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type: datablock
references: doi:10.13018/BMR50773
alternative label: bmr50773
title: Backbone 1H, 15N assignment of 15N-labeled oncogenic mutant human KRas4B-G12V(1-169) bound to GTP at physiological pH
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 25
atom chem shift.comp id: LEU
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 25
atom chem shift.val: 7.629
atom chem shift.val err: 0.020

1,50773,34
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: LEU
atom chem shift.auth seq id: 25
atom chem shift.comp id: LEU
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 25
atom chem shift.val: 120.706
atom chem shift.val err: 0.3

1,50773,35
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: ILE
atom chem shift.auth seq id: 26
atom chem shift.comp id: ILE
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 8.154
atom chem shift.val err: 0.020

1,50773,36
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 36
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: 26
atom chem shift.comp id: ILE
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 113.999
atom chem shift.val err: 0.3

1,50773,37
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 37
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: 27
atom chem shift.comp id: GLN
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 8.992
atom chem shift.val err: 0.020

1,50773,38
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 38
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: 27
atom chem shift.comp id: GLN
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 116.363
atom chem shift.val err: 0.3

1,50773,39
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 39
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 28
atom chem shift.comp id: ASN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 8.060
atom chem shift.val err: 0.020

1,50773,40
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 40
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 28
atom chem shift.comp id: ASN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 116.824
atom chem shift.val err: 0.3

1,50773,41
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 41
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: 31
atom chem shift.comp id: VAL
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 7.810
atom chem shift.val err: 0.020

1,50773,42
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 42
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: 31
atom chem shift.comp id: VAL
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: 128.634
atom chem shift.val err: 0.3

1,50773,43
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 43
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: 34
atom chem shift.comp id: TYR
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: 8.887
atom chem shift.val err: 0.020

1,50773,44
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 44
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: 34
atom chem shift.comp id: TYR
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: 126.905
atom chem shift.val err: 0.3

1,50773,45
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 45
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: 37
atom chem shift.comp id: THR
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: 9.489
atom chem shift.val err: 0.020

1,50773,46
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 46
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 37
atom chem shift.comp id: THR
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: 112.926
atom chem shift.val err: 0.3

1,50773,47
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 47
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 41
atom chem shift.comp id: SER
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 8.199
atom chem shift.val err: 0.020

1,50773,48
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 48
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: 41
atom chem shift.comp id: SER
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 114.340
atom chem shift.val err: 0.3

1,50773,49
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 49
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: 42
atom chem shift.comp id: TYR
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 9.089
atom chem shift.val err: 0.020

1,50773,50
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 50
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: 42
atom chem shift.comp id: TYR
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 121.436
atom chem shift.val err: 0.3

1,50773,51
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 51
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 43
atom chem shift.comp id: ARG
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 8.617
atom chem shift.val err: 0.020

1,50773,52
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 52
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: 43
atom chem shift.comp id: ARG
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 120.583
atom chem shift.val err: 0.3

1,50773,53
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 53
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 44
atom chem shift.comp id: LYS
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: 8.718
atom chem shift.val err: 0.020

1,50773,54
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 54
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 44
atom chem shift.comp id: LYS
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: 122.808
atom chem shift.val err: 0.3

1,50773,55
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 55
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 45
atom chem shift.comp id: GLN
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: 8.921
atom chem shift.val err: 0.020

1,50773,56
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 56
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: 45
atom chem shift.comp id: GLN
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: 129.225
atom chem shift.val err: 0.3

1,50773,57
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 57
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: 47
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 8.175
atom chem shift.val err: 0.020

1,50773,58
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 58
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: 47
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 122.481
atom chem shift.val err: 0.3

1,50773,59
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 59
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 48
atom chem shift.comp id: ILE
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: 8.370
atom chem shift.val err: 0.020

1,50773,60
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 60
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: 48
atom chem shift.comp id: ILE
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: 126.028
atom chem shift.val err: 0.3

1,50773,61
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 61
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: 49
atom chem shift.comp id: ASP
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: 9.574
atom chem shift.val err: 0.020

1,50773,62
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 62
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: 49
atom chem shift.comp id: ASP
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: 130.313
atom chem shift.val err: 0.3

1,50773,63
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 63
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: 50
atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 8.343
atom chem shift.val err: 0.020

1,50773,64
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 64
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: 50
atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 103.423
atom chem shift.val err: 0.3

1,50773,65
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 65
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 7.731
atom chem shift.val err: 0.020

1,50773,66
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 66
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 122.616
atom chem shift.val err: 0.3

1,50773,67
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 67
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: 52
atom chem shift.comp id: THR
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 9.071
atom chem shift.val err: 0.020

1,50773,68
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 68
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 52
atom chem shift.comp id: THR
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 125.654
atom chem shift.val err: 0.3

1,50773,69
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 69
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: 53
atom chem shift.comp id: CYS
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 9.404
atom chem shift.val err: 0.020

1,50773,70
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 70
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: 53
atom chem shift.comp id: CYS
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 125.221
atom chem shift.val err: 0.3

1,50773,71
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 71
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 54
atom chem shift.comp id: LEU
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 8.855
atom chem shift.val err: 0.020

1,50773,72
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 72
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: 54
atom chem shift.comp id: LEU
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 122.848
atom chem shift.val err: 0.3

1,50773,73
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 73
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 55
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 9.174
atom chem shift.val err: 0.020

1,50773,74
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 74
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: 55
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 123.790
atom chem shift.val err: 0.3

1,50773,75
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 75
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: 76
atom chem shift.comp id: THR
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: 7.650
atom chem shift.val err: 0.020

1,50773,76
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 76
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 76
atom chem shift.comp id: THR
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: 108.571
atom chem shift.val err: 0.3

1,50773,77
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 77
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: 77
atom chem shift.comp id: GLY
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: 7.884
atom chem shift.val err: 0.020

1,50773,78
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 78
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: 77
atom chem shift.comp id: GLY
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: 107.987
atom chem shift.val err: 0.3

1,50773,79
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 79
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: 79
atom chem shift.comp id: GLY
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 7.235
atom chem shift.val err: 0.020

1,50773,80
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 80
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: 79
atom chem shift.comp id: GLY
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 79
atom chem shift.val: 101.065
atom chem shift.val err: 0.3

1,50773,81
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 81
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 80
atom chem shift.comp id: PHE
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 8.168
atom chem shift.val err: 0.020

1,50773,82
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 82
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 80
atom chem shift.comp id: PHE
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: 121.077
atom chem shift.val err: 0.3

1,50773,83
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 83
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 81
atom chem shift.comp id: LEU
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: 9.290
atom chem shift.val err: 0.020

1,50773,84
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 84
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: 81
atom chem shift.comp id: LEU
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: 127.951
atom chem shift.val err: 0.3

1,50773,85
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 85
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: 82
atom chem shift.comp id: CYS
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 8.795
atom chem shift.val err: 0.020

1,50773,86
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 86
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: 82
atom chem shift.comp id: CYS
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 124.991
atom chem shift.val err: 0.3

1,50773,87
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 87
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: 83
atom chem shift.comp id: VAL
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 9.099
atom chem shift.val err: 0.020

1,50773,88
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 88
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: 83
atom chem shift.comp id: VAL
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 126.267
atom chem shift.val err: 0.3

1,50773,89
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 89
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 84
atom chem shift.comp id: PHE
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 9.350
atom chem shift.val err: 0.020

1,50773,90
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 90
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 84
atom chem shift.comp id: PHE
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 123.804
atom chem shift.val err: 0.3

1,50773,91
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 91
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: 85
atom chem shift.comp id: ALA
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 8.776
atom chem shift.val err: 0.020

1,50773,92
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 92
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: 85
atom chem shift.comp id: ALA
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 121.491
atom chem shift.val err: 0.3

1,50773,93
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 93
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 86
atom chem shift.comp id: ILE
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 8.563
atom chem shift.val err: 0.020

1,50773,94
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 94
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: 86
atom chem shift.comp id: ILE
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 113.615
atom chem shift.val err: 0.3

1,50773,95
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 95
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 87
atom chem shift.comp id: ASN
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 7.933
atom chem shift.val err: 0.020

1,50773,96
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 96
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 87
atom chem shift.comp id: ASN
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 117.027
atom chem shift.val err: 0.3

1,50773,97
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 97
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 88
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 7.893
atom chem shift.val err: 0.020

1,50773,98
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 98
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 88
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 119.328
atom chem shift.val err: 0.3

1,50773,99
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 99
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 90
atom chem shift.comp id: LYS
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: 8.512
atom chem shift.val err: 0.020

1,50773,100
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 100
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 90
atom chem shift.comp id: LYS
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: 124.110
atom chem shift.val err: 0.3

1,50773,101
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 101
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: 91
atom chem shift.comp id: SER
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: 7.991
atom chem shift.val err: 0.020

1,50773,102
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 102
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: 91
atom chem shift.comp id: SER
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: 114.405
atom chem shift.val err: 0.3

1,50773,103
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 103
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 92
atom chem shift.comp id: PHE
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: 7.471
atom chem shift.val err: 0.020

1,50773,104
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 104
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 92
atom chem shift.comp id: PHE
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: 124.870
atom chem shift.val err: 0.3

1,50773,105
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 105
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 93
atom chem shift.comp id: GLU
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 8.372
atom chem shift.val err: 0.020

1,50773,106
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 106
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 93
atom chem shift.comp id: GLU
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: 121.628
atom chem shift.val err: 0.3

1,50773,107
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 107
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: 94
atom chem shift.comp id: ASP
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: 8.614
atom chem shift.val err: 0.020

1,50773,108
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 108
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: 94
atom chem shift.comp id: ASP
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: 117.287
atom chem shift.val err: 0.3

1,50773,109
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 109
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 7.567
atom chem shift.val err: 0.020

1,50773,110
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 110
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 95
atom chem shift.comp id: ILE
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 120.162
atom chem shift.val err: 0.3

1,50773,111
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 111
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: 97
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 7.168
atom chem shift.val err: 0.020

1,50773,112
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 112
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: 97
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 116.651
atom chem shift.val err: 0.3

1,50773,113
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 113
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: 98
atom chem shift.comp id: TYR
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 7.731
atom chem shift.val err: 0.020

1,50773,114
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 114
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: 98
atom chem shift.comp id: TYR
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: 118.874
atom chem shift.val err: 0.3

1,50773,115
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 115
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 99
atom chem shift.comp id: ARG
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: 8.461
atom chem shift.val err: 0.020

1,50773,116
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 116
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: 99
atom chem shift.comp id: ARG
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: 118.035
atom chem shift.val err: 0.3

1,50773,117
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 117
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 104
atom chem shift.comp id: ARG
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 7.736
atom chem shift.val err: 0.020

1,50773,118
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 118
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: 104
atom chem shift.comp id: ARG
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 104
atom chem shift.val: 118.345
atom chem shift.val err: 0.3

1,50773,119
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 119
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 106
atom chem shift.comp id: LYS
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 8.175
atom chem shift.val err: 0.020

1,50773,120
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 120
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 106
atom chem shift.comp id: LYS
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 116.138
atom chem shift.val err: 0.3

1,50773,121
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 121
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: 107
atom chem shift.comp id: ASP
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 7.962
atom chem shift.val err: 0.020

1,50773,122
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 122
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: 107
atom chem shift.comp id: ASP
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 120.960
atom chem shift.val err: 0.3

1,50773,123
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 123
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: 108
atom chem shift.comp id: SER
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 7.615
atom chem shift.val err: 0.020

1,50773,124
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 124
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: 108
atom chem shift.comp id: SER
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 109.323
atom chem shift.val err: 0.3

1,50773,125
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 125
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 109
atom chem shift.comp id: GLU
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 8.469
atom chem shift.val err: 0.020

1,50773,126
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 126
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 109
atom chem shift.comp id: GLU
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 121.320
atom chem shift.val err: 0.3

1,50773,127
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 127
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 8.406
atom chem shift.val err: 0.020

1,50773,128
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 128
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 110
atom chem shift.comp id: ASP
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 120.604
atom chem shift.val err: 0.3

1,50773,129
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 129
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: 111
atom chem shift.comp id: VAL
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 7.634
atom chem shift.val err: 0.020

1,50773,130
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 130
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: 111
atom chem shift.comp id: VAL
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 121.888
atom chem shift.val err: 0.3

1,50773,131
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 131
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 113
atom chem shift.comp id: MET
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 8.345
atom chem shift.val err: 0.020

1,50773,132
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 132
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 113
atom chem shift.comp id: MET
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 113
atom chem shift.val: 123.098
atom chem shift.val err: 0.3

1,50773,133
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 133
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: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 8.109
atom chem shift.val err: 0.020

1,50773,134
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 134
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: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 118.677
atom chem shift.val err: 0.3

1,50773,135
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 135
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 115
atom chem shift.comp id: LEU
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 8.993
atom chem shift.val err: 0.020

1,50773,136
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 136
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: 115
atom chem shift.comp id: LEU
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 128.987
atom chem shift.val err: 0.3

1,50773,137
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 137
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: 116
atom chem shift.comp id: VAL
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 9.247
atom chem shift.val err: 0.020

1,50773,138
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 138
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: 116
atom chem shift.comp id: VAL
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 116
atom chem shift.val: 128.077
atom chem shift.val err: 0.3

1,50773,139
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 139
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: 117
atom chem shift.comp id: GLY
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 8.238
atom chem shift.val err: 0.020

1,50773,140
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 140
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: 117
atom chem shift.comp id: GLY
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 113.438
atom chem shift.val err: 0.3

1,50773,141
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 141
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 118
atom chem shift.comp id: ASN
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 8.831
atom chem shift.val err: 0.020

1,50773,142
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 142
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 118
atom chem shift.comp id: ASN
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 121.476
atom chem shift.val err: 0.3

1,50773,143
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 143
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 120
atom chem shift.comp id: CYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 8.627
atom chem shift.val err: 0.020

1,50773,144
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 144
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: 120
atom chem shift.comp id: CYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 113.839
atom chem shift.val err: 0.3

1,50773,145
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 145
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: 121
atom chem shift.comp id: ASP
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 8.607
atom chem shift.val err: 0.020

1,50773,146
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 146
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: 121
atom chem shift.comp id: ASP
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 116.541
atom chem shift.val err: 0.3

1,50773,147
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 147
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 122
atom chem shift.comp id: LEU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 7.828
atom chem shift.val err: 0.020

1,50773,148
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 148
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: 122
atom chem shift.comp id: LEU
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 121.401
atom chem shift.val err: 0.3

1,50773,149
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 149
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: 124
atom chem shift.comp id: SER
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 7.318
atom chem shift.val err: 0.020

1,50773,150
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 150
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: 124
atom chem shift.comp id: SER
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 124
atom chem shift.val: 113.263
atom chem shift.val err: 0.3

1,50773,151
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 151
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 125
atom chem shift.comp id: ARG
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 7.839
atom chem shift.val err: 0.020

1,50773,152
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 152
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: 125
atom chem shift.comp id: ARG
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 120.220
atom chem shift.val err: 0.3

1,50773,153
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 153
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: 126
atom chem shift.comp id: THR
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 9.147
atom chem shift.val err: 0.020

1,50773,154
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 154
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 126
atom chem shift.comp id: THR
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 114.877
atom chem shift.val err: 0.3

1,50773,155
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 155
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 127
atom chem shift.comp id: VAL
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 7.603
atom chem shift.val err: 0.020

1,50773,156
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 156
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: 127
atom chem shift.comp id: VAL
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 124.270
atom chem shift.val err: 0.3

1,50773,157
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 157
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: 128
atom chem shift.comp id: ASP
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 8.631
atom chem shift.val err: 0.020

1,50773,158
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 158
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: 128
atom chem shift.comp id: ASP
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 128
atom chem shift.val: 128.345
atom chem shift.val err: 0.3

1,50773,159
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 159
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: 129
atom chem shift.comp id: THR
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 8.779
atom chem shift.val err: 0.020

1,50773,160
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 160
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 129
atom chem shift.comp id: THR
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 121.540
atom chem shift.val err: 0.3

1,50773,161
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 161
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 130
atom chem shift.comp id: LYS
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 8.448
atom chem shift.val err: 0.020

1,50773,162
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 162
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 130
atom chem shift.comp id: LYS
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 120.310
atom chem shift.val err: 0.3

1,50773,163
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 163
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 7.341
atom chem shift.val err: 0.020

1,50773,164
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 164
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: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 117.493
atom chem shift.val err: 0.3

1,50773,165
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 165
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: 132
atom chem shift.comp id: ALA
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 7.123
atom chem shift.val err: 0.020

1,50773,166
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 166
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: 132
atom chem shift.comp id: ALA
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 122.585
atom chem shift.val err: 0.3

1,50773,167
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 167
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: 133
atom chem shift.comp id: GLN
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 8.464
atom chem shift.val err: 0.020

1,50773,168
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 168
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: 133
atom chem shift.comp id: GLN
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 118.043
atom chem shift.val err: 0.3

1,50773,169
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 169
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: 134
atom chem shift.comp id: ASP
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 8.532
atom chem shift.val err: 0.020

1,50773,170
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 170
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: 134
atom chem shift.comp id: ASP
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 120.315
atom chem shift.val err: 0.3

1,50773,171
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 171
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 135
atom chem shift.comp id: LEU
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 7.541
atom chem shift.val err: 0.020

1,50773,172
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 172
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: 135
atom chem shift.comp id: LEU
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 123.515
atom chem shift.val err: 0.3

1,50773,173
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 173
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: 136
atom chem shift.comp id: ALA
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 8.284
atom chem shift.val err: 0.020

1,50773,174
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 174
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: 136
atom chem shift.comp id: ALA
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 121.503
atom chem shift.val err: 0.3

1,50773,175
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 175
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 137
atom chem shift.comp id: ARG
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 8.496
atom chem shift.val err: 0.020

1,50773,176
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 176
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: 137
atom chem shift.comp id: ARG
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 118.209
atom chem shift.val err: 0.3

1,50773,177
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 177
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: 139
atom chem shift.comp id: TYR
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 7.691
atom chem shift.val err: 0.020

1,50773,178
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: TYR
atom chem shift.auth seq id: 139
atom chem shift.comp id: TYR
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 119.788
atom chem shift.val err: 0.3

1,50773,179
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: GLY
atom chem shift.auth seq id: 140
atom chem shift.comp id: GLY
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 8.338
atom chem shift.val err: 0.020

1,50773,180
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 180
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: 140
atom chem shift.comp id: GLY
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 110.885
atom chem shift.val err: 0.3

1,50773,181
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 181
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 141
atom chem shift.comp id: ILE
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 8.061
atom chem shift.val err: 0.020

1,50773,182
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 182
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: 141
atom chem shift.comp id: ILE
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 112.782
atom chem shift.val err: 0.3

1,50773,183
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 183
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 143
atom chem shift.comp id: PHE
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 8.331
atom chem shift.val err: 0.020

1,50773,184
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 184
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 143
atom chem shift.comp id: PHE
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 143
atom chem shift.val: 120.360
atom chem shift.val err: 0.3

1,50773,185
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 185
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 144
atom chem shift.comp id: ILE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 8.415
atom chem shift.val err: 0.020

1,50773,186
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: ILE
atom chem shift.auth seq id: 144
atom chem shift.comp id: ILE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 129.935
atom chem shift.val err: 0.3

1,50773,187
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: GLU
atom chem shift.auth seq id: 145
atom chem shift.comp id: GLU
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 7.847
atom chem shift.val err: 0.020

1,50773,188
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 188
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 145
atom chem shift.comp id: GLU
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 125.213
atom chem shift.val err: 0.3

1,50773,189
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 189
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: 146
atom chem shift.comp id: THR
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 8.852
atom chem shift.val err: 0.020

1,50773,190
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 190
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 146
atom chem shift.comp id: THR
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 146
atom chem shift.val: 112.558
atom chem shift.val err: 0.3

1,50773,191
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 191
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: 147
atom chem shift.comp id: SER
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 8.709
atom chem shift.val err: 0.020

1,50773,192
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 192
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: 147
atom chem shift.comp id: SER
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 112.272
atom chem shift.val err: 0.3

1,50773,193
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 193
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: 148
atom chem shift.comp id: ALA
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 9.167
atom chem shift.val err: 0.020

1,50773,194
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: ALA
atom chem shift.auth seq id: 148
atom chem shift.comp id: ALA
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 132.274
atom chem shift.val err: 0.3

1,50773,195
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: LYS
atom chem shift.auth seq id: 149
atom chem shift.comp id: LYS
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 7.009
atom chem shift.val err: 0.020

1,50773,196
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 196
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 149
atom chem shift.comp id: LYS
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 116.212
atom chem shift.val err: 0.3

1,50773,197
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 197
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: 150
atom chem shift.comp id: THR
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 7.621
atom chem shift.val err: 0.020

1,50773,198
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 198
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 150
atom chem shift.comp id: THR
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 106.147
atom chem shift.val err: 0.3

1,50773,199
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 199
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: 152
atom chem shift.comp id: GLN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 7.818
atom chem shift.val err: 0.020

1,50773,200
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 200
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: 152
atom chem shift.comp id: GLN
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 124.264
atom chem shift.val err: 0.3

1,50773,201
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 201
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: 153
atom chem shift.comp id: GLY
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 8.962
atom chem shift.val err: 0.020

1,50773,202
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: GLY
atom chem shift.auth seq id: 153
atom chem shift.comp id: GLY
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 115.340
atom chem shift.val err: 0.3

1,50773,203
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
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: 154
atom chem shift.comp id: VAL
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 7.020
atom chem shift.val err: 0.020

1,50773,204
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 204
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: 154
atom chem shift.comp id: VAL
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 120.396
atom chem shift.val err: 0.3

1,50773,205
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 205
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: 155
atom chem shift.comp id: ASP
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 7.940
atom chem shift.val err: 0.020

1,50773,206
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 206
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: 155
atom chem shift.comp id: ASP
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 117.043
atom chem shift.val err: 0.3

1,50773,207
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 207
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: 156
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 8.088
atom chem shift.val err: 0.020

1,50773,208
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 208
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: 156
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 116.224
atom chem shift.val err: 0.3

1,50773,209
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 209
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: 157
atom chem shift.comp id: ALA
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 8.650
atom chem shift.val err: 0.020

1,50773,210
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 210
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: 157
atom chem shift.comp id: ALA
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 124.744
atom chem shift.val err: 0.3

1,50773,211
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 211
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 158
atom chem shift.comp id: PHE
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 7.254
atom chem shift.val err: 0.020

1,50773,212
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 212
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 158
atom chem shift.comp id: PHE
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 112.915
atom chem shift.val err: 0.3

1,50773,213
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 213
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: 159
atom chem shift.comp id: TYR
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 9.519
atom chem shift.val err: 0.020

1,50773,214
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 214
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: 159
atom chem shift.comp id: TYR
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 119.420
atom chem shift.val err: 0.3

1,50773,215
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 215
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: 160
atom chem shift.comp id: THR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 8.616
atom chem shift.val err: 0.020

1,50773,216
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 216
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 160
atom chem shift.comp id: THR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 116.520
atom chem shift.val err: 0.3

1,50773,217
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 217
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 161
atom chem shift.comp id: LEU
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 7.335
atom chem shift.val err: 0.020

1,50773,218
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 218
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: 161
atom chem shift.comp id: LEU
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 121.917
atom chem shift.val err: 0.3

1,50773,219
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 219
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: 162
atom chem shift.comp id: VAL
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 7.680
atom chem shift.val err: 0.020

1,50773,220
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 220
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: 162
atom chem shift.comp id: VAL
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 119.675
atom chem shift.val err: 0.3

1,50773,221
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 221
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 163
atom chem shift.comp id: ARG
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 163
atom chem shift.val: 8.130
atom chem shift.val err: 0.020

1,50773,222
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 222
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: 163
atom chem shift.comp id: ARG
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 163
atom chem shift.val: 118.597
atom chem shift.val err: 0.3

1,50773,223
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 223
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 164
atom chem shift.comp id: GLU
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 164
atom chem shift.val: 8.357
atom chem shift.val err: 0.020

1,50773,224
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 224
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 164
atom chem shift.comp id: GLU
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 164
atom chem shift.val: 119.298
atom chem shift.val err: 0.3

1,50773,225
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 225
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 165
atom chem shift.comp id: ILE
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 165
atom chem shift.val: 8.412
atom chem shift.val err: 0.020

1,50773,226
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 226
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: 165
atom chem shift.comp id: ILE
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 165
atom chem shift.val: 122.874
atom chem shift.val err: 0.3

1,50773,227
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 227
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 166
atom chem shift.comp id: ARG
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 166
atom chem shift.val: 8.690
atom chem shift.val err: 0.020

1,50773,228
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 228
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: 166
atom chem shift.comp id: ARG
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 166
atom chem shift.val: 119.679
atom chem shift.val err: 0.3

1,50773,229
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 229
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 167
atom chem shift.val: 7.847
atom chem shift.val err: 0.020

1,50773,230
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 230
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 167
atom chem shift.val: 117.071
atom chem shift.val err: 0.3

1,50773,231
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 231
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 169
atom chem shift.val: 8.079
atom chem shift.val err: 0.020

1,50773,232
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 232
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 169
atom chem shift.val: 118.916
atom chem shift.val err: 0.3

1,50773,233
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 233
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 171
atom chem shift.comp id: LYS
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 171
atom chem shift.val: 7.633
atom chem shift.val err: 0.020

1,50773,234
type: atom chem shift
of datablock: info:bmrb/50773
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 50773
atom chem shift.id: 234
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 171
atom chem shift.comp id: LYS
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 171
atom chem shift.val: 126.645
atom chem shift.val err: 0.3

50773,MG
type: chem comp
of datablock: info:bmrb/50773
reference to entry: entry
chem comp.entry id: 50773
chem comp.id: MG
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: MG
chem comp.formal charge: 2+
chem comp.formula: Mg
chem comp.formula weight: 24.305
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/Mg/q+2
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.name: MAGNESIUM ION
chem comp.number atoms all: 1
chem comp.number atoms nh: 1
chem comp.pdb code: MG
chem comp.processing site: PDBJ
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_MG
chem comp.three letter code: MG
chem comp.type: NON-POLYMER

info:pdb-ccd/MG

pdb-ccd:MG

info:pdb.ligand/MG

pdb.ligand:MG

50773,GTP
type: chem comp
of datablock: info:bmrb/50773
reference to entry: entry
chem comp.entry id: 50773
chem comp.id: GTP
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: GTP
chem comp.formal charge: 0
chem comp.formula: C10 H16 N5 O14 P3
chem comp.formula weight: 523.180
chem comp.ideal coordinates details: Corina
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates db code: 1QRA
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.mon nstd parent comp id: G
chem comp.name: GUANOSINE-5'-TRIPHOSPHATE
chem comp.number atoms all: 48
chem comp.number atoms nh: 32
chem comp.one letter code: G
chem comp.pdb code: GTP
chem comp.processing site: EBI
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_GTP
chem comp.three letter code: GTP
chem comp.type: NON-POLYMER

info:pdb-ccd/GTP

pdb-ccd:GTP

info:pdb.ligand/GTP

pdb.ligand:GTP

PG,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: PG
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: PG
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: PG
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.566
chem comp atom.model cartn x ideal: -6.030
chem comp atom.model cartn y: 31.391
chem comp atom.model cartn y ideal: -2.367
chem comp atom.model cartn z: 21.635
chem comp atom.model cartn z ideal: 0.637
chem comp atom.pdb atom id: PG
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1G,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O1G
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O1G
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1G
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.613
chem comp atom.model cartn x ideal: -7.326
chem comp atom.model cartn y: 31.907
chem comp atom.model cartn y ideal: -1.996
chem comp atom.model cartn z: 23.069
chem comp atom.model cartn z ideal: 0.026
chem comp atom.pdb atom id: O1G
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2G,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O2G
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O2G
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2G
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.892
chem comp atom.model cartn x ideal: -6.285
chem comp atom.model cartn y: 32.319
chem comp atom.model cartn y ideal: -2.982
chem comp atom.model cartn z: 20.631
chem comp atom.model cartn z ideal: 2.103
chem comp atom.pdb atom id: O2G
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3G,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O3G
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O3G
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3G
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.143
chem comp atom.model cartn x ideal: -5.296
chem comp atom.model cartn y: 30.012
chem comp atom.model cartn y ideal: -3.463
chem comp atom.model cartn z: 21.613
chem comp atom.model cartn z ideal: -0.286
chem comp atom.pdb atom id: O3G
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3B,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O3B
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O3B
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3B
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.160
chem comp atom.model cartn x ideal: -5.101
chem comp atom.model cartn y: 31.360
chem comp atom.model cartn y ideal: -1.058
chem comp atom.model cartn z: 21.228
chem comp atom.model cartn z ideal: 0.758
chem comp atom.pdb atom id: O3B
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: O

PB,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: PB
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: PB
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: PB
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.877
chem comp atom.model cartn x ideal: -4.818
chem comp atom.model cartn y: 31.202
chem comp atom.model cartn y ideal: 0.206
chem comp atom.model cartn z: 19.745
chem comp atom.model cartn z ideal: -0.199
chem comp atom.pdb atom id: PB
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1B,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O1B
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O1B
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1B
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.079
chem comp atom.model cartn x ideal: -4.732
chem comp atom.model cartn y: 29.709
chem comp atom.model cartn y ideal: -0.250
chem comp atom.model cartn z: 19.473
chem comp atom.model cartn z ideal: -1.605
chem comp atom.pdb atom id: O1B
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2B,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O2B
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O2B
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2B
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.125
chem comp atom.model cartn x ideal: -6.017
chem comp atom.model cartn y: 31.970
chem comp atom.model cartn y ideal: 1.269
chem comp atom.model cartn z: 18.749
chem comp atom.model cartn z ideal: -0.052
chem comp atom.pdb atom id: O2B
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3A,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O3A
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O3A
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3A
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.251
chem comp atom.model cartn x ideal: -3.429
chem comp atom.model cartn y: 31.890
chem comp atom.model cartn y ideal: 0.900
chem comp atom.model cartn z: 20.003
chem comp atom.model cartn z ideal: 0.226
chem comp atom.pdb atom id: O3A
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: O

PA,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: PA
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: PA
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: PA
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.846
chem comp atom.model cartn x ideal: -2.449
chem comp atom.model cartn y: 33.261
chem comp atom.model cartn y ideal: 1.965
chem comp atom.model cartn z: 19.411
chem comp atom.model cartn z ideal: -0.479
chem comp atom.pdb atom id: PA
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1A,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O1A
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O1A
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1A
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.888
chem comp atom.model cartn x ideal: -2.350
chem comp atom.model cartn y: 33.256
chem comp atom.model cartn y ideal: 1.662
chem comp atom.model cartn z: 17.957
chem comp atom.model cartn z ideal: -1.925
chem comp atom.pdb atom id: O1A
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2A,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O2A
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O2A
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2A
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.105
chem comp atom.model cartn x ideal: -3.040
chem comp atom.model cartn y: 34.398
chem comp atom.model cartn y ideal: 3.450
chem comp atom.model cartn z: 20.129
chem comp atom.model cartn z ideal: -0.282
chem comp atom.pdb atom id: O2A
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O5',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O5'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O5'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O5'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.430
chem comp atom.model cartn x ideal: -0.988
chem comp atom.model cartn y: 33.153
chem comp atom.model cartn y ideal: 1.876
chem comp atom.model cartn z: 19.900
chem comp atom.model cartn z ideal: 0.190
chem comp atom.pdb atom id: O5'
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C5',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C5'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C5'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C5'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.549
chem comp atom.model cartn x ideal: 0.134
chem comp atom.model cartn y: 33.044
chem comp atom.model cartn y ideal: 2.622
chem comp atom.model cartn z: 21.378
chem comp atom.model cartn z ideal: -0.287
chem comp atom.pdb atom id: C5'
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C4'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C4'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C4'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.046
chem comp atom.model cartn x ideal: 1.360
chem comp atom.model cartn y: 33.618
chem comp atom.model cartn y ideal: 2.304
chem comp atom.model cartn z: 21.474
chem comp atom.model cartn z ideal: 0.570
chem comp atom.pdb atom id: C4'
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O4',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O4'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O4'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O4'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.052
chem comp atom.model cartn x ideal: 1.749
chem comp atom.model cartn y: 32.830
chem comp atom.model cartn y ideal: 0.933
chem comp atom.model cartn z: 20.818
chem comp atom.model cartn z ideal: 0.378
chem comp atom.pdb atom id: O4'
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C3',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.307
chem comp atom.model cartn x ideal: 2.548
chem comp atom.model cartn y: 34.969
chem comp atom.model cartn y ideal: 3.182
chem comp atom.model cartn z: 21.057
chem comp atom.model cartn z ideal: 0.132
chem comp atom.pdb atom id: C3'
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: S
chem comp atom.type symbol: C

O3',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.109
chem comp atom.model cartn x ideal: 2.994
chem comp atom.model cartn y: 35.672
chem comp atom.model cartn y ideal: 3.997
chem comp atom.model cartn z: 21.971
chem comp atom.model cartn z ideal: 1.218
chem comp atom.pdb atom id: O3'
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C2',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.839
chem comp atom.model cartn x ideal: 3.645
chem comp atom.model cartn y: 34.971
chem comp atom.model cartn y ideal: 2.166
chem comp atom.model cartn z: 19.593
chem comp atom.model cartn z ideal: -0.269
chem comp atom.pdb atom id: C2'
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O2',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.672
chem comp atom.model cartn x ideal: 4.929
chem comp atom.model cartn y: 35.961
chem comp atom.model cartn y ideal: 2.593
chem comp atom.model cartn z: 19.355
chem comp atom.model cartn z ideal: 0.190
chem comp atom.pdb atom id: O2'
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C1',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C1'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C1'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C1'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.846
chem comp atom.model cartn x ideal: 3.188
chem comp atom.model cartn y: 33.622
chem comp atom.model cartn y ideal: 0.886
chem comp atom.model cartn z: 19.927
chem comp atom.model cartn z ideal: 0.476
chem comp atom.pdb atom id: C1'
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: R
chem comp atom.type symbol: C

N9,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: N9
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: N9
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N9
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 14.001
chem comp atom.model cartn x ideal: 3.711
chem comp atom.model cartn y: 32.833
chem comp atom.model cartn y ideal: -0.311
chem comp atom.model cartn z: 18.649
chem comp atom.model cartn z ideal: -0.188
chem comp atom.pdb atom id: N9
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C8,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C8
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C8
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C8
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.934
chem comp atom.model cartn x ideal: 3.094
chem comp atom.model cartn y: 32.452
chem comp atom.model cartn y ideal: -1.021
chem comp atom.model cartn z: 17.848
chem comp atom.model cartn z ideal: -1.176
chem comp atom.pdb atom id: C8
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N7,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: N7
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: N7
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N7
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.640
chem comp atom.model cartn x ideal: 3.843
chem comp atom.model cartn y: 31.798
chem comp atom.model cartn y ideal: -2.023
chem comp atom.model cartn z: 16.899
chem comp atom.model cartn z ideal: -1.533
chem comp atom.pdb atom id: N7
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C5,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C5
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C5
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C5
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.029
chem comp atom.model cartn x ideal: 4.981
chem comp atom.model cartn y: 31.889
chem comp atom.model cartn y ideal: -2.017
chem comp atom.model cartn z: 17.001
chem comp atom.model cartn z ideal: -0.798
chem comp atom.pdb atom id: C5
chem comp atom.pdbx ordinal: 25
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C6,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C6
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C6
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.899
chem comp atom.model cartn x ideal: 6.129
chem comp atom.model cartn y: 31.394
chem comp atom.model cartn y ideal: -2.842
chem comp atom.model cartn z: 16.238
chem comp atom.model cartn z ideal: -0.753
chem comp atom.pdb atom id: C6
chem comp atom.pdbx ordinal: 26
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O6,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: O6
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: O6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O6
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.982
chem comp atom.model cartn x ideal: 6.235
chem comp atom.model cartn y: 30.680
chem comp atom.model cartn y ideal: -3.807
chem comp atom.model cartn z: 15.191
chem comp atom.model cartn z ideal: -1.491
chem comp atom.pdb atom id: O6
chem comp atom.pdbx ordinal: 27
chem comp atom.stereo config: N
chem comp atom.type symbol: O

N1,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: N1
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: N1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: N1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.274
chem comp atom.model cartn x ideal: 7.106
chem comp atom.model cartn y: 31.628
chem comp atom.model cartn y ideal: -2.535
chem comp atom.model cartn z: 16.800
chem comp atom.model cartn z ideal: 0.129
chem comp atom.pdb atom id: N1
chem comp atom.pdbx ordinal: 28
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C2,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C2
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.304
chem comp atom.model cartn x ideal: 6.978
chem comp atom.model cartn y: 32.295
chem comp atom.model cartn y ideal: -1.454
chem comp atom.model cartn z: 17.896
chem comp atom.model cartn z ideal: 0.950
chem comp atom.pdb atom id: C2
chem comp atom.pdbx ordinal: 29
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N2,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: N2
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: N2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: N2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.677
chem comp atom.model cartn x ideal: 7.986
chem comp atom.model cartn y: 32.450
chem comp atom.model cartn y ideal: -1.165
chem comp atom.model cartn z: 18.475
chem comp atom.model cartn z ideal: 1.835
chem comp atom.pdb atom id: N2
chem comp atom.pdbx ordinal: 30
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N3,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: N3
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: N3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: N3
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.384
chem comp atom.model cartn x ideal: 5.916
chem comp atom.model cartn y: 32.736
chem comp atom.model cartn y ideal: -0.679
chem comp atom.model cartn z: 18.739
chem comp atom.model cartn z ideal: 0.917
chem comp atom.pdb atom id: N3
chem comp atom.pdbx ordinal: 31
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C4,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: C4
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: C4
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C4
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.218
chem comp atom.model cartn x ideal: 4.911
chem comp atom.model cartn y: 32.517
chem comp atom.model cartn y ideal: -0.918
chem comp atom.model cartn z: 18.135
chem comp atom.model cartn z ideal: 0.066
chem comp atom.pdb atom id: C4
chem comp atom.pdbx ordinal: 32
chem comp atom.stereo config: N
chem comp atom.type symbol: C

HOG2,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HOG2
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HOG2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOG2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.595
chem comp atom.model cartn x ideal: -6.838
chem comp atom.model cartn y: 33.105
chem comp atom.model cartn y ideal: -3.775
chem comp atom.model cartn z: 21.075
chem comp atom.model cartn z ideal: 2.106
chem comp atom.pdb atom id: HOG2
chem comp atom.pdbx ordinal: 33
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOG3,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HOG3
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HOG3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOG3
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.982
chem comp atom.model cartn x ideal: -4.439
chem comp atom.model cartn y: 29.715
chem comp atom.model cartn y ideal: -3.753
chem comp atom.model cartn z: 22.501
chem comp atom.model cartn z ideal: 0.055
chem comp atom.pdb atom id: HOG3
chem comp atom.pdbx ordinal: 34
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOB2,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HOB2
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HOB2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOB2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 5.858
chem comp atom.model cartn x ideal: -6.132
chem comp atom.model cartn y: 31.396
chem comp atom.model cartn y ideal: 1.611
chem comp atom.model cartn z: 18.041
chem comp atom.model cartn z ideal: 0.846
chem comp atom.pdb atom id: HOB2
chem comp atom.pdbx ordinal: 35
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOA2,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HOA2
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HOA2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOA2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.743
chem comp atom.model cartn x ideal: -3.133
chem comp atom.model cartn y: 34.996
chem comp atom.model cartn y ideal: 3.717
chem comp atom.model cartn z: 19.486
chem comp atom.model cartn z ideal: 0.643
chem comp atom.pdb atom id: HOA2
chem comp atom.pdbx ordinal: 36
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H5'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: H5'1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H5'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.819
chem comp atom.model cartn x ideal: 0.335
chem comp atom.model cartn y: 33.672
chem comp atom.model cartn y ideal: 2.352
chem comp atom.model cartn z: 21.910
chem comp atom.model cartn z ideal: -1.324
chem comp atom.pdb atom id: H5'
chem comp atom.pdbx ordinal: 37
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5'',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H5''
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: H5'2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H5''
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.469
chem comp atom.model cartn x ideal: -0.086
chem comp atom.model cartn y: 32.007
chem comp atom.model cartn y ideal: 3.688
chem comp atom.model cartn z: 21.735
chem comp atom.model cartn z ideal: -0.226
chem comp atom.pdb atom id: H5''
chem comp atom.pdbx ordinal: 38
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H4'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: H4'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H4'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.283
chem comp atom.model cartn x ideal: 1.133
chem comp atom.model cartn y: 33.581
chem comp atom.model cartn y ideal: 2.480
chem comp atom.model cartn z: 22.548
chem comp atom.model cartn z ideal: 1.621
chem comp atom.pdb atom id: H4'
chem comp atom.pdbx ordinal: 39
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H3',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: H3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.335
chem comp atom.model cartn x ideal: 2.270
chem comp atom.model cartn y: 35.482
chem comp atom.model cartn y ideal: 3.803
chem comp atom.model cartn z: 21.016
chem comp atom.model cartn z ideal: -0.720
chem comp atom.pdb atom id: H3'
chem comp atom.pdbx ordinal: 40
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO3',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HO3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HO3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HO3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: 13.253
chem comp atom.model cartn x ideal: 3.741
chem comp atom.model cartn y: 36.555
chem comp atom.model cartn y ideal: 4.571
chem comp atom.model cartn z: 21.653
chem comp atom.model cartn z ideal: 0.998
chem comp atom.pdb atom id: HO3'
chem comp atom.pdbx ordinal: 41
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: H2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.075
chem comp atom.model cartn x ideal: 3.652
chem comp atom.model cartn y: 34.730
chem comp atom.model cartn y ideal: 2.007
chem comp atom.model cartn z: 18.840
chem comp atom.model cartn z ideal: -1.347
chem comp atom.pdb atom id: H2'
chem comp atom.pdbx ordinal: 42
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO2',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HO2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HO2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HO2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.966
chem comp atom.model cartn x ideal: 5.218
chem comp atom.model cartn y: 35.918
chem comp atom.model cartn y ideal: 3.438
chem comp atom.model cartn z: 18.453
chem comp atom.model cartn z ideal: -0.180
chem comp atom.pdb atom id: HO2'
chem comp atom.pdbx ordinal: 43
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H1',GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H1'
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: H1'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H1'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 14.805
chem comp atom.model cartn x ideal: 3.503
chem comp atom.model cartn y: 33.958
chem comp atom.model cartn y ideal: 0.916
chem comp atom.model cartn z: 20.347
chem comp atom.model cartn z ideal: 1.519
chem comp atom.pdb atom id: H1'
chem comp atom.pdbx ordinal: 44
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H8,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: H8
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: H8
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H8
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.873
chem comp atom.model cartn x ideal: 2.128
chem comp atom.model cartn y: 32.624
chem comp atom.model cartn y ideal: -0.786
chem comp atom.model cartn z: 17.951
chem comp atom.model cartn z ideal: -1.599
chem comp atom.pdb atom id: H8
chem comp atom.pdbx ordinal: 45
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN1,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HN1
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 1
chem comp atom.alt atom id: HN1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HN1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.102
chem comp atom.model cartn x ideal: 7.903
chem comp atom.model cartn y: 31.290
chem comp atom.model cartn y ideal: -3.086
chem comp atom.model cartn z: 16.354
chem comp atom.model cartn z ideal: 0.179
chem comp atom.pdb atom id: HN1
chem comp atom.pdbx ordinal: 46
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN21,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HN21
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HN21
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HN21
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.794
chem comp atom.model cartn x ideal: 8.776
chem comp atom.model cartn y: 32.845
chem comp atom.model cartn y ideal: -1.728
chem comp atom.model cartn z: 19.386
chem comp atom.model cartn z ideal: 1.870
chem comp atom.pdb atom id: HN21
chem comp atom.pdbx ordinal: 47
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN22,GTP,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: HN22
chem comp atom.comp id: GTP
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: HN22
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HN22
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.477
chem comp atom.model cartn x ideal: 7.909
chem comp atom.model cartn y: 32.159
chem comp atom.model cartn y ideal: -0.399
chem comp atom.model cartn z: 17.950
chem comp atom.model cartn z ideal: 2.425
chem comp atom.pdb atom id: HN22
chem comp atom.pdbx ordinal: 48
chem comp atom.stereo config: N
chem comp atom.type symbol: H

MG,MG,50773
type: chem comp atom
of datablock: info:bmrb/50773
reference to entry: entry
chem comp atom.atom id: MG
chem comp atom.comp id: MG
chem comp atom.entry id: 50773
chem comp atom.align: 0
chem comp atom.alt atom id: MG
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: MG
chem comp atom.charge: 2
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.000
chem comp atom.model cartn x ideal: 0.000
chem comp atom.model cartn y: 0.000
chem comp atom.model cartn y ideal: 0.000
chem comp atom.model cartn z: 0.000
chem comp atom.model cartn z ideal: 0.000
chem comp atom.pdb atom id: MG
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: MG

GTP,50773,1
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 1
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O1G
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,2
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 2
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O2G
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,3
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 3
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O3G
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,4
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 4
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O3B
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,5
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 5
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2G
chem comp bond.atom id 2: HOG2
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,6
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 6
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3G
chem comp bond.atom id 2: HOG3
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,7
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 7
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3B
chem comp bond.atom id 2: PB
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,8
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PB
chem comp bond.atom id 2: O1B
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,9
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 9
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PB
chem comp bond.atom id 2: O2B
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,10
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 10
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PB
chem comp bond.atom id 2: O3A
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,11
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 11
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2B
chem comp bond.atom id 2: HOB2
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,12
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 12
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3A
chem comp bond.atom id 2: PA
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,13
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 13
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O1A
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,14
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 14
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O2A
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,15
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 15
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O5'
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,16
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 16
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2A
chem comp bond.atom id 2: HOA2
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,17
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 17
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O5'
chem comp bond.atom id 2: C5'
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,18
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 18
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5'
chem comp bond.atom id 2: C4'
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,19
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 19
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5'
chem comp bond.atom id 2: H5'
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,20
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 20
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5'
chem comp bond.atom id 2: H5''
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,21
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 21
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4'
chem comp bond.atom id 2: O4'
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,22
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 22
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4'
chem comp bond.atom id 2: C3'
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,23
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 23
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4'
chem comp bond.atom id 2: H4'
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,24
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 24
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O4'
chem comp bond.atom id 2: C1'
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,25
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 25
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3'
chem comp bond.atom id 2: O3'
chem comp bond.ordinal: 25
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,26
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 26
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3'
chem comp bond.atom id 2: C2'
chem comp bond.ordinal: 26
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,27
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 27
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3'
chem comp bond.atom id 2: H3'
chem comp bond.ordinal: 27
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,28
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 28
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3'
chem comp bond.atom id 2: HO3'
chem comp bond.ordinal: 28
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,29
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 29
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2'
chem comp bond.atom id 2: O2'
chem comp bond.ordinal: 29
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,30
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 30
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2'
chem comp bond.atom id 2: C1'
chem comp bond.ordinal: 30
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,31
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 31
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2'
chem comp bond.atom id 2: H2'
chem comp bond.ordinal: 31
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,32
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 32
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2'
chem comp bond.atom id 2: HO2'
chem comp bond.ordinal: 32
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,33
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 33
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1'
chem comp bond.atom id 2: N9
chem comp bond.ordinal: 33
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,34
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 34
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1'
chem comp bond.atom id 2: H1'
chem comp bond.ordinal: 34
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,35
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 35
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N9
chem comp bond.atom id 2: C8
chem comp bond.ordinal: 35
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,36
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 36
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N9
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 36
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,37
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 37
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: N7
chem comp bond.ordinal: 37
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,38
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 38
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H8
chem comp bond.ordinal: 38
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,39
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 39
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N7
chem comp bond.atom id 2: C5
chem comp bond.ordinal: 39
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,40
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 40
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 40
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,41
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 41
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 41
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,42
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 42
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: O6
chem comp bond.ordinal: 42
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,43
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 43
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: N1
chem comp bond.ordinal: 43
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,44
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 44
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: C2
chem comp bond.ordinal: 44
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,45
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 45
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: HN1
chem comp bond.ordinal: 45
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,46
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 46
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N2
chem comp bond.ordinal: 46
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,47
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 47
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N3
chem comp bond.ordinal: 47
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,50773,48
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 48
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: HN21
chem comp bond.ordinal: 48
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,49
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 49
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: HN22
chem comp bond.ordinal: 49
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,50773,50
type: chem comp bond
of datablock: info:bmrb/50773
chem comp bond.comp id: GTP
chem comp bond.entry id: 50773
chem comp bond.id: 50
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 50
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,,50773,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: InChI=1S/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
chem comp descriptor.entry id: 50773
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr50773/chem_comp_descriptor/GTP,NC1%3DNc2n(cnc2C(%3DO)N1)%5BC%40%40H%5D3O%5BC%40H%5D(CO%5BP%5D(O)(%3DO)O%5BP%5D(O)(%3DO)O%5BP%5D(O,50773,CACTVS,3.370,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@H](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)[C@@H](O)[C@H]3O
chem comp descriptor.entry id: 50773
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.370
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr50773/chem_comp_descriptor/GTP,NC1%3DNc2n(cnc2C(%3DO)N1)%5BCH%5D3O%5BCH%5D(CO%5BP%5D(O)(%3DO)O%5BP%5D(O)(%3DO)O%5BP%5D(O)(O,50773,CACTVS,3.370,SMILES
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: NC1=Nc2n(cnc2C(=O)N1)[CH]3O[CH](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)[CH](O)[CH]3O
chem comp descriptor.entry id: 50773
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.370
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr50773/chem_comp_descriptor/GTP,O%3DP(O)(O)OP(%3DO)(O)OP(%3DO)(O)OCC3OC(n2cnc1c2N%3DC(N)NC1%3DO)C(O)C3O,50773,ACD,12.01,SMILES
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)C(O)C3O
chem comp descriptor.entry id: 50773
chem comp descriptor.program: ACD
chem comp descriptor.program version: 12.01
chem comp descriptor.type: SMILES

GTP,XKMLYUALXHKNFT-UUOKFMHZSA-N,50773,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: XKMLYUALXHKNFT-UUOKFMHZSA-N
chem comp descriptor.entry id: 50773
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr50773/chem_comp_descriptor/GTP,c1nc2c(n1C3C(C(C(O3)COP(%3DO)(O)OP(%3DO)(O)OP(%3DO)(O)O)O)O)N%3DC(NC2%3DO),50773,OECHEM,1.7.6,SMILES
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: c1nc2c(n1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
chem comp descriptor.entry id: 50773
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr50773/chem_comp_descriptor/GTP,c1nc2c(n1%5BC%40H%5D3%5BC%40%40H%5D(%5BC%40%40H%5D(%5BC%40H%5D(O3)CO%5BP%40%5D(%3DO)(O)O%5BP%40%5D(%3DO)(O)O,50773,OECHEM,1.7.6,SMILES_CAN[cell cut: 206 characters, first 200 kept]
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)O[P@](=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
chem comp descriptor.entry id: 50773
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr50773/chem_comp_descriptor/MG,InChI%3D1S%2FMg%2Fq%2B2,50773,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: InChI=1S/Mg/q+2
chem comp descriptor.entry id: 50773
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

MG,JLVVSXFLKOJNIY-UHFFFAOYSA-N,50773,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: JLVVSXFLKOJNIY-UHFFFAOYSA-N
chem comp descriptor.entry id: 50773
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

MG,[Mg++],50773,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg++]
chem comp descriptor.entry id: 50773
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

MG,[Mg++],50773,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg++]
chem comp descriptor.entry id: 50773
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

MG,[Mg+2],50773,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg+2]
chem comp descriptor.entry id: 50773
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

MG,[Mg+2],50773,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg+2]
chem comp descriptor.entry id: 50773
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

MG,[Mg+2],50773,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/50773
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg+2]
chem comp descriptor.entry id: 50773
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

GTP,50773,[[(2R,3S,4R,5R)-5-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)-3,OECHEM,1.7.6,systematic name
type: chem comp identifier
of datablock: info:bmrb/50773
chem comp identifier.comp id: GTP
chem comp identifier.entry id: 50773
chem comp identifier.identifier: [[(2R,3S,4R,5R)-5-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.7.6
chem comp identifier.type: systematic name

GTP,50773,guanosine 5'-(tetrahydrogen triphosphate),ACD,12.01,systematic name
type: chem comp identifier
of datablock: info:bmrb/50773
chem comp identifier.comp id: GTP
chem comp identifier.entry id: 50773
chem comp identifier.identifier: guanosine 5'-(tetrahydrogen triphosphate)
chem comp identifier.program: ACD
chem comp identifier.program version: 12.01
chem comp identifier.type: systematic name

MG,50773,magnesium,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/50773
chem comp identifier.comp id: MG
chem comp identifier.entry id: 50773
chem comp identifier.identifier: magnesium
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

MG,50773,magnesium(+2) cation,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/50773
chem comp identifier.comp id: MG
chem comp identifier.entry id: 50773
chem comp identifier.identifier: magnesium(+2) cation
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

1,50773,1
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 1
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,2
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 2
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 94
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,3
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 3
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 95
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,4
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 4
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: HIS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,5
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 5
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.286
chem shift completeness char.comp id: HIS
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,6
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 6
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.222
chem shift completeness char.comp id: TYR
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,7
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 7
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
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.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,8
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 8
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,9
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 9
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLN
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.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,10
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 10
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ILE
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,11
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 11
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 103
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,12
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 12
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 104
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,13
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 13
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 105
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,14
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 14
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 106
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,15
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 15
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 107
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,16
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 16
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 108
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,17
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 17
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.286
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 109
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,18
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 18
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 110
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,19
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 19
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.400
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 111
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.500
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 507730301

1,50773,20
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 20
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 112
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,21
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 21
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 113
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,22
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 22
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 114
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,23
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 23
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 115
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,24
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 24
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 116
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 507730301

1,50773,25
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 25
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 117
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 507730301

1,50773,26
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 26
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 118
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,27
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 27
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 119
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,28
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 28
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 120
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,29
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 29
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 121
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,30
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 30
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 122
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.800
chem shift completeness char.sf id: 507730301

1,50773,31
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 31
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 123
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,32
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 32
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 124
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,33
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 33
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 125
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,34
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 34
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 126
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,35
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 35
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 127
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,36
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 36
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 128
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,37
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 37
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 129
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,38
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 38
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 130
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,39
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 39
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 131
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,40
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 40
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 132
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,41
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 41
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 133
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,42
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 42
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 134
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,43
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 43
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.125
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 135
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,44
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 44
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 136
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,45
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 45
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 137
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,46
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 46
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 138
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,47
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 47
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.222
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 139
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,48
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 48
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 140
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 507730301

1,50773,49
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 49
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 141
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,50
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 50
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 142
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,51
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 51
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 143
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,52
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 52
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 144
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,53
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 53
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.286
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 145
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,54
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 54
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 146
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,55
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 55
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 147
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,56
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 56
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 148
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,57
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 57
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 149
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,58
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 58
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 150
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,59
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 59
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 151
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,60
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 60
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 152
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,61
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 61
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 153
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 507730301

1,50773,62
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 62
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.400
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 154
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,63
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 63
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 155
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,64
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 64
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 156
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,65
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 65
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 157
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,66
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 66
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 158
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,67
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 67
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.222
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 159
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,68
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 68
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 160
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,69
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 69
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 161
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,70
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 70
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 162
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,71
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 71
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 163
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,72
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 72
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,73
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 73
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: HIS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,74
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 74
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: MET
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,75
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 75
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,76
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 76
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.286
chem shift completeness char.comp id: GLU
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,77
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 77
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.222
chem shift completeness char.comp id: TYR
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,78
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 78
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,79
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 79
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.429
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: LEU
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 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.400
chem shift completeness char.sc chem shift coverage: 0.400
chem shift completeness char.sf id: 507730301

1,50773,80
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 80
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: VAL
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,81
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 81
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,82
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 82
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,83
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 83
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,84
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 84
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,85
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 85
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,86
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 86
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,87
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 87
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: VAL
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 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 507730301

1,50773,88
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 88
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,89
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 89
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,90
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 90
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,91
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 91
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: ALA
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,92
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 92
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,93
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 93
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: THR
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,94
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 94
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.286
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 164
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,95
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 95
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 165
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,96
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 96
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 166
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,97
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 97
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 167
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,98
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 98
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 168
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,99
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 99
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 169
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,100
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 100
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 170
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,101
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 101
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 171
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,102
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 102
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: 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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,103
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 103
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 25
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,104
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 104
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,105
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 105
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
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.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,106
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 106
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 28
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,107
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 107
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: HIS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,108
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 108
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PHE
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,109
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 109
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,110
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 110
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 32
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,111
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 111
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,112
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 112
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.222
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 34
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,113
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 113
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,114
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 114
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 36
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,115
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 115
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,116
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 116
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ILE
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,117
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 117
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 39
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,118
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 118
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 40
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,119
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 119
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: SER
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,120
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 120
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.222
chem shift completeness char.comp id: TYR
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,121
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 121
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: ARG
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,122
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 122
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.100
chem shift completeness char.chem shift coverage: 0.182
chem shift completeness char.comp id: LYS
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,123
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 123
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,124
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 124
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: VAL
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,125
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 125
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 47
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,126
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 126
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ILE
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,127
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 127
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,128
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 128
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,129
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 129
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.286
chem shift completeness char.comp id: GLU
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,130
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 130
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,131
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 131
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: CYS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,132
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 132
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.286
chem shift completeness char.chem shift coverage: 0.375
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 0.500
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.200
chem shift completeness char.sc chem shift coverage: 0.200
chem shift completeness char.sf id: 507730301

1,50773,133
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 133
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 55
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,134
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 134
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 56
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,135
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 135
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ILE
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,136
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 136
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,137
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 137
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,138
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 138
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: THR
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,139
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 139
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 61
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,140
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 140
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
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: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,141
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 141
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLN
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.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,142
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 142
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,143
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 143
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,144
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 144
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: TYR
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,145
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 145
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: SER
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,146
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 146
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
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 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 507730301

1,50773,147
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 147
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: MET
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,148
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 148
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ARG
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,149
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 149
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,150
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 150
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 72
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,151
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 151
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: TYR
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,152
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 152
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: MET
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,153
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 153
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: ARG
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,154
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 154
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 76
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,155
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 155
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,156
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 156
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: GLU
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,157
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 157
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.333
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLY
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.sf id: 507730301

1,50773,158
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 158
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: PHE
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,159
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 159
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,160
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 160
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: CYS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,161
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 161
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 83
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,162
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 162
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 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.111
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: PHE
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 507730301

1,50773,163
type: chem shift completeness char
of datablock: info:bmrb/50773
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 50773
chem shift completeness char.id: 163
chem shift completeness char.bb chem shift 15n coverage: 1.000
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.500
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
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1,50773,164
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reference to entry: entry
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1,50773,165
type: chem shift completeness char
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reference to entry: entry
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1,50773,166
type: chem shift completeness char
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reference to entry: entry
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1,50773,167
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1,50773,168
type: chem shift completeness char
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1,50773,169
type: chem shift completeness char
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reference to entry: entry
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1,50773,170
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1,50773,171
type: chem shift completeness char
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1,50773
type: chem shift completeness list
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chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr50773_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
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chem shift completeness list.queried date: 2022-07-12Z
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chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
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15,N,1,50773,DSS
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chem shift reference.name: Reference
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1,50773,1
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50773,1
type: citation
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reference to entry: entry
citation.entry id: 50773
citation.id: 1
citation.class: entry citation
citation.doi: 10.1002/chem.202201449
citation.journal abbrev: Chemistry
citation.journal issn: 0947-6539
citation.journal issue: 59
citation.journal name full: Chemistry (Weinheim an der Bergstrasse, Germany)
citation.journal volume: 28
citation.page first: e202201449
citation.page last: e202201449
citation.pubmed id: 35781716
citation.sf category: citations
citation.sf framecode: citations_1
citation.status: published
citation.title: The Importance of Mg2+-free State in Nucleotide Exchange of Oncogenic K-Ras Mutants.
citation.type: journal
citation.year: 2022

info:doi/10.1002/chem.202201449

doi:10.1002/chem.202201449

urn:ISSN:0947-6539

issn:0947-6539

info:pmid/35781716

pubmed:35781716

1,50773,1
type: citation author
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citation author.citation id: 1
citation author.entry id: 50773
citation author.ordinal: 1
citation author.family name: Palfy
citation author.given name: Gyula
citation author.pdbx name: Palfy, G.

1,50773,2
type: citation author
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citation author.citation id: 1
citation author.entry id: 50773
citation author.ordinal: 2
citation author.family name: Menyhard
citation author.given name: Dora
citation author.middle initials: K.
citation author.pdbx name: Menyhard, D.K.

1,50773,3
type: citation author
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citation author.citation id: 1
citation author.entry id: 50773
citation author.ordinal: 3
citation author.family name: Akontz-Kiss
citation author.given name: Hanna
citation author.pdbx name: Akontz-Kiss, H.

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type: citation author
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citation author.entry id: 50773
citation author.ordinal: 4
citation author.family name: Vida
citation author.given name: Istvan
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citation author.ordinal: 6
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citation author.pdbx name: Toke, O.

1,50773,7
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citation author.entry id: 50773
citation author.ordinal: 7
citation author.family name: Perczel
citation author.given name: Andras
citation author.pdbx name: Perczel, A.

50773,assigned chemical shifts
type: data set
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reference to entry: entry
data set.entry id: 50773
data set.type: assigned_chemical_shifts
data set.count: 1

50773,15N chemical shifts
type: datum
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reference to entry: entry
datum.entry id: 50773
datum.type: 15N chemical shifts
datum.count: 117

50773,1H chemical shifts
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50773,1
type: entity
of datablock: info:bmrb/50773
reference to entry: entry
entity.entry id: 50773
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 19481.79
entity.name: entity 1
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 171
entity.paramagnetic: no
entity.parent entity id: 1
entity.polymer seq one letter code: GHMTEYKLVVVGAVGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEK
entity.polymer seq one letter code can: GHMTEYKLVVVGAVGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEK
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: entity_1
entity.thiol state: all free
entity.type: polymer

50773,2
type: entity
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reference to entry: entry
entity.entry id: 50773
entity.id: 2
entity.bmrb code: GTP
entity.formula weight: 523.180
entity.name: entity GTP
entity.nonpolymer comp id: GTP
entity.nonpolymer comp label: chem_comp_GTP
entity.number of nonpolymer components: 1
entity.parent entity id: 2
entity.polymer seq one letter code can: (GTP)
entity.sf category: entity
entity.sf framecode: entity_GTP
entity.type: non-polymer

50773,3
type: entity
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reference to entry: entry
entity.entry id: 50773
entity.id: 3
entity.bmrb code: MG
entity.formula weight: 24.305
entity.name: entity MG
entity.nonpolymer comp id: MG
entity.nonpolymer comp label: chem_comp_MG
entity.number of nonpolymer components: 1
entity.parent entity id: 3
entity.polymer seq one letter code can: (MG)
entity.sf category: entity
entity.sf framecode: entity_MG
entity.type: non-polymer

1,50773,1
type: entity assembly
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entity assembly.assembly id: 1
entity assembly.entry id: 50773
entity assembly.id: 1
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: KRas-G12V
entity assembly.entity id: 1
entity assembly.entity label: entity_1
entity assembly.experimental data reported: yes
entity assembly.physical state: native

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entity assembly.conformational isomer: no
entity assembly.entity assembly name: GTP
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entity assembly.entity label: entity_GTP
entity assembly.experimental data reported: no
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entity assembly.id: 3
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Mg2+
entity assembly.entity id: 3
entity assembly.entity label: entity_MG
entity assembly.experimental data reported: no
entity assembly.physical state: native

2,50773,GUANOSINE-5'-TRIPHOSPHATE,BMRB
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entity common name.name: MAGNESIUM ION
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1,50773,155
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1,50773,158
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1,50773,1
type: entity experimental src
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entity experimental src.host org species: coli
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info:taxonomy/562

taxonomy:562

50773,1
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entity natural src.kingdom: Metazoa
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entity natural src.organism name scientific: Homo sapiens
entity natural src.species: sapiens
entity natural src.superkingdom: Eukaryota
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info:taxonomy/9606

taxonomy:9606

50773,1
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type: entity poly seq
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entity systematic name.naming system: Three letter code
entity systematic name.name: GTP

3,50773,BMRB
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entity systematic name.entity id: 3
entity systematic name.entry id: 50773
entity systematic name.naming system: BMRB
entity systematic name.name: MAGNESIUM ION

3,50773,Three letter code
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entity systematic name.entity id: 3
entity systematic name.entry id: 50773
entity systematic name.naming system: Three letter code
entity systematic name.name: MG

http://bmrbpub.pdbj.org/rdf/bmr50773/entry/50773
type: entry
of datablock: info:bmrb/50773
entry.id: 50773
entry.accession date: 2021-02-16Z
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2021-02-16Z
entry.nmr star version: 3.2.14.0
entry.original nmr star version: 3.1
entry.original release date: 2021-02-16Z
entry.origination: author
entry.sf category: entry_information
entry.sf framecode: entry_information_1
entry.submission date: 2021-02-16Z
entry.title: Backbone 1H, 15N assignment of 15N-labeled oncogenic mutant human KRas4B-G12V(1-169) bound to GTP at physiological pH
entry.type: macromolecule
entry.version type: original

50773,1
type: entry author
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reference to entry: entry
entry author.entry id: 50773
entry author.ordinal: 1
entry author.family name: Palfy
entry author.given name: Gyula
entry author.orcid: 0000-0003-1590-5331
entry author.pdbx name: Palfy, G.

info:orcid/0000-0003-1590-5331

orcid:0000-0003-1590-5331

50773,2
type: entry author
of datablock: info:bmrb/50773
reference to entry: entry
entry author.entry id: 50773
entry author.ordinal: 2
entry author.family name: Vida
entry author.given name: Istvan
entry author.orcid: 0000-0002-7886-5392
entry author.pdbx name: Vida, I.

info:orcid/0000-0002-7886-5392

orcid:0000-0002-7886-5392

50773,3
type: entry author
of datablock: info:bmrb/50773
reference to entry: entry
entry author.entry id: 50773
entry author.ordinal: 3
entry author.family name: Perczel
entry author.given name: Andras
entry author.orcid: 0000-0003-1252-6416
entry author.pdbx name: Perczel, A.

info:orcid/0000-0003-1252-6416

orcid:0000-0003-1252-6416

50773,1,1
type: experiment
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experiment.id: 1
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
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experiment.mass spectrometer id: 0
experiment.name: 2D 1H-15N HSQC
experiment.nmr spectrometer id: 1
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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

50773,1,2
type: experiment
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experiment.chromatographic system id: 0
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experiment.name: 3D 1H-15N NOESY
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experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
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experiment.sample id: 1
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experiment.sample state: isotropic

50773,1
type: experiment list
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experiment list.entry id: 50773
experiment list.id: 1
experiment list.sf category: experiment_list
experiment list.sf framecode: experiment_list_1

50773,1
type: nmr spectrometer
of datablock: info:bmrb/50773
reference to entry: entry
nmr spectrometer.entry id: 50773
nmr spectrometer.id: 1
nmr spectrometer.field strength: 700
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: AVANCE III
nmr spectrometer.name: Spectrometer
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: NMR_spectrometer_1

50774,BMRB,50773
type: related entries
of datablock: info:bmrb/50773
reference to entry: entry
related entries.database accession code: 50774
related entries.database name: BMRB
related entries.entry id: 50773
related entries.relationship: Full assignment of 13C,15N-labeled Mg2+-free oncogenic mutant human KRas4B-G12C(1-169) bound to GDP

info:bmrb/50774

50773,2
type: release
of datablock: info:bmrb/50773
reference to entry: entry
release.entry id: 50773
release.release number: 2
release.author: BMRB
release.date: 2022-12-27Z
release.detail: update entry citation
release.submission date: 2021-02-16Z
release.type: update

50773,1
type: release
of datablock: info:bmrb/50773
reference to entry: entry
release.entry id: 50773
release.release number: 1
release.author: author
release.date: 2022-07-04Z
release.detail: original release
release.submission date: 2021-02-16Z
release.type: original

50773,1
type: sample
of datablock: info:bmrb/50773
reference to entry: entry
sample.entry id: 50773
sample.id: 1
sample.aggregate sample number: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.name: Sample
sample.sf category: sample
sample.sf framecode: sample_1
sample.solvent system: 90% H2O/10% D2O
sample.type: solution

50773,1,1
type: sample component
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sample component.entry id: 50773
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 1
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: [U-100% 15N]
sample component.mol common name: KRas-G12V

50773,2,1
type: sample component
of datablock: info:bmrb/50773
sample component.entry id: 50773
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 80
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: GTP

50773,3,1
type: sample component
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sample component.entry id: 50773
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 15
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: MgCl2

50773,4,1
type: sample component
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sample component.entry id: 50773
sample component.id: 4
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 10
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: EDTA

50773,5,1
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sample component.id: 5
sample component.sample id: 1
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sample component.concentration val: 10
sample component.concentration val units: % v/v
sample component.entity id: 0
sample component.isotopic labeling: [U-100% 2H]
sample component.mol common name: D2O

50773,6,1
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sample component.id: 6
sample component.sample id: 1
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sample component.concentration val units: % v/v
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: DSS

50773,7,1
type: sample component
of datablock: info:bmrb/50773
sample component.entry id: 50773
sample component.id: 7
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 137
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: NaCl

50773,8,1
type: sample component
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sample component.entry id: 50773
sample component.id: 8
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 2.7
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: KCl

50773,9,1
type: sample component
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sample component.entry id: 50773
sample component.id: 9
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 10
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: Na2HPO4

50773,10,1
type: sample component
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sample component.entry id: 50773
sample component.id: 10
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 1.8
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: KH2PO4

50773,1
type: sample condition list
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reference to entry: entry
sample condition list.entry id: 50773
sample condition list.id: 1
sample condition list.name: Condition 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

50773,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/50773
sample condition variable.entry id: 50773
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 0.3
sample condition variable.val units: M

50773,1,pH
type: sample condition variable
of datablock: info:bmrb/50773
sample condition variable.entry id: 50773
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 7.4
sample condition variable.val units: pH

50773,1,pressure
type: sample condition variable
of datablock: info:bmrb/50773
sample condition variable.entry id: 50773
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

50773,1,temperature
type: sample condition variable
of datablock: info:bmrb/50773
sample condition variable.entry id: 50773
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

50773,1
type: software
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reference to entry: entry
software.entry id: 50773
software.id: 1
software.name: TOPSPIN
software.sf category: software
software.sf framecode: software_1
software.version: 3.6

50773,2
type: software
of datablock: info:bmrb/50773
reference to entry: entry
software.entry id: 50773
software.id: 2
software.name: CARA
software.sf category: software
software.sf framecode: software_2

50773,2,chemical shift assignment
type: task
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task.entry id: 50773
task.software id: 2
task.task: chemical shift assignment

50773,1,collection
type: task
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task.entry id: 50773
task.software id: 1
task.task: collection

50773,1,processing
type: task
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task.entry id: 50773
task.software id: 1
task.task: processing