919
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 1.97
atom chem shift.val err: 0.02

1,17144,920
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 2.04
atom chem shift.val err: 0.02

1,17144,921
type: atom chem shift
of datablock: info:bmrb/17144
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: 2.08
atom chem shift.val err: 0.02

1,17144,922
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 922
atom chem shift.ambiguity code: 1
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 2.08
atom chem shift.val err: 0.02

1,17144,923
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 2.08
atom chem shift.val err: 0.02

1,17144,924
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.52
atom chem shift.val err: 0.02

1,17144,925
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.66
atom chem shift.val err: 0.02

1,17144,926
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 926
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 176.1
atom chem shift.val err: 0.2

1,17144,927
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 927
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atom chem shift.val: 57.7
atom chem shift.val err: 0.2

1,17144,928
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 32.1
atom chem shift.val err: 0.2

1,17144,929
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.val: 16.8
atom chem shift.val err: 0.2

1,17144,930
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 32.0
atom chem shift.val err: 0.2

1,17144,931
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 931
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: N
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atom chem shift.comp id: MET
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
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atom chem shift.val: 127.0
atom chem shift.val err: 0.2

1,17144,932
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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.val: 5.31
atom chem shift.val err: 0.02

1,17144,933
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.48
atom chem shift.val err: 0.02

1,17144,934
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 4.61
atom chem shift.val err: 0.02

1,17144,935
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 171.1
atom chem shift.val err: 0.2

1,17144,936
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.2

1,17144,937
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,938
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,939
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,940
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,941
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,942
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,943
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,944
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,945
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,946
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,947
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,948
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,949
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1,17144,950
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1,17144,951
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1,17144,952
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1,17144,953
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of datablock: info:bmrb/17144
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1,17144,954
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of datablock: info:bmrb/17144
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1,17144,955
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of datablock: info:bmrb/17144
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1,17144,956
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of datablock: info:bmrb/17144
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1,17144,957
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1,17144,958
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1,17144,959
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1,17144,960
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1,17144,961
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,962
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,963
type: atom chem shift
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1,17144,964
type: atom chem shift
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1,17144,965
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,966
type: atom chem shift
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1,17144,968
type: atom chem shift
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1,17144,969
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 53.1
atom chem shift.val err: 0.2

1,17144,970
type: atom chem shift
of datablock: info:bmrb/17144
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: 86
atom chem shift.val: 39.1
atom chem shift.val err: 0.2

1,17144,971
type: atom chem shift
of datablock: info:bmrb/17144
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: 86
atom chem shift.val: 176.1
atom chem shift.val err: 0.2

1,17144,972
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
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atom chem shift.val: 116.6
atom chem shift.val err: 0.2

1,17144,973
type: atom chem shift
of datablock: info:bmrb/17144
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: 86
atom chem shift.val: 113.4
atom chem shift.val err: 0.2

1,17144,974
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.02
atom chem shift.val err: 0.02

1,17144,975
type: atom chem shift
of datablock: info:bmrb/17144
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: 3.69
atom chem shift.val err: 0.02

1,17144,976
type: atom chem shift
of datablock: info:bmrb/17144
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: 1.42
atom chem shift.val err: 0.02

1,17144,977
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.42
atom chem shift.val err: 0.02

1,17144,978
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.42
atom chem shift.val err: 0.02

1,17144,979
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 180.1
atom chem shift.val err: 0.2

1,17144,980
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 55.5
atom chem shift.val err: 0.2

1,17144,981
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 19.0
atom chem shift.val err: 0.2

1,17144,982
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 130.2
atom chem shift.val err: 0.2

1,17144,983
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.11
atom chem shift.val err: 0.02

1,17144,984
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,985
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.20
atom chem shift.val err: 0.02

1,17144,986
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.13
atom chem shift.val err: 0.02

1,17144,987
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,988
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,989
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,990
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,991
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,992
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,993
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,994
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 7.29
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1,17144,995
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,996
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,997
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,998
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,999
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1000
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1001
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1002
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1003
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1004
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1005
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1005
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: 90
atom chem shift.comp id: ARG
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: 1.70
atom chem shift.val err: 0.02

1,17144,1006
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1006
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: 90
atom chem shift.comp id: ARG
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: 3.11
atom chem shift.val err: 0.02

1,17144,1007
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1007
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: 90
atom chem shift.comp id: ARG
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: 3.27
atom chem shift.val err: 0.02

1,17144,1008
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1008
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE
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: ARG
atom chem shift.auth seq id: 90
atom chem shift.comp id: ARG
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: 8.15
atom chem shift.val err: 0.02

1,17144,1009
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1009
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: 90
atom chem shift.comp id: ARG
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: 0.77
atom chem shift.val err: 0.02

1,17144,1010
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1010
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: 90
atom chem shift.comp id: ARG
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: 1.47
atom chem shift.val err: 0.02

1,17144,1011
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1011
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HH11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HH11
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 90
atom chem shift.comp id: ARG
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: 6.83
atom chem shift.val err: 0.02

1,17144,1012
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1012
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: 90
atom chem shift.comp id: ARG
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: 177.6
atom chem shift.val err: 0.2

1,17144,1013
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1013
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: 90
atom chem shift.comp id: ARG
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: 60.3
atom chem shift.val err: 0.2

1,17144,1014
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1014
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: 90
atom chem shift.comp id: ARG
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: 31.3
atom chem shift.val err: 0.2

1,17144,1015
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1015
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: 90
atom chem shift.comp id: ARG
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: 43.2
atom chem shift.val err: 0.2

1,17144,1016
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1016
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: 90
atom chem shift.comp id: ARG
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: 28.5
atom chem shift.val err: 0.2

1,17144,1017
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1017
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CZ
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CZ
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 90
atom chem shift.comp id: ARG
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: 158.8
atom chem shift.val err: 0.2

1,17144,1018
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1018
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: 90
atom chem shift.comp id: ARG
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: 116.9
atom chem shift.val err: 0.2

1,17144,1019
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1019
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 90
atom chem shift.comp id: ARG
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: 83.3
atom chem shift.val err: 0.2

1,17144,1020
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1020
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NH1
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NH1
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 90
atom chem shift.comp id: ARG
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: 70.5
atom chem shift.val err: 0.2

1,17144,1021
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1021
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: 91
atom chem shift.comp id: ALA
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: 7.70
atom chem shift.val err: 0.02

1,17144,1022
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1022
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: 91
atom chem shift.comp id: ALA
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: 3.72
atom chem shift.val err: 0.02

1,17144,1023
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1023
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: 91
atom chem shift.comp id: ALA
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: 1.36
atom chem shift.val err: 0.02

1,17144,1024
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1024
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: 91
atom chem shift.comp id: ALA
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: 1.36
atom chem shift.val err: 0.02

1,17144,1025
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1025
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: 91
atom chem shift.comp id: ALA
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: 1.36
atom chem shift.val err: 0.02

1,17144,1026
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1026
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: 91
atom chem shift.comp id: ALA
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: 180.7
atom chem shift.val err: 0.2

1,17144,1027
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1027
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: 91
atom chem shift.comp id: ALA
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: 54.8
atom chem shift.val err: 0.2

1,17144,1028
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1028
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: 91
atom chem shift.comp id: ALA
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: 17.5
atom chem shift.val err: 0.2

1,17144,1029
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1029
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: 91
atom chem shift.comp id: ALA
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: 120.4
atom chem shift.val err: 0.2

1,17144,1030
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1030
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: 92
atom chem shift.comp id: ASP
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: 7.89
atom chem shift.val err: 0.02

1,17144,1031
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1031
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: 92
atom chem shift.comp id: ASP
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: 4.12
atom chem shift.val err: 0.02

1,17144,1032
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1032
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: 92
atom chem shift.comp id: ASP
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: 2.45
atom chem shift.val err: 0.02

1,17144,1033
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1033
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: 92
atom chem shift.comp id: ASP
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: 2.62
atom chem shift.val err: 0.02

1,17144,1034
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1034
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: 92
atom chem shift.comp id: ASP
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: 177.9
atom chem shift.val err: 0.2

1,17144,1035
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1035
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: 92
atom chem shift.comp id: ASP
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: 57.5
atom chem shift.val err: 0.2

1,17144,1036
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1036
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: 92
atom chem shift.comp id: ASP
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: 38.9
atom chem shift.val err: 0.2

1,17144,1037
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1037
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: 92
atom chem shift.comp id: ASP
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: 121.1
atom chem shift.val err: 0.2

1,17144,1038
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1038
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: 93
atom chem shift.comp id: VAL
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: 7.98
atom chem shift.val err: 0.02

1,17144,1039
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1039
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: 93
atom chem shift.comp id: VAL
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: 3.07
atom chem shift.val err: 0.02

1,17144,1040
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1040
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: 93
atom chem shift.comp id: VAL
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: 1.34
atom chem shift.val err: 0.02

1,17144,1041
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1041
atom chem shift.ambiguity code: 1
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: 93
atom chem shift.comp id: VAL
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: -0.34
atom chem shift.val err: 0.02

1,17144,1042
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1042
atom chem shift.ambiguity code: 1
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: 93
atom chem shift.comp id: VAL
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: -0.34
atom chem shift.val err: 0.02

1,17144,1043
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1043
atom chem shift.ambiguity code: 1
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: 93
atom chem shift.comp id: VAL
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: -0.34
atom chem shift.val err: 0.02

1,17144,1044
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1044
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: VAL
atom chem shift.auth seq id: 93
atom chem shift.comp id: VAL
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: 0.34
atom chem shift.val err: 0.02

1,17144,1045
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1045
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: VAL
atom chem shift.auth seq id: 93
atom chem shift.comp id: VAL
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: 0.34
atom chem shift.val err: 0.02

1,17144,1046
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1046
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: VAL
atom chem shift.auth seq id: 93
atom chem shift.comp id: VAL
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: 0.34
atom chem shift.val err: 0.02

1,17144,1047
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1047
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: 93
atom chem shift.comp id: VAL
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: 177.4
atom chem shift.val err: 0.2

1,17144,1048
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1048
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: 93
atom chem shift.comp id: VAL
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: 66.9
atom chem shift.val err: 0.2

1,17144,1049
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1049
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: 93
atom chem shift.comp id: VAL
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: 30.5
atom chem shift.val err: 0.2

1,17144,1050
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1050
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: VAL
atom chem shift.auth seq id: 93
atom chem shift.comp id: VAL
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: 21.3
atom chem shift.val err: 0.2

1,17144,1051
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1051
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: VAL
atom chem shift.auth seq id: 93
atom chem shift.comp id: VAL
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: 24.5
atom chem shift.val err: 0.2

1,17144,1052
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1052
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: 93
atom chem shift.comp id: VAL
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: 121.6
atom chem shift.val err: 0.2

1,17144,1053
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1053
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: 94
atom chem shift.comp id: VAL
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: 8.34
atom chem shift.val err: 0.02

1,17144,1054
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1054
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: 94
atom chem shift.comp id: VAL
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: 2.74
atom chem shift.val err: 0.02

1,17144,1055
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1055
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: 94
atom chem shift.comp id: VAL
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: 1.90
atom chem shift.val err: 0.02

1,17144,1056
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1056
atom chem shift.ambiguity code: 1
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: 94
atom chem shift.comp id: VAL
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: 0.78
atom chem shift.val err: 0.02

1,17144,1057
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1057
atom chem shift.ambiguity code: 1
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: 94
atom chem shift.comp id: VAL
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: 0.78
atom chem shift.val err: 0.02

1,17144,1058
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1058
atom chem shift.ambiguity code: 1
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: 94
atom chem shift.comp id: VAL
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: 0.78
atom chem shift.val err: 0.02

1,17144,1059
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1059
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: VAL
atom chem shift.auth seq id: 94
atom chem shift.comp id: VAL
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: 0.54
atom chem shift.val err: 0.02

1,17144,1060
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1060
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: VAL
atom chem shift.auth seq id: 94
atom chem shift.comp id: VAL
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: 0.54
atom chem shift.val err: 0.02

1,17144,1061
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1061
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: VAL
atom chem shift.auth seq id: 94
atom chem shift.comp id: VAL
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: 0.54
atom chem shift.val err: 0.02

1,17144,1062
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1062
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: 94
atom chem shift.comp id: VAL
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: 176.4
atom chem shift.val err: 0.2

1,17144,1063
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1063
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: 94
atom chem shift.comp id: VAL
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: 67.8
atom chem shift.val err: 0.2

1,17144,1064
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1064
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: 94
atom chem shift.comp id: VAL
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: 30.9
atom chem shift.val err: 0.2

1,17144,1065
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1065
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: VAL
atom chem shift.auth seq id: 94
atom chem shift.comp id: VAL
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: 21.7
atom chem shift.val err: 0.2

1,17144,1066
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1066
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: VAL
atom chem shift.auth seq id: 94
atom chem shift.comp id: VAL
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: 24.0
atom chem shift.val err: 0.2

1,17144,1067
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1067
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: 94
atom chem shift.comp id: VAL
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: 121.1
atom chem shift.val err: 0.2

1,17144,1068
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1068
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: 95
atom chem shift.comp id: ALA
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: 7.68
atom chem shift.val err: 0.02

1,17144,1069
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1069
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: 95
atom chem shift.comp id: ALA
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: 3.87
atom chem shift.val err: 0.02

1,17144,1070
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1070
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: 95
atom chem shift.comp id: ALA
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: 1.21
atom chem shift.val err: 0.02

1,17144,1071
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1071
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: 95
atom chem shift.comp id: ALA
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: 1.21
atom chem shift.val err: 0.02

1,17144,1072
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1072
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: 95
atom chem shift.comp id: ALA
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: 1.21
atom chem shift.val err: 0.02

1,17144,1073
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1073
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: 95
atom chem shift.comp id: ALA
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: 180.5
atom chem shift.val err: 0.2

1,17144,1074
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1074
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: 95
atom chem shift.comp id: ALA
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: 54.5
atom chem shift.val err: 0.2

1,17144,1075
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1075
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: 95
atom chem shift.comp id: ALA
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: 18.0
atom chem shift.val err: 0.2

1,17144,1076
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1076
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: 95
atom chem shift.comp id: ALA
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: 120.8
atom chem shift.val err: 0.2

1,17144,1077
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1077
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atom chem shift.auth comp id: TYR
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atom chem shift.comp id: TYR
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: 7.70
atom chem shift.val err: 0.02

1,17144,1078
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1078
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atom chem shift.comp id: TYR
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: 4.15
atom chem shift.val err: 0.02

1,17144,1079
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1079
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atom chem shift.comp id: TYR
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: 2.65
atom chem shift.val err: 0.02

1,17144,1080
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1080
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.99
atom chem shift.val err: 0.02

1,17144,1081
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
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atom chem shift.val: 178.4
atom chem shift.val err: 0.2

1,17144,1082
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 60.6
atom chem shift.val err: 0.2

1,17144,1083
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 37.0
atom chem shift.val err: 0.2

1,17144,1084
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1084
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atom chem shift.comp id: TYR
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: 117.8
atom chem shift.val err: 0.2

1,17144,1085
type: atom chem shift
of datablock: info:bmrb/17144
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: 97
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 97
atom chem shift.val: 8.45
atom chem shift.val err: 0.02

1,17144,1086
type: atom chem shift
of datablock: info:bmrb/17144
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: 97
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 97
atom chem shift.val: 3.16
atom chem shift.val err: 0.02

1,17144,1087
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1087
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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: 97
atom chem shift.val: 0.61
atom chem shift.val err: 0.02

1,17144,1088
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.60
atom chem shift.val err: 0.02

1,17144,1089
type: atom chem shift
of datablock: info:bmrb/17144
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: -0.57
atom chem shift.val err: 0.02

1,17144,1090
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: -0.57
atom chem shift.val err: 0.02

1,17144,1091
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: -0.57
atom chem shift.val err: 0.02

1,17144,1092
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: -0.27
atom chem shift.val err: 0.02

1,17144,1093
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: -0.27
atom chem shift.val err: 0.02

1,17144,1094
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: -0.27
atom chem shift.val err: 0.02

1,17144,1095
type: atom chem shift
of datablock: info:bmrb/17144
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

1,17144,1096
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 178.7
atom chem shift.val err: 0.2

1,17144,1097
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 57.3
atom chem shift.val err: 0.2

1,17144,1098
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 39.8
atom chem shift.val err: 0.2

1,17144,1099
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1100
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 22.4
atom chem shift.val err: 0.2

1,17144,1101
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 25.5
atom chem shift.val err: 0.2

1,17144,1102
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.comp id: LEU
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1,17144,1103
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1104
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 3.10
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1,17144,1105
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.41
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1,17144,1106
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1107
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 6.38
atom chem shift.val err: 0.02

1,17144,1108
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 6.53
atom chem shift.val err: 0.02

1,17144,1109
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1110
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1111
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1112
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.comp id: GLN
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: 58.2
atom chem shift.val err: 0.2

1,17144,1113
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1113
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atom chem shift.comp id: GLN
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: 28.2
atom chem shift.val err: 0.2

1,17144,1114
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1114
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: GLN
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: 179.3
atom chem shift.val err: 0.2

1,17144,1115
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1115
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atom chem shift.atom id: CG
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atom chem shift.comp id: GLN
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: 33.4
atom chem shift.val err: 0.2

1,17144,1116
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1116
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: 98
atom chem shift.comp id: GLN
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: 117.4
atom chem shift.val err: 0.2

1,17144,1117
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1117
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 98
atom chem shift.val: 109.3
atom chem shift.val err: 0.2

1,17144,1118
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1118
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atom chem shift.comp id: THR
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: 7.30
atom chem shift.val err: 0.02

1,17144,1119
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1119
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atom chem shift.comp id: THR
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: 4.13
atom chem shift.val err: 0.02

1,17144,1120
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1120
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HB
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atom chem shift.auth seq id: 99
atom chem shift.comp id: THR
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: 4.25
atom chem shift.val err: 0.02

1,17144,1121
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 1121
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HG21
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atom chem shift.comp id: THR
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: 1.25
atom chem shift.val err: 0.02

1,17144,1122
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1122
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atom chem shift.atom id: HG22
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atom chem shift.comp id: THR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 99
atom chem shift.val: 1.25
atom chem shift.val err: 0.02

1,17144,1123
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1123
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atom chem shift.comp id: THR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.25
atom chem shift.val err: 0.02

1,17144,1124
type: atom chem shift
of datablock: info:bmrb/17144
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: 174.9
atom chem shift.val err: 0.2

1,17144,1125
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 99
atom chem shift.val: 62.4
atom chem shift.val err: 0.2

1,17144,1126
type: atom chem shift
of datablock: info:bmrb/17144
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.entity assembly id: 1
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atom chem shift.val: 69.9
atom chem shift.val err: 0.2

1,17144,1127
type: atom chem shift
of datablock: info:bmrb/17144
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: 21.5
atom chem shift.val err: 0.2

1,17144,1128
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1128
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atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 99
atom chem shift.comp id: THR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 99
atom chem shift.val: 107.5
atom chem shift.val err: 0.2

1,17144,1129
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1129
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atom chem shift.comp id: LEU
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: 6.79
atom chem shift.val err: 0.02

1,17144,1130
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1130
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atom chem shift.comp id: LEU
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: 4.25
atom chem shift.val err: 0.02

1,17144,1131
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1131
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: LEU
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: 1.38
atom chem shift.val err: 0.02

1,17144,1132
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1132
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 100
atom chem shift.val: 1.91
atom chem shift.val err: 0.02

1,17144,1133
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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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: 100
atom chem shift.val: 0.25
atom chem shift.val err: 0.02

1,17144,1134
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1134
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.25
atom chem shift.val err: 0.02

1,17144,1135
type: atom chem shift
of datablock: info:bmrb/17144
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: 0.25
atom chem shift.val err: 0.02

1,17144,1136
type: atom chem shift
of datablock: info:bmrb/17144
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: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.30
atom chem shift.val err: 0.02

1,17144,1137
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.30
atom chem shift.val err: 0.02

1,17144,1138
type: atom chem shift
of datablock: info:bmrb/17144
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: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.30
atom chem shift.val err: 0.02

1,17144,1139
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.19
atom chem shift.val err: 0.02

1,17144,1140
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1140
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 177.4
atom chem shift.val err: 0.2

1,17144,1141
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1141
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 54.2
atom chem shift.val err: 0.2

1,17144,1142
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 40.3
atom chem shift.val err: 0.2

1,17144,1143
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 1143
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atom chem shift.val err: 0.2

1,17144,1144
type: atom chem shift
of datablock: info:bmrb/17144
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: 26.1
atom chem shift.val err: 0.2

1,17144,1145
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.2

1,17144,1146
type: atom chem shift
of datablock: info:bmrb/17144
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: 100
atom chem shift.entity assembly id: 1
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atom chem shift.val: 119.9
atom chem shift.val err: 0.2

1,17144,1147
type: atom chem shift
of datablock: info:bmrb/17144
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: 8.22
atom chem shift.val err: 0.02

1,17144,1148
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 3.83
atom chem shift.val err: 0.02

1,17144,1149
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.14
atom chem shift.val err: 0.02

1,17144,1150
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 172.9
atom chem shift.val err: 0.2

1,17144,1151
type: atom chem shift
of datablock: info:bmrb/17144
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: 45.1
atom chem shift.val err: 0.2

1,17144,1152
type: atom chem shift
of datablock: info:bmrb/17144
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: 113.5
atom chem shift.val err: 0.2

1,17144,1153
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.90
atom chem shift.val err: 0.02

1,17144,1154
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val: 4.08
atom chem shift.val err: 0.02

1,17144,1155
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.68
atom chem shift.val err: 0.02

1,17144,1156
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,1157
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.61
atom chem shift.val err: 0.02

1,17144,1158
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,1159
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,1160
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.02

1,17144,1161
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,1162
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.02

1,17144,1163
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1164
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,1165
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1166
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,1167
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,1168
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,1169
type: atom chem shift
of datablock: info:bmrb/17144
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atom chem shift.val err: 0.2

1,17144,1170
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1171
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1172
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1173
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1174
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1175
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1176
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1177
type: atom chem shift
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1,17144,1178
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1179
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1180
type: atom chem shift
of datablock: info:bmrb/17144
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1,17144,1181
type: atom chem shift
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1,17144,1182
type: atom chem shift
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1,17144,1183
type: atom chem shift
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atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: -29.6
atom chem shift.val err: 0.2

1,17144,1184
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1184
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CAB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CAB
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: 10.5
atom chem shift.val err: 0.2

1,17144,1185
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1185
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CAD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CAD
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: 1.75
atom chem shift.val err: 0.2

1,17144,1186
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1186
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CBA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CBA
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: 123.2
atom chem shift.val err: 0.2

1,17144,1187
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1187
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CBB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CBB
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: 34.9
atom chem shift.val err: 0.2

1,17144,1188
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1188
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CBC
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CBC
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: 101.9
atom chem shift.val err: 0.2

1,17144,1189
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1189
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CMB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CMB
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: -22.7
atom chem shift.val err: 0.2

1,17144,1190
type: atom chem shift
of datablock: info:bmrb/17144
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 17144
atom chem shift.id: 1190
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CMD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CMD
atom chem shift.auth comp id: HEM
atom chem shift.auth seq id: 999
atom chem shift.comp id: HEM
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 2
atom chem shift.entity id: 2
atom chem shift.seq id: 1
atom chem shift.val: -24.9
atom chem shift.val err: 0.2

1,17144,1
type: bond
of datablock: info:bmrb/17144
bond.assembly id: 1
bond.entry id: 17144
bond.id: 1
bond.atom id 1: SG
bond.atom id 2: CAB
bond.comp id 1: CYS
bond.comp id 2: HEM
bond.comp index id 1: 14
bond.comp index id 2: 1
bond.entity assembly id 1: 1
bond.entity assembly id 2: 2
bond.entity assembly name 1: ApcA
bond.entity assembly name 2: heme
bond.entity id 1: 1
bond.entity id 2: 2
bond.seq id 1: 14
bond.seq id 2: 1
bond.type: thioether
bond.value order: sing

1,17144,2
type: bond
of datablock: info:bmrb/17144
bond.assembly id: 1
bond.entry id: 17144
bond.id: 2
bond.atom id 1: SG
bond.atom id 2: CAC
bond.comp id 1: CYS
bond.comp id 2: HEM
bond.comp index id 1: 17
bond.comp index id 2: 1
bond.entity assembly id 1: 1
bond.entity assembly id 2: 2
bond.entity assembly name 1: ApcA
bond.entity assembly name 2: heme
bond.entity id 1: 1
bond.entity id 2: 2
bond.seq id 1: 17
bond.seq id 2: 1
bond.type: thioether
bond.value order: sing

17144,HEM
type: chem comp
of datablock: info:bmrb/17144
reference to entry: entry
chem comp.entry id: 17144
chem comp.id: HEM
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 Jun 9 14:29:58 2009
chem comp.formal charge: 0
chem comp.formula: C34 H32 Fe N4 O4
chem comp.formula weight: 616.487
chem comp.ideal coordinates missing flag: yes
chem comp.model coordinates db code: 1A6M
chem comp.model coordinates missing flag: no
chem comp.name: PROTOPORPHYRIN IX CONTAINING FE
chem comp.pdb code: HEM
chem comp.processing site: RCSB
chem comp.provenance: na
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_HEM
chem comp.three letter code: HEM
chem comp.type: NON-POLYMER

info:pdb-ccd/HEM

pdb-ccd:HEM

info:pdb.ligand/HEM

pdb.ligand:HEM

C4A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C4A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.411
chem comp atom.model cartn y: 29.112
chem comp atom.model cartn z: 7.593
chem comp atom.pdb atom id: C4A
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C1A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C1A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.320
chem comp atom.model cartn y: 30.527
chem comp atom.model cartn z: 6.185
chem comp atom.pdb atom id: C1A
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C1B,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C1B
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.423
chem comp atom.model cartn y: 26.879
chem comp atom.model cartn z: 7.368
chem comp atom.pdb atom id: C1B
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C1C,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C1C
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.834
chem comp atom.model cartn y: 25.344
chem comp atom.model cartn z: 3.365
chem comp atom.pdb atom id: C1C
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C1D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C1D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.682
chem comp atom.model cartn y: 29.076
chem comp atom.model cartn z: 2.164
chem comp atom.pdb atom id: C1D
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C2A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C2A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.292
chem comp atom.model cartn y: 31.177
chem comp atom.model cartn z: 7.500
chem comp atom.pdb atom id: C2A
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C2B,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C2B
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.776
chem comp atom.model cartn y: 25.680
chem comp atom.model cartn z: 7.928
chem comp atom.pdb atom id: C2B
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C2C,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C2C
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.050
chem comp atom.model cartn y: 24.629
chem comp atom.model cartn z: 2.134
chem comp atom.pdb atom id: C2C
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C2D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C2D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.362
chem comp atom.model cartn y: 30.195
chem comp atom.model cartn z: 1.608
chem comp atom.pdb atom id: C2D
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C3A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C3A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.744
chem comp atom.model cartn y: 30.264
chem comp atom.model cartn z: 8.355
chem comp atom.pdb atom id: C3A
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C3B,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C3B
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.644
chem comp atom.model cartn y: 24.800
chem comp atom.model cartn z: 6.938
chem comp atom.pdb atom id: C3B
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C3C,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C3C
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.671
chem comp atom.model cartn y: 25.493
chem comp atom.model cartn z: 1.316
chem comp atom.pdb atom id: C3C
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C3D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C3D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.570
chem comp atom.model cartn y: 31.069
chem comp atom.model cartn z: 2.646
chem comp atom.pdb atom id: C3D
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4B,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C4B
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.185
chem comp atom.model cartn y: 25.434
chem comp atom.model cartn z: 5.760
chem comp atom.pdb atom id: C4B
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4C,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C4C
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.805
chem comp atom.model cartn y: 26.752
chem comp atom.model cartn z: 2.018
chem comp atom.pdb atom id: C4C
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: C4D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.937
chem comp atom.model cartn y: 30.499
chem comp atom.model cartn z: 3.808
chem comp atom.pdb atom id: C4D
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CAA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CAA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.687
chem comp atom.model cartn y: 32.583
chem comp atom.model cartn z: 7.757
chem comp atom.pdb atom id: CAA
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CAB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CAB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.101
chem comp atom.model cartn y: 23.393
chem comp atom.model cartn z: 6.989
chem comp atom.pdb atom id: CAB
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CAC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CAC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.240
chem comp atom.model cartn y: 25.293
chem comp atom.model cartn z: -0.044
chem comp atom.pdb atom id: CAC
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CAD,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CAD
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 17.387
chem comp atom.model cartn y: 32.329
chem comp atom.model cartn z: 2.587
chem comp atom.pdb atom id: CAD
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CBA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CBA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.458
chem comp atom.model cartn y: 33.524
chem comp atom.model cartn z: 7.976
chem comp atom.pdb atom id: CBA
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CBB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CBB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.295
chem comp atom.model cartn y: 22.586
chem comp atom.model cartn z: 8.017
chem comp atom.pdb atom id: CBB
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CBC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CBC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.157
chem comp atom.model cartn y: 24.199
chem comp atom.model cartn z: -0.766
chem comp atom.pdb atom id: CBC
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CBD,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CBD
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 18.889
chem comp atom.model cartn y: 32.017
chem comp atom.model cartn z: 2.859
chem comp atom.pdb atom id: CBD
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CGA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CGA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.561
chem comp atom.model cartn y: 33.534
chem comp atom.model cartn z: 6.775
chem comp atom.pdb atom id: CGA
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CGD,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CGD
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 19.762
chem comp atom.model cartn y: 33.226
chem comp atom.model cartn z: 2.747
chem comp atom.pdb atom id: CGD
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CHA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CHA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.904
chem comp atom.model cartn y: 31.066
chem comp atom.model cartn z: 5.050
chem comp atom.pdb atom id: CHA
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CHB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CHB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.782
chem comp atom.model cartn y: 28.006
chem comp atom.model cartn z: 8.099
chem comp atom.pdb atom id: CHB
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CHC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CHC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.251
chem comp atom.model cartn y: 24.817
chem comp atom.model cartn z: 4.509
chem comp atom.pdb atom id: CHC
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CHD,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CHD
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.381
chem comp atom.model cartn y: 27.908
chem comp atom.model cartn z: 1.499
chem comp atom.pdb atom id: CHD
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CMA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CMA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.477
chem comp atom.model cartn y: 30.428
chem comp atom.model cartn z: 9.835
chem comp atom.pdb atom id: CMA
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CMB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CMB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.364
chem comp atom.model cartn y: 25.564
chem comp atom.model cartn z: 9.367
chem comp atom.pdb atom id: CMB
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CMC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CMC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.686
chem comp atom.model cartn y: 23.193
chem comp atom.model cartn z: 1.908
chem comp atom.pdb atom id: CMC
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CMD,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: CMD
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.872
chem comp atom.model cartn y: 30.306
chem comp atom.model cartn z: 0.198
chem comp atom.pdb atom id: CMD
chem comp atom.stereo config: N
chem comp atom.type symbol: C

FE,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: FE
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.515
chem comp atom.model cartn y: 27.975
chem comp atom.model cartn z: 4.750
chem comp atom.pdb atom id: FE
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

H2A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: H2A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.481
chem comp atom.model cartn y: 33.981
chem comp atom.model cartn z: 4.921
chem comp atom.pdb atom id: H2A
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: H2D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 20.703
chem comp atom.model cartn y: 34.517
chem comp atom.model cartn z: 3.758
chem comp atom.pdb atom id: H2D
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HAA1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HAA1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.398
chem comp atom.model cartn y: 32.648
chem comp atom.model cartn z: 8.612
chem comp atom.pdb atom id: HAA1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HAA2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HAA2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.346
chem comp atom.model cartn y: 32.968
chem comp atom.model cartn z: 6.944
chem comp atom.pdb atom id: HAA2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HAB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HAB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.504
chem comp atom.model cartn y: 22.907
chem comp atom.model cartn z: 6.198
chem comp atom.pdb atom id: HAB
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HAC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HAC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.803
chem comp atom.model cartn y: 26.065
chem comp atom.model cartn z: -0.595
chem comp atom.pdb atom id: HAC
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HAD1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HAD1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 17.243
chem comp atom.model cartn y: 32.871
chem comp atom.model cartn z: 1.623
chem comp atom.pdb atom id: HAD1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HAD2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HAD2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.994
chem comp atom.model cartn y: 33.111
chem comp atom.model cartn z: 3.277
chem comp atom.pdb atom id: HAD2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBA1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBA1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.898
chem comp atom.model cartn y: 33.258
chem comp atom.model cartn z: 8.903
chem comp atom.pdb atom id: HBA1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBA2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBA2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.776
chem comp atom.model cartn y: 34.554
chem comp atom.model cartn z: 8.258
chem comp atom.pdb atom id: HBA2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBB1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBB1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.891
chem comp atom.model cartn y: 23.071
chem comp atom.model cartn z: 8.807
chem comp atom.pdb atom id: HBB1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBB2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBB2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.898
chem comp atom.model cartn y: 21.557
chem comp atom.model cartn z: 8.054
chem comp atom.pdb atom id: HBB2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBC1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBC1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.594
chem comp atom.model cartn y: 23.427
chem comp atom.model cartn z: -0.215
chem comp atom.pdb atom id: HBC1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBC2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBC2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.578
chem comp atom.model cartn y: 24.050
chem comp atom.model cartn z: -1.774
chem comp atom.pdb atom id: HBC2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBD1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBD1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 19.020
chem comp atom.model cartn y: 31.519
chem comp atom.model cartn z: 3.848
chem comp atom.pdb atom id: HBD1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HBD2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HBD2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 19.253
chem comp atom.model cartn y: 31.198
chem comp atom.model cartn z: 2.195
chem comp atom.pdb atom id: HBD2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HHA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HHA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.394
chem comp atom.model cartn y: 32.049
chem comp atom.model cartn z: 5.145
chem comp atom.pdb atom id: HHA
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HHB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HHB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.546
chem comp atom.model cartn y: 28.024
chem comp atom.model cartn z: 9.176
chem comp atom.pdb atom id: HHB
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HHC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HHC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.798
chem comp atom.model cartn y: 23.815
chem comp atom.model cartn z: 4.415
chem comp atom.pdb atom id: HHC
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HHD,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HHD
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.630
chem comp atom.model cartn y: 27.897
chem comp atom.model cartn z: 0.424
chem comp atom.pdb atom id: HHD
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMA1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMA1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.029
chem comp atom.model cartn y: 29.682
chem comp atom.model cartn z: 10.533
chem comp atom.pdb atom id: HMA1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMA2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMA2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.451
chem comp atom.model cartn y: 30.723
chem comp atom.model cartn z: 10.289
chem comp atom.pdb atom id: HMA2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMA3,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMA3
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.854
chem comp atom.model cartn y: 31.347
chem comp atom.model cartn z: 9.931
chem comp atom.pdb atom id: HMA3
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMB1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMB1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.874
chem comp atom.model cartn y: 24.656
chem comp atom.model cartn z: 9.790
chem comp atom.pdb atom id: HMB1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMB2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMB2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.265
chem comp atom.model cartn y: 25.776
chem comp atom.model cartn z: 9.988
chem comp atom.pdb atom id: HMB2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMB3,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMB3
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.705
chem comp atom.model cartn y: 26.434
chem comp atom.model cartn z: 9.595
chem comp atom.pdb atom id: HMB3
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMC1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMC1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.853
chem comp atom.model cartn y: 22.639
chem comp atom.model cartn z: 0.954
chem comp atom.pdb atom id: HMC1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMC2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMC2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.180
chem comp atom.model cartn y: 22.603
chem comp atom.model cartn z: 2.715
chem comp atom.pdb atom id: HMC2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMC3,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMC3
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.603
chem comp atom.model cartn y: 23.091
chem comp atom.model cartn z: 2.155
chem comp atom.pdb atom id: HMC3
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMD1,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMD1
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 17.405
chem comp atom.model cartn y: 31.183
chem comp atom.model cartn z: -0.237
chem comp atom.pdb atom id: HMD1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMD2,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMD2
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 17.530
chem comp atom.model cartn y: 29.422
chem comp atom.model cartn z: 0.030
chem comp atom.pdb atom id: HMD2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HMD3,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: HMD3
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.001
chem comp atom.model cartn y: 30.102
chem comp atom.model cartn z: -0.468
chem comp atom.pdb atom id: HMD3
chem comp atom.stereo config: N
chem comp atom.type symbol: H

NA,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: NA
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.784
chem comp atom.model cartn y: 29.263
chem comp atom.model cartn z: 6.257
chem comp atom.pdb atom id: NA
chem comp atom.stereo config: N
chem comp atom.type symbol: N

NB,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: NB
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.664
chem comp atom.model cartn y: 26.679
chem comp atom.model cartn z: 6.009
chem comp atom.pdb atom id: NB
chem comp atom.stereo config: N
chem comp atom.type symbol: N

NC,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: NC
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.311
chem comp atom.model cartn y: 26.644
chem comp atom.model cartn z: 3.267
chem comp atom.pdb atom id: NC
chem comp atom.stereo config: N
chem comp atom.type symbol: N

ND,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: ND
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.389
chem comp atom.model cartn y: 29.280
chem comp atom.model cartn z: 3.475
chem comp atom.pdb atom id: ND
chem comp atom.stereo config: N
chem comp atom.type symbol: N

O1A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: O1A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.400
chem comp atom.model cartn y: 33.104
chem comp atom.model cartn z: 6.842
chem comp atom.pdb atom id: O1A
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O1D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: O1D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 20.186
chem comp atom.model cartn y: 33.643
chem comp atom.model cartn z: 1.646
chem comp atom.pdb atom id: O1D
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2A,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: O2A
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.050
chem comp atom.model cartn y: 33.975
chem comp atom.model cartn z: 5.683
chem comp atom.pdb atom id: O2A
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2D,HEM,17144
type: chem comp atom
of datablock: info:bmrb/17144
reference to entry: entry
chem comp atom.atom id: O2D
chem comp atom.comp id: HEM
chem comp atom.entry id: 17144
chem comp atom.charge: 0
chem comp atom.model cartn x: 20.149
chem comp atom.model cartn y: 33.749
chem comp atom.model cartn z: 3.830
chem comp atom.pdb atom id: O2D
chem comp atom.stereo config: N
chem comp atom.type symbol: O

HEM,17144,1
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 1
chem comp bond.atom id 1: FE
chem comp bond.atom id 2: NA
chem comp bond.value order: SING

HEM,17144,2
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 2
chem comp bond.atom id 1: FE
chem comp bond.atom id 2: NB
chem comp bond.value order: SING

HEM,17144,3
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 3
chem comp bond.atom id 1: FE
chem comp bond.atom id 2: NC
chem comp bond.value order: SING

HEM,17144,4
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 4
chem comp bond.atom id 1: FE
chem comp bond.atom id 2: ND
chem comp bond.value order: SING

HEM,17144,5
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 5
chem comp bond.atom id 1: CHA
chem comp bond.atom id 2: C1A
chem comp bond.value order: DOUB

HEM,17144,6
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 6
chem comp bond.atom id 1: CHA
chem comp bond.atom id 2: C4D
chem comp bond.value order: SING

HEM,17144,7
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 7
chem comp bond.atom id 1: CHA
chem comp bond.atom id 2: HHA
chem comp bond.value order: SING

HEM,17144,8
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 8
chem comp bond.atom id 1: CHB
chem comp bond.atom id 2: C4A
chem comp bond.value order: DOUB

HEM,17144,9
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 9
chem comp bond.atom id 1: CHB
chem comp bond.atom id 2: C1B
chem comp bond.value order: SING

HEM,17144,10
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 10
chem comp bond.atom id 1: CHB
chem comp bond.atom id 2: HHB
chem comp bond.value order: SING

HEM,17144,11
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 11
chem comp bond.atom id 1: CHC
chem comp bond.atom id 2: C4B
chem comp bond.value order: DOUB

HEM,17144,12
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 12
chem comp bond.atom id 1: CHC
chem comp bond.atom id 2: C1C
chem comp bond.value order: SING

HEM,17144,13
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 13
chem comp bond.atom id 1: CHC
chem comp bond.atom id 2: HHC
chem comp bond.value order: SING

HEM,17144,14
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 14
chem comp bond.atom id 1: CHD
chem comp bond.atom id 2: C4C
chem comp bond.value order: SING

HEM,17144,15
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 15
chem comp bond.atom id 1: CHD
chem comp bond.atom id 2: C1D
chem comp bond.value order: DOUB

HEM,17144,16
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 16
chem comp bond.atom id 1: CHD
chem comp bond.atom id 2: HHD
chem comp bond.value order: SING

HEM,17144,17
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 17
chem comp bond.atom id 1: NA
chem comp bond.atom id 2: C1A
chem comp bond.value order: SING

HEM,17144,18
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 18
chem comp bond.atom id 1: NA
chem comp bond.atom id 2: C4A
chem comp bond.value order: SING

HEM,17144,19
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 19
chem comp bond.atom id 1: C1A
chem comp bond.atom id 2: C2A
chem comp bond.value order: SING

HEM,17144,20
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 20
chem comp bond.atom id 1: C2A
chem comp bond.atom id 2: C3A
chem comp bond.value order: DOUB

HEM,17144,21
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 21
chem comp bond.atom id 1: C2A
chem comp bond.atom id 2: CAA
chem comp bond.value order: SING

HEM,17144,22
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 22
chem comp bond.atom id 1: C3A
chem comp bond.atom id 2: C4A
chem comp bond.value order: SING

HEM,17144,23
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 23
chem comp bond.atom id 1: C3A
chem comp bond.atom id 2: CMA
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HEM,17144,24
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 24
chem comp bond.atom id 1: CMA
chem comp bond.atom id 2: HMA1
chem comp bond.value order: SING

HEM,17144,25
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 25
chem comp bond.atom id 1: CMA
chem comp bond.atom id 2: HMA2
chem comp bond.value order: SING

HEM,17144,26
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 26
chem comp bond.atom id 1: CMA
chem comp bond.atom id 2: HMA3
chem comp bond.value order: SING

HEM,17144,27
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 27
chem comp bond.atom id 1: CAA
chem comp bond.atom id 2: CBA
chem comp bond.value order: SING

HEM,17144,28
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 28
chem comp bond.atom id 1: CAA
chem comp bond.atom id 2: HAA1
chem comp bond.value order: SING

HEM,17144,29
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 29
chem comp bond.atom id 1: CAA
chem comp bond.atom id 2: HAA2
chem comp bond.value order: SING

HEM,17144,30
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 30
chem comp bond.atom id 1: CBA
chem comp bond.atom id 2: CGA
chem comp bond.value order: SING

HEM,17144,31
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 31
chem comp bond.atom id 1: CBA
chem comp bond.atom id 2: HBA1
chem comp bond.value order: SING

HEM,17144,32
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 32
chem comp bond.atom id 1: CBA
chem comp bond.atom id 2: HBA2
chem comp bond.value order: SING

HEM,17144,33
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 33
chem comp bond.atom id 1: CGA
chem comp bond.atom id 2: O1A
chem comp bond.value order: DOUB

HEM,17144,34
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 34
chem comp bond.atom id 1: CGA
chem comp bond.atom id 2: O2A
chem comp bond.value order: SING

HEM,17144,35
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 35
chem comp bond.atom id 1: O2A
chem comp bond.atom id 2: H2A
chem comp bond.value order: SING

HEM,17144,36
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 36
chem comp bond.atom id 1: NB
chem comp bond.atom id 2: C1B
chem comp bond.value order: DOUB

HEM,17144,37
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 37
chem comp bond.atom id 1: NB
chem comp bond.atom id 2: C4B
chem comp bond.value order: SING

HEM,17144,38
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 38
chem comp bond.atom id 1: C1B
chem comp bond.atom id 2: C2B
chem comp bond.value order: SING

HEM,17144,39
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 39
chem comp bond.atom id 1: C2B
chem comp bond.atom id 2: C3B
chem comp bond.value order: DOUB

HEM,17144,40
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 40
chem comp bond.atom id 1: C2B
chem comp bond.atom id 2: CMB
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HEM,17144,41
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 41
chem comp bond.atom id 1: C3B
chem comp bond.atom id 2: C4B
chem comp bond.value order: SING

HEM,17144,42
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 42
chem comp bond.atom id 1: C3B
chem comp bond.atom id 2: CAB
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HEM,17144,43
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 43
chem comp bond.atom id 1: CMB
chem comp bond.atom id 2: HMB1
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HEM,17144,44
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 44
chem comp bond.atom id 1: CMB
chem comp bond.atom id 2: HMB2
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HEM,17144,45
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 45
chem comp bond.atom id 1: CMB
chem comp bond.atom id 2: HMB3
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HEM,17144,46
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 46
chem comp bond.atom id 1: CAB
chem comp bond.atom id 2: CBB
chem comp bond.value order: DOUB

HEM,17144,47
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 47
chem comp bond.atom id 1: CAB
chem comp bond.atom id 2: HAB
chem comp bond.value order: SING

HEM,17144,48
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 48
chem comp bond.atom id 1: CBB
chem comp bond.atom id 2: HBB1
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HEM,17144,49
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 49
chem comp bond.atom id 1: CBB
chem comp bond.atom id 2: HBB2
chem comp bond.value order: SING

HEM,17144,50
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 50
chem comp bond.atom id 1: NC
chem comp bond.atom id 2: C1C
chem comp bond.value order: SING

HEM,17144,51
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 51
chem comp bond.atom id 1: NC
chem comp bond.atom id 2: C4C
chem comp bond.value order: SING

HEM,17144,52
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 52
chem comp bond.atom id 1: C1C
chem comp bond.atom id 2: C2C
chem comp bond.value order: DOUB

HEM,17144,53
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 53
chem comp bond.atom id 1: C2C
chem comp bond.atom id 2: C3C
chem comp bond.value order: SING

HEM,17144,54
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 54
chem comp bond.atom id 1: C2C
chem comp bond.atom id 2: CMC
chem comp bond.value order: SING

HEM,17144,55
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 55
chem comp bond.atom id 1: C3C
chem comp bond.atom id 2: C4C
chem comp bond.value order: DOUB

HEM,17144,56
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 56
chem comp bond.atom id 1: C3C
chem comp bond.atom id 2: CAC
chem comp bond.value order: SING

HEM,17144,57
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 57
chem comp bond.atom id 1: CMC
chem comp bond.atom id 2: HMC1
chem comp bond.value order: SING

HEM,17144,58
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 58
chem comp bond.atom id 1: CMC
chem comp bond.atom id 2: HMC2
chem comp bond.value order: SING

HEM,17144,59
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 59
chem comp bond.atom id 1: CMC
chem comp bond.atom id 2: HMC3
chem comp bond.value order: SING

HEM,17144,60
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 60
chem comp bond.atom id 1: CAC
chem comp bond.atom id 2: CBC
chem comp bond.value order: DOUB

HEM,17144,61
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 61
chem comp bond.atom id 1: CAC
chem comp bond.atom id 2: HAC
chem comp bond.value order: SING

HEM,17144,62
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 62
chem comp bond.atom id 1: CBC
chem comp bond.atom id 2: HBC1
chem comp bond.value order: SING

HEM,17144,63
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 63
chem comp bond.atom id 1: CBC
chem comp bond.atom id 2: HBC2
chem comp bond.value order: SING

HEM,17144,64
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 64
chem comp bond.atom id 1: ND
chem comp bond.atom id 2: C1D
chem comp bond.value order: SING

HEM,17144,65
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 65
chem comp bond.atom id 1: ND
chem comp bond.atom id 2: C4D
chem comp bond.value order: DOUB

HEM,17144,66
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 66
chem comp bond.atom id 1: C1D
chem comp bond.atom id 2: C2D
chem comp bond.value order: SING

HEM,17144,67
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 67
chem comp bond.atom id 1: C2D
chem comp bond.atom id 2: C3D
chem comp bond.value order: DOUB

HEM,17144,68
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 68
chem comp bond.atom id 1: C2D
chem comp bond.atom id 2: CMD
chem comp bond.value order: SING

HEM,17144,69
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 69
chem comp bond.atom id 1: C3D
chem comp bond.atom id 2: C4D
chem comp bond.value order: SING

HEM,17144,70
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 70
chem comp bond.atom id 1: C3D
chem comp bond.atom id 2: CAD
chem comp bond.value order: SING

HEM,17144,71
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 71
chem comp bond.atom id 1: CMD
chem comp bond.atom id 2: HMD1
chem comp bond.value order: SING

HEM,17144,72
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 72
chem comp bond.atom id 1: CMD
chem comp bond.atom id 2: HMD2
chem comp bond.value order: SING

HEM,17144,73
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 73
chem comp bond.atom id 1: CMD
chem comp bond.atom id 2: HMD3
chem comp bond.value order: SING

HEM,17144,74
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 74
chem comp bond.atom id 1: CAD
chem comp bond.atom id 2: CBD
chem comp bond.value order: SING

HEM,17144,75
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 75
chem comp bond.atom id 1: CAD
chem comp bond.atom id 2: HAD1
chem comp bond.value order: SING

HEM,17144,76
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 76
chem comp bond.atom id 1: CAD
chem comp bond.atom id 2: HAD2
chem comp bond.value order: SING

HEM,17144,77
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 77
chem comp bond.atom id 1: CBD
chem comp bond.atom id 2: CGD
chem comp bond.value order: SING

HEM,17144,78
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 78
chem comp bond.atom id 1: CBD
chem comp bond.atom id 2: HBD1
chem comp bond.value order: SING

HEM,17144,79
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 79
chem comp bond.atom id 1: CBD
chem comp bond.atom id 2: HBD2
chem comp bond.value order: SING

HEM,17144,80
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 80
chem comp bond.atom id 1: CGD
chem comp bond.atom id 2: O1D
chem comp bond.value order: DOUB

HEM,17144,81
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 81
chem comp bond.atom id 1: CGD
chem comp bond.atom id 2: O2D
chem comp bond.value order: SING

HEM,17144,82
type: chem comp bond
of datablock: info:bmrb/17144
chem comp bond.comp id: HEM
chem comp bond.entry id: 17144
chem comp bond.id: 82
chem comp bond.atom id 1: O2D
chem comp bond.atom id 2: H2D
chem comp bond.value order: SING

http://bmrbpub.pdbj.org/rdf/bmr17144/chem_comp_descriptor/HEM,Cc1c2n3c(c1C%3DC)C%3DC4C(%3DC(C5%3D%5BN%5D4%5BFe%5D36%5BN%5D7%3DC(C%3DC8N6C(%3DC5)C(%3DC8C)C,17144,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17144
chem comp descriptor.comp id: HEM
chem comp descriptor.descriptor: Cc1c2n3c(c1C=C)C=C4C(=C(C5=[N]4[Fe]36[N]7=C(C=C8N6C(=C5)C(=C8C)CCC(=O)O)C(=C(C7=C2)C=C)C)CCC(=O)O)C
chem comp descriptor.entry id: 17144
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr17144/chem_comp_descriptor/HEM,Cc1c2n3c(c1C%3DC)C%3DC4C(%3DC(C5%3D%5BN%5D4%5BFe%5D36%5BN%5D7%3DC(C%3DC8N6C(%3DC5)C(%3DC8C)C,17144,OECHEM,1.5.0,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/17144
chem comp descriptor.comp id: HEM
chem comp descriptor.descriptor: Cc1c2n3c(c1C=C)C=C4C(=C(C5=[N]4[Fe]36[N]7=C(C=C8N6C(=C5)C(=C8C)CCC(=O)O)C(=C(C7=C2)C=C)C)CCC(=O)O)C
chem comp descriptor.entry id: 17144
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr17144/chem_comp_descriptor/HEM,CC1%3DC(CCC(O)%3DO)C2%3DN3%7C%5BFe%5D45%7CN6%3DC(C%3Dc7n4c(%3DC2)c(CCC(O)%3DO)c7C)C(%3DC,17144,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/17144
chem comp descriptor.comp id: HEM
chem comp descriptor.descriptor: CC1=C(CCC(O)=O)C2=N3|[Fe]45|N6=C(C=c7n4c(=C2)c(CCC(O)=O)c7C)C(=C(C=C)C6=Cc8n5c(C=C13)c(C=C)c8C)C
chem comp descriptor.entry id: 17144
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr17144/chem_comp_descriptor/HEM,CC1%3DC(CCC(O)%3DO)C2%3DN3%7C%5BFe%5D45%7CN6%3DC(C%3Dc7n4c(%3DC2)c(CCC(O)%3DO)c7C)C(%3DC,17144,CACTVS,3.341,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/17144
chem comp descriptor.comp id: HEM
chem comp descriptor.descriptor: CC1=C(CCC(O)=O)C2=N3|[Fe]45|N6=C(C=c7n4c(=C2)c(CCC(O)=O)c7C)C(=C(C=C)C6=Cc8n5c(C=C13)c(C=C)c8C)C
chem comp descriptor.entry id: 17144
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

HEM,,17144,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/17144
chem comp descriptor.comp id: HEM
chem comp descriptor.descriptor: InChI=1/C34H34N4O4.Fe/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;/fC34H32N4O4.Fe/h39,41H;/q-2;m/rC34H32FeN4O4/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(40)41)31-16-32-24(10-12-34(42)43)20(6)28-15-30-22(8-2)18(4)27-14-29(21)36(25)35(37(27)30,38(26)31)39(28)32/h7-8,13-16H,1-2,9-12H2,3-6H3,(H,40,41)(H,42,43)/f/h40,42H
chem comp descriptor.entry id: 17144
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

HEM,KABFMIBPWCXCRK-OSEZOLLWDJ,17144,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/17144
chem comp descriptor.comp id: HEM
chem comp descriptor.descriptor: KABFMIBPWCXCRK-OSEZOLLWDJ
chem comp descriptor.entry id: 17144
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

1,17144,1
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 1
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: 2
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: 171440301

1,17144,2
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,3
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,4
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 4
chem shift completeness char.arom chem shift 13c 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: HIS
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: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 171440301

1,17144,5
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 6
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 171440301

1,17144,6
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 7
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: 171440301

1,17144,7
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,8
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,9
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 10
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: 171440301

1,17144,10
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLN
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: 171440301

1,17144,11
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,12
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLN
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 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: 171440301

1,17144,13
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: CYS
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.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: 171440301

1,17144,14
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 171440301

1,17144,15
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 15
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: 16
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: 171440301

1,17144,16
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 17
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: 171440301

1,17144,17
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 17
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: 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: 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: 171440301

1,17144,18
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: SER
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 171440301

1,17144,19
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 20
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: 171440301

1,17144,20
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 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: 171440301

1,17144,21
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 21
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: 171440301

1,17144,22
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLY
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.sf id: 171440301

1,17144,23
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLN
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: 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: 171440301

1,17144,24
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ASN
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.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: 171440301

1,17144,25
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLY
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.sf id: 171440301

1,17144,26
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 171440301

1,17144,27
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLY
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.sf id: 171440301

1,17144,28
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 28
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: 29
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: 171440301

1,17144,29
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: SER
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 171440301

1,17144,30
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 30
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: 171440301

1,17144,31
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,32
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 32
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: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 171440301

1,17144,33
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: VAL
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.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: 171440301

1,17144,34
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 34
chem shift completeness char.arom chem shift 13c coverage: 0.500
chem shift completeness char.arom chem shift 1h coverage: 0.500
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: 0.714
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: TYR
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.sc chem shift 13c coverage: 0.600
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.636
chem shift completeness char.sf id: 171440301

1,17144,35
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLY
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.sf id: 171440301

1,17144,36
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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: 171440301

1,17144,37
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: LYS
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.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: 171440301

1,17144,38
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,39
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 40
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: 171440301

1,17144,40
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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: 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: 171440301

1,17144,41
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 171440301

1,17144,42
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 42
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: 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: 171440301

1,17144,43
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,44
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 44
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.600
chem shift completeness char.arom chem shift coverage: 0.300
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: 0.667
chem shift completeness char.chem shift coverage: 0.556
chem shift completeness char.comp id: PHE
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: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.714
chem shift completeness char.sc chem shift coverage: 0.462
chem shift completeness char.sf id: 171440301

1,17144,45
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLN
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: 171440301

1,17144,46
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 46
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: 47
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: 171440301

1,17144,47
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: SER
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: 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: 171440301

1,17144,48
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 48
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: 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: 171440301

1,17144,49
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,50
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: LEU
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: 171440301

1,17144,51
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: LYS
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.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: 171440301

1,17144,52
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: LYS
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: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 171440301

1,17144,53
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: SER
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: 171440301

1,17144,54
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 55
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 171440301

1,17144,55
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 56
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: 171440301

1,17144,56
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: VAL
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.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: 171440301

1,17144,57
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 57
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: 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 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: 171440301

1,17144,58
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ASN
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.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: 171440301

1,17144,59
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,60
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: SER
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.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: 171440301

1,17144,61
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 0.667
chem shift completeness char.chem shift coverage: 0.714
chem shift completeness char.comp id: ALA
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.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: 171440301

1,17144,62
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: THR
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: 171440301

1,17144,63
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,64
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ASP
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: 171440301

1,17144,65
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 171440301

1,17144,66
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 66
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: 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: 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: 171440301

1,17144,67
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: LEU
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: 171440301

1,17144,68
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 68
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: 171440301

1,17144,69
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ASN
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: 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: 171440301

1,17144,70
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 70
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: 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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 171440301

1,17144,71
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLN
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 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: 171440301

1,17144,72
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,73
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 73
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: 171440301

1,17144,74
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,75
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 75
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: 75
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: 171440301

1,17144,76
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 76
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 171440301

1,17144,77
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: THR
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: 171440301

1,17144,78
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: LYS
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.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: 171440301

1,17144,79
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 79
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: 171440301

1,17144,80
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 80
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: 80
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: 171440301

1,17144,81
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 81
chem shift completeness char.arom chem shift 13c coverage: 0.500
chem shift completeness char.arom chem shift 1h coverage: 0.500
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: 0.714
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: TYR
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: 0.600
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.636
chem shift completeness char.sf id: 171440301

1,17144,82
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 82
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: 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: 171440301

1,17144,83
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 83
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: 83
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 171440301

1,17144,84
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 84
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: 84
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: 171440301

1,17144,85
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 171440301

1,17144,86
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 86
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: 86
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: 171440301

1,17144,87
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,88
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: THR
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.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: 171440301

1,17144,89
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,90
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ARG
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.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: 171440301

1,17144,91
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: ALA
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.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: 171440301

1,17144,92
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 92
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: 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: 171440301

1,17144,93
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 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: 171440301

1,17144,94
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 94
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: 171440301

1,17144,95
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,96
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
chem shift completeness char.id: 96
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: 96
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: 171440301

1,17144,97
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 97
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: 171440301

1,17144,98
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLN
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.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: 171440301

1,17144,99
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 171440301

1,17144,100
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 171440301

1,17144,101
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: GLY
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.sf id: 171440301

1,17144,102
type: chem shift completeness char
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 17144
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: 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: 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: 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: 171440301

1,17144
type: chem shift completeness list
of datablock: info:bmrb/17144
reference to entry: entry
chem shift completeness list.assigned chem shift list id: 1
chem shift completeness list.entry id: 17144
chem shift completeness list.arom chem shift 13c fraction: 11/41
chem shift completeness list.arom chem shift 15n fraction: 1/1
chem shift completeness list.arom chem shift 1h fraction: 15/42
chem shift completeness list.arom chem shift fraction: 27/84
chem shift completeness list.assigned residue coverage: 1.000
chem shift completeness list.bb chem shift 13c fraction: 295/295
chem shift completeness list.bb chem shift 15n fraction: 94/95
chem shift completeness list.bb chem shift 1h fraction: 207/208
chem shift completeness list.bb chem shift fraction: 596/598
chem shift completeness list.chem shift 13c fraction: 400/431
chem shift completeness list.chem shift 15n fraction: 106/107
chem shift completeness list.chem shift 1h fraction: 534/565
chem shift completeness list.chem shift fraction: 1040/1103
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr17144_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 13c fraction: 56/56
chem shift completeness list.methyl chem shift 1h fraction: 56/56
chem shift completeness list.methyl chem shift fraction: 112/112
chem shift completeness list.output file name: bmr17144_chem_shift_completeness.str
chem shift completeness list.queried date: 2020-07-22Z
chem shift completeness list.sc chem shift 13c fraction: 196/227
chem shift completeness list.sc chem shift 15n fraction: 12/12
chem shift completeness list.sc chem shift 1h fraction: 328/357
chem shift completeness list.sc chem shift fraction: 536/596
chem shift completeness list.sf category: chem_shift_completeness_list
chem shift completeness list.sf framecode: chem_shift_completeness_list_1
chem shift completeness list.sf id: 171440301

1,17144,1
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: 2D 1H-15N HSQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,2
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 2
chem shift experiment.experiment name: 2D 1H-13C HSQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,3
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 3
chem shift experiment.experiment name: 2D 1H-1H NOESY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,4
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 4
chem shift experiment.experiment name: 2D DQF-COSY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,5
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 5
chem shift experiment.experiment name: 3D CBCA(CO)NH
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,6
type: chem shift experiment
of datablock: info:bmrb/17144
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chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 6
chem shift experiment.experiment name: 3D HNCACB
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chem shift experiment.sample state: isotropic

1,17144,7
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 7
chem shift experiment.experiment name: 3D HBHA(CO)NH
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,8
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 8
chem shift experiment.experiment name: 3D HCCH-TOCSY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,9
type: chem shift experiment
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chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 9
chem shift experiment.experiment name: 3D 1H-15N NOESY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,10
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 10
chem shift experiment.experiment name: 3D 1H-13C NOESY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,11
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 11
chem shift experiment.experiment name: 3D HNHA
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,12
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 12
chem shift experiment.experiment name: 3D C(CO)NH
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,13
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 13
chem shift experiment.experiment name: 2D 1H-13C HSQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,14
type: chem shift experiment
of datablock: info:bmrb/17144
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chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 14
chem shift experiment.experiment name: 4D 1H-13C HMQC-NOESY-HMQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,15
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 15
chem shift experiment.experiment name: 2D HBCBCGCDHD-ARO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,16
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 16
chem shift experiment.experiment name: 2D HBCBCGCDCEHE-ARO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,17
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 17
chem shift experiment.experiment name: 3D CBCA(COCA)HA
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,17144,18
type: chem shift experiment
of datablock: info:bmrb/17144
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 17144
chem shift experiment.experiment id: 18
chem shift experiment.experiment name: 3D HNCO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

13,C,1,17144,DSS
type: chem shift ref
of datablock: info:bmrb/17144
chem shift ref.atom isotope number: 13
chem shift ref.atom type: C
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 17144
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 type: indirect

1,H,1,17144,DSS
type: chem shift ref
of datablock: info:bmrb/17144
chem shift ref.atom isotope number: 1
chem shift ref.atom type: H
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 17144
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: 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,1,17144,DSS
type: chem shift ref
of datablock: info:bmrb/17144
chem shift ref.atom isotope number: 15
chem shift ref.atom type: N
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 17144
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 type: indirect

17144,1
type: chem shift reference
of datablock: info:bmrb/17144
reference to entry: entry
chem shift reference.entry id: 17144
chem shift reference.id: 1
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chemical_shift_reference_1

17144,1
type: citation
of datablock: info:bmrb/17144
reference to entry: entry
citation.entry id: 17144
citation.id: 1
citation.class: entry citation
citation.doi: 10.1007/s12104-010-9274-1
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: 5
citation.page first: 89
citation.page last: 92
citation.pubmed id: 21197590
citation.sf category: citations
citation.sf framecode: entry_citation
citation.status: published
citation.title: 1H, 13C, and 15N backbone, side-chain, and heme chemical shift assignments for oxidized and reduced forms of the monoheme c-type cytochrome ApcA isolated from the acidophilic metal-reducing bacterium Acidiphilium cryptum.
citation.type: journal
citation.year: 2011

info:doi/10.1007/s12104-010-9274-1

doi:10.1007/s12104-010-9274-1

urn:ISSN:1874-2718

issn:1874-2718

info:pmid/21197590

pubmed:21197590

1,17144,1
type: citation author
of datablock: info:bmrb/17144
citation author.citation id: 1
citation author.entry id: 17144
citation author.ordinal: 1
citation author.family name: Cort
citation author.given name: John
citation author.middle initials: R.
citation author.pdbx name: Cort, J.R.

1,17144,2
type: citation author
of datablock: info:bmrb/17144
citation author.citation id: 1
citation author.entry id: 17144
citation author.ordinal: 2
citation author.family name: Swenson
citation author.given name: Michael
citation author.middle initials: W.
citation author.pdbx name: Swenson, M.W.

1,17144,3
type: citation author
of datablock: info:bmrb/17144
citation author.citation id: 1
citation author.entry id: 17144
citation author.ordinal: 3
citation author.family name: Magnuson
citation author.given name: Timothy
citation author.middle initials: S.
citation author.pdbx name: Magnuson, T.S.

1,17144,c-type
type: citation keyword
of datablock: info:bmrb/17144
citation keyword.citation id: 1
citation keyword.entry id: 17144
citation keyword.keyword: c-type

1,17144,cytochrome
type: citation keyword
of datablock: info:bmrb/17144
citation keyword.citation id: 1
citation keyword.entry id: 17144
citation keyword.keyword: cytochrome

1,17144,heme
type: citation keyword
of datablock: info:bmrb/17144
citation keyword.citation id: 1
citation keyword.entry id: 17144
citation keyword.keyword: heme

1,17144,paramagnetic
type: citation keyword
of datablock: info:bmrb/17144
citation keyword.citation id: 1
citation keyword.entry id: 17144
citation keyword.keyword: paramagnetic

17144,assigned chemical shifts
type: data set
of datablock: info:bmrb/17144
reference to entry: entry
data set.entry id: 17144
data set.type: assigned_chemical_shifts
data set.count: 1

17144,13C chemical shifts
type: datum
of datablock: info:bmrb/17144
reference to entry: entry
datum.entry id: 17144
datum.type: 13C chemical shifts
datum.count: 419

17144,15N chemical shifts
type: datum
of datablock: info:bmrb/17144
reference to entry: entry
datum.entry id: 17144
datum.type: 15N chemical shifts
datum.count: 108

17144,1H chemical shifts
type: datum
of datablock: info:bmrb/17144
reference to entry: entry
datum.entry id: 17144
datum.type: 1H chemical shifts
datum.count: 663

17144,1
type: entity
of datablock: info:bmrb/17144
reference to entry: entry
entity.entry id: 17144
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.db query revised last date: 2015-11-24Z
entity.details: Cysteines are in thioether bonds to the heme
entity.formula weight: 10407.78
entity.name: ApcA
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 102
entity.paramagnetic: yes
entity.parent entity id: 0
entity.polymer author seq details: An N-terminal 21 amino acid signal sequence is not present and presumably was cleaved by the host organism.
entity.polymer seq one letter code: ANVAHGKALFQAQCAACHSVSPGQNGIGPSLAGVYGAKAAATPGFQFSPALKKSGIVWNASTLDKFLANPQADVPGTKMPYMGMANATDRADVVAYLQTLGK
entity.polymer seq one letter code can: ANVAHGKALFQAQCAACHSVSPGQNGIGPSLAGVYGAKAAATPGFQFSPALKKSGIVWNASTLDKFLANPQADVPGTKMPYMGMANATDRADVVAYLQTLGK
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: ApcA
entity.thiol state: all other bound
entity.type: polymer

17144,2
type: entity
of datablock: info:bmrb/17144
reference to entry: entry
entity.entry id: 17144
entity.id: 2
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 616.487
entity.name: HEM
entity.nonpolymer comp id: HEM
entity.nonpolymer comp label: chem_comp_HEM
entity.nstd chirality: no
entity.nstd linkage: no
entity.parent entity id: 2
entity.polymer seq one letter code can: (HEM)
entity.sf category: entity
entity.sf framecode: HEM
entity.type: non-polymer

1,17144,1
type: entity assembly
of datablock: info:bmrb/17144
entity assembly.assembly id: 1
entity assembly.entry id: 17144
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: ApcA
entity assembly.entity id: 1
entity assembly.entity label: ApcA
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,17144,2
type: entity assembly
of datablock: info:bmrb/17144
entity assembly.assembly id: 1
entity assembly.entry id: 17144
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: heme
entity assembly.entity id: 2
entity assembly.entity label: HEM
entity assembly.experimental data reported: yes
entity assembly.physical state: native

electron transport,1,17144
type: entity biological function
of datablock: info:bmrb/17144
entity biological function.biological function: electron transport
entity biological function.entity id: 1
entity biological function.entry id: 17144

1,17144,1
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 1
entity comp index.comp id: ALA

1,17144,2
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 2
entity comp index.comp id: ASN

1,17144,3
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 3
entity comp index.comp id: VAL

1,17144,4
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 4
entity comp index.comp id: ALA

1,17144,5
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 5
entity comp index.comp id: HIS

1,17144,6
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 6
entity comp index.comp id: GLY

1,17144,7
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 7
entity comp index.comp id: LYS

1,17144,8
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 8
entity comp index.comp id: ALA

1,17144,9
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 9
entity comp index.comp id: LEU

1,17144,10
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 10
entity comp index.comp id: PHE

1,17144,11
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 11
entity comp index.comp id: GLN

1,17144,12
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 12
entity comp index.comp id: ALA

1,17144,13
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entity comp index.entry id: 17144
entity comp index.id: 13
entity comp index.comp id: GLN

1,17144,14
type: entity comp index
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entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 14
entity comp index.comp id: CYS

1,17144,15
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 15
entity comp index.comp id: ALA

1,17144,16
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entity comp index.entry id: 17144
entity comp index.id: 16
entity comp index.comp id: ALA

1,17144,17
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 17
entity comp index.comp id: CYS

1,17144,18
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 18
entity comp index.comp id: HIS

1,17144,19
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 19
entity comp index.comp id: SER

1,17144,20
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 20
entity comp index.comp id: VAL

1,17144,21
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entity comp index.entry id: 17144
entity comp index.id: 21
entity comp index.comp id: SER

1,17144,22
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 22
entity comp index.comp id: PRO

1,17144,23
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entity comp index.id: 23
entity comp index.comp id: GLY

1,17144,24
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 24
entity comp index.comp id: GLN

1,17144,25
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 25
entity comp index.comp id: ASN

1,17144,26
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entity comp index.entry id: 17144
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entity comp index.comp id: GLY

1,17144,27
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entity comp index.entry id: 17144
entity comp index.id: 27
entity comp index.comp id: ILE

1,17144,28
type: entity comp index
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entity comp index.comp id: GLY

1,17144,29
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1,17144,30
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1,17144,31
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entity comp index.comp id: LEU

1,17144,32
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entity comp index.comp id: ALA

1,17144,33
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entity comp index.comp id: GLY

1,17144,34
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entity comp index.comp id: VAL

1,17144,35
type: entity comp index
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entity comp index.entry id: 17144
entity comp index.id: 35
entity comp index.comp id: TYR

1,17144,36
type: entity comp index
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entity comp index.entry id: 17144
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entity comp index.comp id: GLY

1,17144,37
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 37
entity comp index.comp id: ALA

1,17144,38
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: LYS

1,17144,39
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 39
entity comp index.comp id: ALA

1,17144,40
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 40
entity comp index.comp id: ALA

1,17144,41
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: ALA

1,17144,42
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 42
entity comp index.comp id: THR

1,17144,43
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 43
entity comp index.comp id: PRO

1,17144,44
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
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entity comp index.comp id: GLY

1,17144,45
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 45
entity comp index.comp id: PHE

1,17144,46
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
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entity comp index.comp id: GLN

1,17144,47
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: PHE

1,17144,48
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: SER

1,17144,49
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: PRO

1,17144,50
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
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entity comp index.comp id: ALA

1,17144,51
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: LEU

1,17144,52
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: LYS

1,17144,53
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: LYS

1,17144,54
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: SER

1,17144,55
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: GLY

1,17144,56
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: ILE

1,17144,57
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: VAL

1,17144,58
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: TRP

1,17144,59
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: ASN

1,17144,60
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: ALA

1,17144,61
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 61
entity comp index.comp id: SER

1,17144,62
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: THR

1,17144,63
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
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entity comp index.comp id: LEU

1,17144,64
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 64
entity comp index.comp id: ASP

1,17144,65
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: LYS

1,17144,66
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
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entity comp index.comp id: PHE

1,17144,67
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
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entity comp index.comp id: LEU

1,17144,68
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 68
entity comp index.comp id: ALA

1,17144,69
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 69
entity comp index.comp id: ASN

1,17144,70
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 70
entity comp index.comp id: PRO

1,17144,71
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 71
entity comp index.comp id: GLN

1,17144,72
type: entity comp index
of datablock: info:bmrb/17144
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entity comp index.entry id: 17144
entity comp index.id: 72
entity comp index.comp id: ALA

1,17144,73
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 73
entity comp index.comp id: ASP

1,17144,74
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 74
entity comp index.comp id: VAL

1,17144,75
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 75
entity comp index.comp id: PRO

1,17144,76
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 76
entity comp index.comp id: GLY

1,17144,77
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 77
entity comp index.comp id: THR

1,17144,78
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 78
entity comp index.comp id: LYS

1,17144,79
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 79
entity comp index.comp id: MET

1,17144,80
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 80
entity comp index.comp id: PRO

1,17144,81
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 81
entity comp index.comp id: TYR

1,17144,82
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 82
entity comp index.comp id: MET

1,17144,83
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 83
entity comp index.comp id: GLY

1,17144,84
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 84
entity comp index.comp id: MET

1,17144,85
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 85
entity comp index.comp id: ALA

1,17144,86
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 86
entity comp index.comp id: ASN

1,17144,87
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 87
entity comp index.comp id: ALA

1,17144,88
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 88
entity comp index.comp id: THR

1,17144,89
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 89
entity comp index.comp id: ASP

1,17144,90
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 90
entity comp index.comp id: ARG

1,17144,91
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 91
entity comp index.comp id: ALA

1,17144,92
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 92
entity comp index.comp id: ASP

1,17144,93
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 93
entity comp index.comp id: VAL

1,17144,94
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 94
entity comp index.comp id: VAL

1,17144,95
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 95
entity comp index.comp id: ALA

1,17144,96
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 96
entity comp index.comp id: TYR

1,17144,97
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 97
entity comp index.comp id: LEU

1,17144,98
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 98
entity comp index.comp id: GLN

1,17144,99
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 99
entity comp index.comp id: THR

1,17144,100
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 100
entity comp index.comp id: LEU

1,17144,101
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 101
entity comp index.comp id: GLY

1,17144,102
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 1
entity comp index.entry id: 17144
entity comp index.id: 102
entity comp index.comp id: LYS

2,17144,103
type: entity comp index
of datablock: info:bmrb/17144
entity comp index.entity id: 2
entity comp index.entry id: 17144
entity comp index.id: 103
entity comp index.comp id: HEM

YP 001235217.1,REF,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: YP_001235217.1
entity db link.database code: REF
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: yes
entity db link.entry mol name: Acry_2099
entity db link.ordinal: 1

info:refseq/YP_001235217.1

refseq:YP_001235217.1

A5G0B6,SP,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: A5G0B6
entity db link.database code: SP
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: yes
entity db link.ordinal: 2

info:uniprot/A5G0B6

uniprot:A5G0B6

17146,BMRB,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: 17146
entity db link.database code: BMRB
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: ApcA
entity db link.ordinal: 3
entity db link.seq homology expectation val: 1.63E-66
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: 102

info:bmrb/17146

BAJ81692,DBJ,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: BAJ81692
entity db link.database code: DBJ
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: cytochrome c [Acidiphilium multivorum AIU301]
entity db link.ordinal: 4
entity db link.seq homology expectation val: 6.79E-67
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: 123

info:ddbj-embl-genbank/BAJ81692

ncbiprotein:BAJ81692

GAN75771,DBJ,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: GAN75771
entity db link.database code: DBJ
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: cytochrome c [Acidiphilium multivorum AIU301]
entity db link.ordinal: 5
entity db link.seq homology expectation val: 6.79E-67
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: 123

info:ddbj-embl-genbank/GAN75771

ncbiprotein:GAN75771

ABQ31298,GB,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: ABQ31298
entity db link.database code: GB
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: cytochrome c, class I [Acidiphilium cryptum JF-5]
entity db link.ordinal: 6
entity db link.seq homology expectation val: 6.79E-67
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: 123

info:ddbj-embl-genbank/ABQ31298

ncbiprotein:ABQ31298

EGO93894,GB,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: EGO93894
entity db link.database code: GB
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: Cytochrome c, class I [Acidiphilium sp. PM]
entity db link.ordinal: 7
entity db link.seq homology expectation val: 6.79E-67
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: 123

info:ddbj-embl-genbank/EGO93894

ncbiprotein:EGO93894

KDM67854,GB,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: KDM67854
entity db link.database code: GB
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: cytochrome c2 [Acidiphilium sp. JA12-A1]
entity db link.ordinal: 8
entity db link.seq homology expectation val: 6.79E-67
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: 123

info:ddbj-embl-genbank/KDM67854

ncbiprotein:KDM67854

WP 007424422,REF,1,17144
type: entity db link
of datablock: info:bmrb/17144
entity db link.accession code: WP_007424422
entity db link.database code: REF
entity db link.entity id: 1
entity db link.entry id: 17144
entity db link.author supplied: no
entity db link.entry mol name: MULTISPECIES: cytochrome C [Acidiphilium]
entity db link.ordinal: 9
entity db link.seq homology expectation val: 6.79E-67
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: 123

info:refseq/WP_007424422

refseq:WP_007424422

1,17144,1
type: entity deleted atom
of datablock: info:bmrb/17144
entity deleted atom.assembly id: 1
entity deleted atom.entry id: 17144
entity deleted atom.id: 1
entity deleted atom.atom id: HG
entity deleted atom.auth atom id: HG
entity deleted atom.auth comp id: CYS
entity deleted atom.auth seq id: 14
entity deleted atom.comp id: CYS
entity deleted atom.comp index id: 14
entity deleted atom.entity assembly id: 1
entity deleted atom.entity id: 1
entity deleted atom.seq id: 14
entity deleted atom.sf id: 62143

1,17144,2
type: entity deleted atom
of datablock: info:bmrb/17144
entity deleted atom.assembly id: 1
entity deleted atom.entry id: 17144
entity deleted atom.id: 2
entity deleted atom.atom id: HG
entity deleted atom.auth atom id: HG
entity deleted atom.auth comp id: CYS
entity deleted atom.auth seq id: 17
entity deleted atom.comp id: CYS
entity deleted atom.comp index id: 17
entity deleted atom.entity assembly id: 1
entity deleted atom.entity id: 1
entity deleted atom.seq id: 17
entity deleted atom.sf id: 62143

1,17144,1
type: entity experimental src
of datablock: info:bmrb/17144
entity experimental src.entity experimental src list id: 1
entity experimental src.entry id: 17144
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: ApcA
entity experimental src.host org genus: Acidiphilium
entity experimental src.host org name common: not available
entity experimental src.host org ncbi taxonomy id: 524
entity experimental src.host org scientific name: Acidiphilium cryptum
entity experimental src.host org species: cryptum
entity experimental src.host org strain: JF-5
entity experimental src.production method: purified from the natural source

info:taxonomy/524

taxonomy:524

17144,1
type: entity experimental src list
of datablock: info:bmrb/17144
reference to entry: entry
entity experimental src list.entry id: 17144
entity experimental src list.id: 1
entity experimental src list.sf category: experimental_source
entity experimental src list.sf framecode: experimental_source

1,17144,1
type: entity natural src
of datablock: info:bmrb/17144
reference to entry: entry
entity natural src.entity natural src list id: 1
entity natural src.entry id: 17144
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: ApcA
entity natural src.gene mnemonic: Acry_2099
entity natural src.genus: Acidiphilium
entity natural src.kingdom: Not applicable
entity natural src.ncbi taxonomy id: 524
entity natural src.organism name common: a-proteobacteria
entity natural src.organism name scientific: Acidiphilium cryptum
entity natural src.species: cryptum
entity natural src.strain: JF-5
entity natural src.superkingdom: Bacteria
entity natural src.type: organism

17144,1
type: entity natural src list
of datablock: info:bmrb/17144
reference to entry: entry
entity natural src list.entry id: 17144
entity natural src list.id: 1
entity natural src list.sf category: natural_source
entity natural src list.sf framecode: natural_source

1,17144,1
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 1
entity poly seq.comp index id: 1
entity poly seq.mon id: ALA

1,17144,2
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 2
entity poly seq.comp index id: 2
entity poly seq.mon id: ASN

1,17144,3
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 3
entity poly seq.comp index id: 3
entity poly seq.mon id: VAL

1,17144,4
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 4
entity poly seq.comp index id: 4
entity poly seq.mon id: ALA

1,17144,5
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 5
entity poly seq.comp index id: 5
entity poly seq.mon id: HIS

1,17144,6
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 6
entity poly seq.comp index id: 6
entity poly seq.mon id: GLY

1,17144,7
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 7
entity poly seq.comp index id: 7
entity poly seq.mon id: LYS

1,17144,8
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
entity poly seq.entry id: 17144
entity poly seq.num: 8
entity poly seq.comp index id: 8
entity poly seq.mon id: ALA

1,17144,9
type: entity poly seq
of datablock: info:bmrb/17144
entity poly seq.entity id: 1
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http://bmrbpub.pdbj.org/rdf/bmr17144/entry/17144
type: entry
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entry.id: 17144
entry.accession date: 2010-08-23Z
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2011-03-23Z
entry.nmr star version: 3.1.1.61
entry.original nmr star version: 3.0.9.13
entry.original release date: 2010-10-03Z
entry.origination: author
entry.sf category: entry_information
entry.sf framecode: entry_information
entry.submission date: 2010-08-23Z
entry.title: 1H, 13C, and 15N backbone, side-chain, and heme chemical shift assignments for the oxidized form of the monoheme c-type cytochrome ApcA isolated from the acidophilic metal-reducing bacterium Acidiphilium cryptum
entry.type: macromolecule
entry.version type: original

17144,1
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entry author.ordinal: 1
entry author.family name: Cort
entry author.given name: John
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entry author.family name: Magnuson
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17144,1,1
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17144,1,2
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17144,1,3
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17144,1,4
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17144,1,5
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17144,1,6
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17144,1,7
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17144,1,8
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17144,1,9
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17144,1,10
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17144,1,11
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17144,1,12
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17144,1,13
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17144,1,14
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experiment.name: 4D 1H-13C HMQC-NOESY-HMQC
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17144,1,15
type: experiment
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experiment.name: 2D HBCBCGCDHD-ARO
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17144,1,16
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17144,1,17
type: experiment
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experiment.name: 3D CBCA(COCA)HA
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17144,1,18
type: experiment
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experiment.mass spectrometer id: 0
experiment.name: 3D HNCO
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experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

17144,1
type: experiment list
of datablock: info:bmrb/17144
reference to entry: entry
experiment list.entry id: 17144
experiment list.id: 1
experiment list.sf category: experiment_list
experiment list.sf framecode: experiment_list

17144,1
type: nmr spectrometer
of datablock: info:bmrb/17144
reference to entry: entry
nmr spectrometer.entry id: 17144
nmr spectrometer.id: 1
nmr spectrometer.field strength: 750
nmr spectrometer.manufacturer: Varian
nmr spectrometer.model: INOVA
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: spectrometer_1

17144,2
type: nmr spectrometer
of datablock: info:bmrb/17144
reference to entry: entry
nmr spectrometer.entry id: 17144
nmr spectrometer.id: 2
nmr spectrometer.field strength: 600
nmr spectrometer.manufacturer: Varian
nmr spectrometer.model: INOVA
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: spectrometer_2

17144,3
type: nmr spectrometer
of datablock: info:bmrb/17144
reference to entry: entry
nmr spectrometer.entry id: 17144
nmr spectrometer.id: 3
nmr spectrometer.field strength: 500
nmr spectrometer.manufacturer: Varian
nmr spectrometer.model: UnityPlus
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: spectrometer_3

17144,1
type: nmr spectrometer list
of datablock: info:bmrb/17144
reference to entry: entry
nmr spectrometer list.entry id: 17144
nmr spectrometer list.id: 1
nmr spectrometer list.sf category: NMR_spectrometer_list
nmr spectrometer list.sf framecode: NMR_spectrometer_list

17144,1,spectrometer 1,1
type: nmr spectrometer view
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nmr spectrometer view.id: 1
nmr spectrometer view.name: spectrometer_1
nmr spectrometer view.nmr spectrometer list id: 1
nmr spectrometer view.citation id: 0
nmr spectrometer view.field strength: 750
nmr spectrometer view.manufacturer: Varian
nmr spectrometer view.model: INOVA

17144,2,spectrometer 2,1
type: nmr spectrometer view
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nmr spectrometer view.entry id: 17144
nmr spectrometer view.id: 2
nmr spectrometer view.name: spectrometer_2
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: INOVA

17144,3,spectrometer 3,1
type: nmr spectrometer view
of datablock: info:bmrb/17144
nmr spectrometer view.entry id: 17144
nmr spectrometer view.id: 3
nmr spectrometer view.name: spectrometer_3
nmr spectrometer view.nmr spectrometer list id: 1
nmr spectrometer view.citation id: 0
nmr spectrometer view.field strength: 500
nmr spectrometer view.manufacturer: Varian
nmr spectrometer view.model: UnityPlus

17146,BMRB,17144
type: related entries
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reference to entry: entry
related entries.database accession code: 17146
related entries.database name: BMRB
related entries.entry id: 17144
related entries.relationship: reduced forms of ApcA

17144,3
type: release
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reference to entry: entry
release.entry id: 17144
release.release number: 3
release.author: BMRB
release.date: 2011-03-23Z
release.detail: update entry citation
release.submission date: 2010-08-23Z
release.type: update

17144,2
type: release
of datablock: info:bmrb/17144
reference to entry: entry
release.entry id: 17144
release.release number: 2
release.author: BMRB
release.date: 2011-01-17Z
release.detail: update entry citation
release.submission date: 2010-08-23Z
release.type: update

17144,1
type: release
of datablock: info:bmrb/17144
reference to entry: entry
release.entry id: 17144
release.release number: 1
release.author: author
release.date: 2010-10-03Z
release.detail: original release
release.submission date: 2010-08-23Z
release.type: original

17144,1
type: sample
of datablock: info:bmrb/17144
reference to entry: entry
sample.entry id: 17144
sample.id: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: sample_1
sample.solvent system: 93% H2O/7% D2O
sample.type: solution

17144,2
type: sample
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reference to entry: entry
sample.entry id: 17144
sample.id: 2
sample.crystal grow method cit id: 0
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sample.sf category: sample
sample.sf framecode: sample_2
sample.solvent system: 93% H2O/7% D2O
sample.type: solution

17144,3
type: sample
of datablock: info:bmrb/17144
reference to entry: entry
sample.entry id: 17144
sample.id: 3
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: sample_3
sample.solvent system: 100% D2O
sample.type: solution

17144,4
type: sample
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reference to entry: entry
sample.entry id: 17144
sample.id: 4
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
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sample.sf framecode: sample_4
sample.solvent system: 100% D2O
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17144,1,1
type: sample component
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sample component.entry id: 17144
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 0.5
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: ApcA
sample component.isotopic labeling: [U-100% 13C; U-100% 15N]
sample component.mol common name: ApcA

17144,2,1
type: sample component
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sample component.entry id: 17144
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 25
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium acetate

17144,3,1
type: sample component
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sample component.concentration val: 100
sample component.concentration val units: mM
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sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

17144,4,2
type: sample component
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sample component.entry id: 17144
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sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 0.5
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: ApcA
sample component.isotopic labeling: natural abundance
sample component.mol common name: ApcA

17144,5,2
type: sample component
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sample component.entry id: 17144
sample component.id: 5
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 25
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium acetate

17144,6,2
type: sample component
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sample component.entry id: 17144
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sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 100
sample component.concentration val units: mM
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sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

17144,7,3
type: sample component
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sample component.entry id: 17144
sample component.id: 7
sample component.sample id: 3
sample component.assembly id: 1
sample component.concentration val: 0.5
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: ApcA
sample component.isotopic labeling: [U-100% 13C; U-100% 15N]
sample component.mol common name: ApcA

17144,8,3
type: sample component
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sample component.entry id: 17144
sample component.id: 8
sample component.sample id: 3
sample component.assembly id: 1
sample component.concentration val: 25
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium acetate

17144,9,3
type: sample component
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sample component.id: 9
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sample component.concentration val: 100
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sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

17144,10,4
type: sample component
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sample component.entry id: 17144
sample component.id: 10
sample component.sample id: 4
sample component.assembly id: 1
sample component.concentration val: 0.5
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: ApcA
sample component.isotopic labeling: [7%-biosynthetically directed 13C; 50%-U-15N]
sample component.mol common name: ApcA

17144,11,4
type: sample component
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sample component.entry id: 17144
sample component.id: 11
sample component.sample id: 4
sample component.assembly id: 1
sample component.concentration val: 25
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium acetate

17144,12,4
type: sample component
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sample component.id: 12
sample component.sample id: 4
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sample component.concentration val: 100
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sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

17144,1
type: sample condition list
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sample condition list.entry id: 17144
sample condition list.id: 1
sample condition list.sf category: sample_conditions
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17144,1,ionic strength
type: sample condition variable
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sample condition variable.entry id: 17144
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 125
sample condition variable.val units: mM

17144,1,pH
type: sample condition variable
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sample condition variable.entry id: 17144
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 5.0
sample condition variable.val units: pH

17144,1,pressure
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sample condition variable.entry id: 17144
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
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sample condition variable.val units: atm

17144,1,temperature
type: sample condition variable
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sample condition variable.entry id: 17144
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 293
sample condition variable.val units: K

17144,1
type: software
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software.entry id: 17144
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software.name: FELIX
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17144,2
type: software
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software.entry id: 17144
software.id: 2
software.name: SPARKY
software.sf category: software
software.sf framecode: SPARKY

17144,2,chemical shift assignment
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task.entry id: 17144
task.software id: 2
task.task: chemical shift assignment

17144,1,processing
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task.software id: 1
task.task: processing

17144,Goddard,2
type: vendor
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vendor.entry id: 17144
vendor.name: Goddard
vendor.software id: 2

17144,Accelrys Software Inc.,1
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vendor.entry id: 17144
vendor.name: Accelrys Software Inc.
vendor.software id: 1