info:bmrb/51358
type: datablock
references: doi:10.13018/BMR51358
alternative label: bmr51358
title: 1H, 13C and 15N resonance assignments of diglycosylated TSR3 domain of human Thrombospondin-1
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 1.387
atom chem shift.val err: 0.020

1,51358,33
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 33
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 0.850
atom chem shift.val err: 0.020

1,51358,34
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 34
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 0.850
atom chem shift.val err: 0.020

1,51358,35
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 35
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 0.850
atom chem shift.val err: 0.020

1,51358,36
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 36
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
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atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 0.834
atom chem shift.val err: 0.020

1,51358,37
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 37
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
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atom chem shift.atom type: H
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 0.834
atom chem shift.val err: 0.020

1,51358,38
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 38
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 0.834
atom chem shift.val err: 0.020

1,51358,39
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 39
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 60.866
atom chem shift.val err: 0.3

1,51358,40
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 40
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 38.790
atom chem shift.val err: 0.3

1,51358,41
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 41
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
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atom chem shift.atom type: C
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 26.961
atom chem shift.val err: 0.3

1,51358,42
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 42
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 17.392
atom chem shift.val err: 0.3

1,51358,43
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 43
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 5
atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 12.901
atom chem shift.val err: 0.3

1,51358,44
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: ILE
atom chem shift.auth seq id: 5
atom chem shift.comp id: ILE
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 119.506
atom chem shift.val err: 0.3

1,51358,45
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: ASN
atom chem shift.auth seq id: 6
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 8.407
atom chem shift.val err: 0.020

1,51358,46
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 46
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 4.627
atom chem shift.val err: 0.020

1,51358,47
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 47
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 2.638
atom chem shift.val err: 0.020

1,51358,48
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 48
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 2.705
atom chem shift.val err: 0.020

1,51358,49
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 49
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 7.532
atom chem shift.val err: 0.020

1,51358,50
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 50
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 6.872
atom chem shift.val err: 0.020

1,51358,51
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 51
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 53.063
atom chem shift.val err: 0.3

1,51358,52
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 52
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 39.079
atom chem shift.val err: 0.3

1,51358,53
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 53
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 122.665
atom chem shift.val err: 0.3

1,51358,54
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 54
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: ND2
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 113.128
atom chem shift.val err: 0.3

1,51358,55
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 55
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
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atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 7.859
atom chem shift.val err: 0.020

1,51358,56
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 56
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 3.925
atom chem shift.val err: 0.020

1,51358,57
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 57
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 3.040
atom chem shift.val err: 0.020

1,51358,58
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 58
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 3.069
atom chem shift.val err: 0.020

1,51358,59
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 59
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 7
atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 57.345
atom chem shift.val err: 0.3

1,51358,60
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 60
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 7
atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 63.297
atom chem shift.val err: 0.3

1,51358,61
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 61
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 7
atom chem shift.comp id: SER
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 116.697
atom chem shift.val err: 0.3

1,51358,62
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 62
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 7.874
atom chem shift.val err: 0.020

1,51358,63
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 63
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 2.419
atom chem shift.val err: 0.020

1,51358,64
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 64
atom chem shift.ambiguity code: 2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 8
atom chem shift.comp id: ASP
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 2.610
atom chem shift.val err: 0.020

1,51358,65
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 65
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 40.015
atom chem shift.val err: 0.3

1,51358,66
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: ASP
atom chem shift.auth seq id: 8
atom chem shift.comp id: ASP
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 123.354
atom chem shift.val err: 0.3

1,51358,67
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 67
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 9
atom chem shift.comp id: PRO
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 4.437
atom chem shift.val err: 0.020

1,51358,68
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 68
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
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atom chem shift.val: 1.671
atom chem shift.val err: 0.020

1,51358,69
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.926
atom chem shift.val err: 0.020

1,51358,70
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.063
atom chem shift.val err: 0.020

1,51358,71
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 71
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.129
atom chem shift.val err: 0.020

1,51358,72
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 72
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atom chem shift.val: 3.622
atom chem shift.val err: 0.020

1,51358,73
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.925
atom chem shift.val err: 0.020

1,51358,74
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 63.340
atom chem shift.val err: 0.3

1,51358,75
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 32.099
atom chem shift.val err: 0.3

1,51358,76
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 27.306
atom chem shift.val err: 0.3

1,51358,77
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 50.432
atom chem shift.val err: 0.3

1,51358,78
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.208
atom chem shift.val err: 0.020

1,51358,79
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.181
atom chem shift.val err: 0.020

1,51358,80
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.610
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1,51358,81
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,82
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,83
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,84
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,85
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,86
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 0.901
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1,51358,87
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,88
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,89
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,90
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,91
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,92
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,93
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,94
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,95
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,96
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,97
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,98
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,99
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,100
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,101
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,102
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,103
type: atom chem shift
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1,51358,104
type: atom chem shift
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atom chem shift.seq id: 11
atom chem shift.val: 114.350
atom chem shift.val err: 0.3

1,51358,105
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.968
atom chem shift.val err: 0.020

1,51358,106
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 12
atom chem shift.val: 2.893
atom chem shift.val err: 0.020

1,51358,107
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.045
atom chem shift.val err: 0.020

1,51358,108
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 45.493
atom chem shift.val err: 0.3

1,51358,109
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
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atom chem shift.val: 106.995
atom chem shift.val err: 0.3

1,51358,110
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.816
atom chem shift.val err: 0.020

1,51358,111
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.436
atom chem shift.val err: 0.020

1,51358,112
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.231
atom chem shift.val err: 0.020

1,51358,113
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 43.875
atom chem shift.val err: 0.3

1,51358,114
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 111.806
atom chem shift.val err: 0.3

1,51358,115
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.215
atom chem shift.val err: 0.020

1,51358,116
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.020

1,51358,117
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.494
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1,51358,118
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.3

1,51358,119
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 121.930
atom chem shift.val err: 0.3

1,51358,120
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 127.244
atom chem shift.val err: 0.3

1,51358,121
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,122
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,123
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,124
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,125
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,126
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,127
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,128
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,129
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,130
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,131
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,132
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,133
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,134
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,135
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,136
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1,51358,137
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1,51358,138
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1,51358,139
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1,51358,140
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atom chem shift.val: 57.540
atom chem shift.val err: 0.3

1,51358,141
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 141
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 17
atom chem shift.comp id: TRP
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 17
atom chem shift.val: 120.356
atom chem shift.val err: 0.3

1,51358,142
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 142
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE1
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE1
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 17
atom chem shift.comp id: TRP
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 17
atom chem shift.val: 128.923
atom chem shift.val err: 0.3

1,51358,143
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 9.367
atom chem shift.val err: 0.020

1,51358,144
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 144
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 4.655
atom chem shift.val err: 0.020

1,51358,145
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 145
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
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atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 4.034
atom chem shift.val err: 0.020

1,51358,146
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 146
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 4.448
atom chem shift.val err: 0.020

1,51358,147
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 147
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 57.704
atom chem shift.val err: 0.3

1,51358,148
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 148
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 62.995
atom chem shift.val err: 0.3

1,51358,149
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 149
atom chem 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: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 119.810
atom chem shift.val err: 0.3

1,51358,150
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 150
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 4.428
atom chem shift.val err: 0.020

1,51358,151
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 151
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 1.772
atom chem shift.val err: 0.020

1,51358,152
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 152
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 2.440
atom chem shift.val err: 0.020

1,51358,153
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 153
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 1.994
atom chem shift.val err: 0.020

1,51358,154
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 154
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 2.068
atom chem shift.val err: 0.020

1,51358,155
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 155
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.648
atom chem shift.val err: 0.020

1,51358,156
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 156
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
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atom chem shift.atom type: H
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.845
atom chem shift.val err: 0.020

1,51358,157
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 157
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 62.807
atom chem shift.val err: 0.3

1,51358,158
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 158
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 31.864
atom chem shift.val err: 0.3

1,51358,159
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 159
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
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atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 19
atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 27.894
atom chem shift.val err: 0.3

1,51358,160
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 160
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
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atom chem shift.auth atom id: CD
atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 50.169
atom chem shift.val err: 0.3

1,51358,161
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 161
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
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atom chem shift.auth comp id: TRP
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atom chem shift.comp id: TRP
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 8.174
atom chem shift.val err: 0.020

1,51358,162
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 162
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.comp id: TRP
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 4.495
atom chem shift.val err: 0.020

1,51358,163
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 163
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
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atom chem shift.comp id: TRP
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 9.889
atom chem shift.val err: 0.020

1,51358,164
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 164
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.atom type: C
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atom chem shift.auth comp id: TRP
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atom chem shift.comp id: TRP
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 57.759
atom chem shift.val err: 0.3

1,51358,165
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 165
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 20
atom chem shift.comp id: TRP
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 124.030
atom chem shift.val err: 0.3

1,51358,166
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 166
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE1
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atom chem shift.atom type: N
atom chem shift.auth atom id: NE1
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atom chem shift.auth seq id: 20
atom chem shift.comp id: TRP
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 128.851
atom chem shift.val err: 0.3

1,51358,167
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 167
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 9.016
atom chem shift.val err: 0.020

1,51358,168
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 168
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 4.680
atom chem shift.val err: 0.020

1,51358,169
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 169
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 3.080
atom chem shift.val err: 0.020

1,51358,170
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 170
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 3.080
atom chem shift.val err: 0.020

1,51358,171
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 171
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 52.857
atom chem shift.val err: 0.3

1,51358,172
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 172
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atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 40.967
atom chem shift.val err: 0.3

1,51358,173
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 173
atom chem 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: 21
atom chem shift.comp id: ASP
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 123.689
atom chem shift.val err: 0.3

1,51358,174
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 174
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 7.958
atom chem shift.val err: 0.020

1,51358,175
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 175
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 3.942
atom chem shift.val err: 0.020

1,51358,176
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 176
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 1.792
atom chem shift.val err: 0.020

1,51358,177
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 177
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG12
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 1.291
atom chem shift.val err: 0.020

1,51358,178
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 178
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG13
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 1.563
atom chem shift.val err: 0.020

1,51358,179
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 179
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 0.991
atom chem shift.val err: 0.020

1,51358,180
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 180
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 0.991
atom chem shift.val err: 0.020

1,51358,181
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 181
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 0.991
atom chem shift.val err: 0.020

1,51358,182
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 182
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 0.886
atom chem shift.val err: 0.020

1,51358,183
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 183
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 0.886
atom chem shift.val err: 0.020

1,51358,184
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 184
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 0.886
atom chem shift.val err: 0.020

1,51358,185
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 185
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 61.471
atom chem shift.val err: 0.3

1,51358,186
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 186
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 38.238
atom chem shift.val err: 0.3

1,51358,187
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 187
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 27.777
atom chem shift.val err: 0.3

1,51358,188
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 188
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 17.263
atom chem shift.val err: 0.3

1,51358,189
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 189
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 12.771
atom chem shift.val err: 0.3

1,51358,190
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: ILE
atom chem shift.auth seq id: 22
atom chem shift.comp id: ILE
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 117.146
atom chem shift.val err: 0.3

1,51358,191
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: CYS
atom chem shift.auth seq id: 23
atom chem shift.comp id: CYS
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 8.649
atom chem shift.val err: 0.020

1,51358,192
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 192
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 23
atom chem shift.comp id: CYS
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 4.260
atom chem shift.val err: 0.020

1,51358,193
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 193
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 23
atom chem shift.comp id: CYS
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 57.093
atom chem shift.val err: 0.3

1,51358,194
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: CYS
atom chem shift.auth seq id: 23
atom chem shift.comp id: CYS
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 124.104
atom chem shift.val err: 0.3

1,51358,195
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 195
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 24
atom chem shift.comp id: SER
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 8.467
atom chem shift.val err: 0.020

1,51358,196
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 196
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 24
atom chem shift.comp id: SER
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 4.138
atom chem shift.val err: 0.020

1,51358,197
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 197
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 24
atom chem shift.comp id: SER
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 61.361
atom chem shift.val err: 0.3

1,51358,198
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: SER
atom chem shift.auth seq id: 24
atom chem shift.comp id: SER
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 123.435
atom chem shift.val err: 0.3

1,51358,199
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 6.969
atom chem shift.val err: 0.020

1,51358,200
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 200
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 4.891
atom chem shift.val err: 0.020

1,51358,201
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 201
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 2.408
atom chem shift.val err: 0.020

1,51358,202
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 202
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 0.491
atom chem shift.val err: 0.020

1,51358,203
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 203
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 0.491
atom chem shift.val err: 0.020

1,51358,204
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 204
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 0.491
atom chem shift.val err: 0.020

1,51358,205
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 205
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 1.005
atom chem shift.val err: 0.020

1,51358,206
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 206
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 1.005
atom chem shift.val err: 0.020

1,51358,207
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 207
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 1.005
atom chem shift.val err: 0.020

1,51358,208
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 208
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 58.978
atom chem shift.val err: 0.3

1,51358,209
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 209
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 36.797
atom chem shift.val err: 0.3

1,51358,210
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 210
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 18.628
atom chem shift.val err: 0.3

1,51358,211
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 211
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 22.244
atom chem shift.val err: 0.3

1,51358,212
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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: VAL
atom chem shift.auth seq id: 25
atom chem shift.comp id: VAL
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: 111.202
atom chem shift.val err: 0.3

1,51358,213
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.entry id: 51358
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atom chem shift.seq id: 26
atom chem shift.val: 9.429
atom chem shift.val err: 0.020

1,51358,214
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.440
atom chem shift.val err: 0.020

1,51358,215
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.453
atom chem shift.val err: 0.020

1,51358,216
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.170
atom chem shift.val err: 0.020

1,51358,217
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.020

1,51358,218
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.020

1,51358,219
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 61.352
atom chem shift.val err: 0.3

1,51358,220
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 71.282
atom chem shift.val err: 0.3

1,51358,221
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 16.943
atom chem shift.val err: 0.3

1,51358,222
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: THR
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
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atom chem shift.val: 107.869
atom chem shift.val err: 0.3

1,51358,223
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.633
atom chem shift.val err: 0.020

1,51358,224
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.991
atom chem shift.val err: 0.020

1,51358,225
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.646
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1,51358,226
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 44.297
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1,51358,227
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 113.376
atom chem shift.val err: 0.3

1,51358,228
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.178
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1,51358,229
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 3.778
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1,51358,230
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,231
type: atom chem shift
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1,51358,232
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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1,51358,233
type: atom chem shift
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1,51358,234
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1,51358,235
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,236
type: atom chem shift
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1,51358,237
type: atom chem shift
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1,51358,238
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,239
type: atom chem shift
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1,51358,240
type: atom chem shift
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1,51358,241
type: atom chem shift
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1,51358,242
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: GLY
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 115.625
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1,51358,243
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,244
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 5.235
atom chem shift.val err: 0.020

1,51358,245
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: VAL
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atom chem shift.val: 1.934
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1,51358,246
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,247
type: atom chem shift
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atom chem shift.val: 0.848
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1,51358,248
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 0.848
atom chem shift.val err: 0.020

1,51358,249
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.id: 249
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 0.838
atom chem shift.val err: 0.020

1,51358,250
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 250
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 0.838
atom chem shift.val err: 0.020

1,51358,251
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 251
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 0.838
atom chem shift.val err: 0.020

1,51358,252
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 252
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 60.168
atom chem shift.val err: 0.3

1,51358,253
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 253
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 36.446
atom chem shift.val err: 0.3

1,51358,254
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 254
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 20.016
atom chem shift.val err: 0.3

1,51358,255
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 255
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 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: 21.085
atom chem shift.val err: 0.3

1,51358,256
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 256
atom chem 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: 117.351
atom chem shift.val err: 0.3

1,51358,257
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 257
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 8.584
atom chem shift.val err: 0.020

1,51358,258
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 258
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HA
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 5.048
atom chem shift.val err: 0.020

1,51358,259
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 259
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 7.790
atom chem shift.val err: 0.020

1,51358,260
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 260
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 6.802
atom chem shift.val err: 0.020

1,51358,261
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 261
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 53.787
atom chem shift.val err: 0.3

1,51358,262
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 262
atom chem 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: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 120.681
atom chem shift.val err: 0.3

1,51358,263
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 263
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 32
atom chem shift.comp id: GLN
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 110.932
atom chem shift.val err: 0.3

1,51358,264
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 264
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 33
atom chem shift.val: 8.839
atom chem shift.val err: 0.020

1,51358,265
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 265
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 6.040
atom chem shift.val err: 0.020

1,51358,266
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 266
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.853
atom chem shift.val err: 0.020

1,51358,267
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
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atom chem shift.val: 1.853
atom chem shift.val err: 0.020

1,51358,268
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 33
atom chem shift.val: 1.352
atom chem shift.val err: 0.020

1,51358,269
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.557
atom chem shift.val err: 0.020

1,51358,270
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: LYS
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atom chem shift.val: 1.627
atom chem shift.val err: 0.020

1,51358,271
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 271
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 33
atom chem shift.val: 1.627
atom chem shift.val err: 0.020

1,51358,272
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 272
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 33
atom chem shift.val: 2.970
atom chem shift.val err: 0.020

1,51358,273
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.970
atom chem shift.val err: 0.020

1,51358,274
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 274
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 33
atom chem shift.val: 54.960
atom chem shift.val err: 0.3

1,51358,275
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
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atom chem shift.val: 37.220
atom chem shift.val err: 0.3

1,51358,276
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 24.038
atom chem shift.val err: 0.3

1,51358,277
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 277
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 29.619
atom chem shift.val err: 0.3

1,51358,278
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 278
atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: CE
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 42.073
atom chem shift.val err: 0.3

1,51358,279
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 279
atom chem 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: 33
atom chem shift.comp id: LYS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 120.201
atom chem shift.val err: 0.3

1,51358,280
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 280
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 8.473
atom chem shift.val err: 0.020

1,51358,281
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 281
atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 4.550
atom chem shift.val err: 0.020

1,51358,282
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 282
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 54.488
atom chem shift.val err: 0.3

1,51358,283
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 283
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 33.060
atom chem shift.val err: 0.3

1,51358,284
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 284
atom chem 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: 34
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 117.526
atom chem shift.val err: 0.3

1,51358,285
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 8.578
atom chem shift.val err: 0.020

1,51358,286
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 5.993
atom chem shift.val err: 0.020

1,51358,287
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.864
atom chem shift.val err: 0.020

1,51358,288
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.864
atom chem shift.val err: 0.020

1,51358,289
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 57.638
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1,51358,290
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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1,51358,291
type: atom chem shift
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1,51358,292
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,293
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 32.727
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1,51358,294
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 118.052
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1,51358,295
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,296
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,297
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,298
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,299
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,300
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,301
type: atom chem shift
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1,51358,302
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,303
type: atom chem shift
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1,51358,304
type: atom chem shift
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1,51358,305
type: atom chem shift
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1,51358,306
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1,51358,307
type: atom chem shift
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1,51358,308
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,309
type: atom chem shift
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1,51358,310
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,311
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of datablock: info:bmrb/51358
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1,51358,312
type: atom chem shift
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1,51358,313
type: atom chem shift
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1,51358,314
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,315
type: atom chem shift
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1,51358,316
type: atom chem shift
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1,51358,317
type: atom chem shift
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1,51358,318
type: atom chem shift
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1,51358,319
type: atom chem shift
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1,51358,320
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1,51358,321
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atom chem shift.val: 6.592
atom chem shift.val err: 0.020

1,51358,322
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.508
atom chem shift.val err: 0.020

1,51358,323
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 50.942
atom chem shift.val err: 0.3

1,51358,324
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 38.759
atom chem shift.val err: 0.3

1,51358,325
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,326
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,327
type: atom chem shift
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1,51358,328
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val err: 0.020

1,51358,329
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.020

1,51358,330
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,331
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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1,51358,332
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,333
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,334
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,335
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,336
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,337
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1,51358,338
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,339
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,340
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1,51358,341
type: atom chem shift
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1,51358,342
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,343
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,344
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,345
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1,51358,346
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,347
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1,51358,348
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1,51358,350
type: atom chem shift
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1,51358,351
type: atom chem shift
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1,51358,352
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1,51358,353
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of datablock: info:bmrb/51358
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1,51358,354
type: atom chem shift
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1,51358,355
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atom chem shift.val: 1.536
atom chem shift.val err: 0.020

1,51358,358
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 1.839
atom chem shift.val err: 0.020

1,51358,359
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 1.793
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1,51358,360
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,361
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of datablock: info:bmrb/51358
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1,51358,362
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of datablock: info:bmrb/51358
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1,51358,363
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1,51358,364
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,365
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,366
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,367
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,368
type: atom chem shift
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1,51358,369
type: atom chem shift
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1,51358,370
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1,51358,371
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1,51358,372
type: atom chem shift
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1,51358,373
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1,51358,374
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1,51358,375
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1,51358,376
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1,51358,377
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1,51358,378
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1,51358,379
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1,51358,380
type: atom chem shift
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1,51358,381
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1,51358,382
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1,51358,383
type: atom chem shift
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1,51358,384
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1,51358,385
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1,51358,386
type: atom chem shift
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1,51358,387
type: atom chem shift
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1,51358,388
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1,51358,389
type: atom chem shift
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1,51358,390
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1,51358,391
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1,51358,392
type: atom chem shift
of datablock: info:bmrb/51358
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1,51358,393
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atom chem shift.id: 393
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 47
atom chem shift.comp id: GLY
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: 3.768
atom chem shift.val err: 0.020

1,51358,394
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 394
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 47
atom chem shift.comp id: GLY
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: 3.921
atom chem shift.val err: 0.020

1,51358,395
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 395
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 47
atom chem shift.comp id: GLY
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: 44.002
atom chem shift.val err: 0.3

1,51358,396
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 396
atom chem 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: 47
atom chem shift.comp id: GLY
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: 106.457
atom chem shift.val err: 0.3

1,51358,397
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 397
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: 48
atom chem shift.comp id: LYS
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: 8.500
atom chem shift.val err: 0.020

1,51358,398
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 398
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 4.074
atom chem shift.val err: 0.020

1,51358,399
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 399
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 1.501
atom chem shift.val err: 0.020

1,51358,400
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 400
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 1.811
atom chem shift.val err: 0.020

1,51358,401
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 401
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 1.499
atom chem shift.val err: 0.020

1,51358,402
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 402
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 1.499
atom chem shift.val err: 0.020

1,51358,403
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 403
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 1.596
atom chem shift.val err: 0.020

1,51358,404
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 404
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 1.649
atom chem shift.val err: 0.020

1,51358,405
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 405
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 2.962
atom chem shift.val err: 0.020

1,51358,406
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 406
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 2.962
atom chem shift.val err: 0.020

1,51358,407
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 407
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 56.444
atom chem shift.val err: 0.3

1,51358,408
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 408
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 33.339
atom chem shift.val err: 0.3

1,51358,409
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 409
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 24.976
atom chem shift.val err: 0.3

1,51358,410
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 410
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 29.007
atom chem shift.val err: 0.3

1,51358,411
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 411
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 48
atom chem shift.comp id: LYS
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: 42.059
atom chem shift.val err: 0.3

1,51358,412
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 412
atom chem 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: 48
atom chem shift.comp id: LYS
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: 120.192
atom chem shift.val err: 0.3

1,51358,413
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 413
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: 8.191
atom chem shift.val err: 0.020

1,51358,414
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 414
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 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: 4.360
atom chem shift.val err: 0.020

1,51358,415
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 415
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 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: 2.500
atom chem shift.val err: 0.020

1,51358,416
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 416
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 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: 2.581
atom chem shift.val err: 0.020

1,51358,417
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 417
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 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: 53.472
atom chem shift.val err: 0.3

1,51358,418
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 418
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 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: 41.012
atom chem shift.val err: 0.3

1,51358,419
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 419
atom chem 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: 120.655
atom chem shift.val err: 0.3

1,51358,420
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 420
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: 50
atom chem shift.comp id: CYS
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: 8.262
atom chem shift.val err: 0.020

1,51358,421
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 421
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 50
atom chem shift.comp id: CYS
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: 3.763
atom chem shift.val err: 0.020

1,51358,422
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 422
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 50
atom chem shift.comp id: CYS
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: 0.532
atom chem shift.val err: 0.020

1,51358,423
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 423
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 50
atom chem shift.comp id: CYS
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: 1.294
atom chem shift.val err: 0.020

1,51358,424
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 424
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 50
atom chem shift.comp id: CYS
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: 61.009
atom chem shift.val err: 0.3

1,51358,425
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 425
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 50
atom chem shift.comp id: CYS
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: 35.883
atom chem shift.val err: 0.3

1,51358,426
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 426
atom chem 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: 50
atom chem shift.comp id: CYS
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: 119.266
atom chem shift.val err: 0.3

1,51358,427
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 427
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: 51
atom chem shift.comp id: VAL
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: 8.359
atom chem shift.val err: 0.020

1,51358,428
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 428
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
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: 4.128
atom chem shift.val err: 0.020

1,51358,429
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 429
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.982
atom chem shift.val err: 0.020

1,51358,430
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 430
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.944
atom chem shift.val err: 0.020

1,51358,431
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 431
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.944
atom chem shift.val err: 0.020

1,51358,432
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 432
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.944
atom chem shift.val err: 0.020

1,51358,433
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 433
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.944
atom chem shift.val err: 0.020

1,51358,434
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 434
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.944
atom chem shift.val err: 0.020

1,51358,435
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 435
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.944
atom chem shift.val err: 0.020

1,51358,436
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 436
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
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: 62.451
atom chem shift.val err: 0.3

1,51358,437
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 437
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
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: 33.068
atom chem shift.val err: 0.3

1,51358,438
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 438
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
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: 20.951
atom chem shift.val err: 0.3

1,51358,439
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 439
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 51
atom chem shift.comp id: VAL
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: 20.951
atom chem shift.val err: 0.3

1,51358,440
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 440
atom chem 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: 51
atom chem shift.comp id: VAL
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: 122.398
atom chem shift.val err: 0.3

1,51358,441
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 441
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: 52
atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 9.010
atom chem shift.val err: 0.020

1,51358,442
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 442
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 52
atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 3.895
atom chem shift.val err: 0.020

1,51358,443
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 443
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 52
atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 4.741
atom chem shift.val err: 0.020

1,51358,444
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 444
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 52
atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 43.069
atom chem shift.val err: 0.3

1,51358,445
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 445
atom chem 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: 52
atom chem shift.comp id: GLY
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 117.878
atom chem shift.val err: 0.3

1,51358,446
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 446
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: 53
atom chem shift.comp id: ASP
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: 8.600
atom chem shift.val err: 0.020

1,51358,447
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 447
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASP
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: 4.805
atom chem shift.val err: 0.020

1,51358,448
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 448
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASP
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: 2.577
atom chem shift.val err: 0.020

1,51358,449
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 449
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASP
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: 3.023
atom chem shift.val err: 0.020

1,51358,450
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 450
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASP
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: 54.654
atom chem shift.val err: 0.3

1,51358,451
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 451
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASP
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: 41.802
atom chem shift.val err: 0.3

1,51358,452
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 452
atom chem 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: 53
atom chem shift.comp id: ASP
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: 118.546
atom chem shift.val err: 0.3

1,51358,453
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 453
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: 54
atom chem shift.comp id: VAL
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: 8.474
atom chem shift.val err: 0.020

1,51358,454
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 454
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 3.687
atom chem shift.val err: 0.020

1,51358,455
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 455
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 2.480
atom chem shift.val err: 0.020

1,51358,456
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 456
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 1.237
atom chem shift.val err: 0.020

1,51358,457
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 457
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 1.237
atom chem shift.val err: 0.020

1,51358,458
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 458
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 1.237
atom chem shift.val err: 0.020

1,51358,459
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 459
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 1.315
atom chem shift.val err: 0.020

1,51358,460
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 460
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 1.315
atom chem shift.val err: 0.020

1,51358,461
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 461
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 1.315
atom chem shift.val err: 0.020

1,51358,462
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 462
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 62.971
atom chem shift.val err: 0.3

1,51358,463
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 463
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 32.766
atom chem shift.val err: 0.3

1,51358,464
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 464
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 20.688
atom chem shift.val err: 0.3

1,51358,465
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 465
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 54
atom chem shift.comp id: VAL
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: 21.743
atom chem shift.val err: 0.3

1,51358,466
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 466
atom chem 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: 54
atom chem shift.comp id: VAL
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: 116.356
atom chem shift.val err: 0.3

1,51358,467
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 467
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: 55
atom chem shift.comp id: THR
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: 7.345
atom chem shift.val err: 0.020

1,51358,468
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 468
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 5.583
atom chem shift.val err: 0.020

1,51358,469
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 469
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 4.028
atom chem shift.val err: 0.020

1,51358,470
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 470
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 1.215
atom chem shift.val err: 0.020

1,51358,471
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 471
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 1.215
atom chem shift.val err: 0.020

1,51358,472
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 472
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 1.215
atom chem shift.val err: 0.020

1,51358,473
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 473
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 59.611
atom chem shift.val err: 0.3

1,51358,474
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 474
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 72.410
atom chem shift.val err: 0.3

1,51358,475
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 475
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 55
atom chem shift.comp id: THR
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: 21.842
atom chem shift.val err: 0.3

1,51358,476
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 476
atom chem 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: 55
atom chem shift.comp id: THR
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: 109.555
atom chem shift.val err: 0.3

1,51358,477
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 477
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: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 8.413
atom chem shift.val err: 0.020

1,51358,478
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 478
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 4.529
atom chem shift.val err: 0.020

1,51358,479
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 479
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 1.299
atom chem shift.val err: 0.020

1,51358,480
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 480
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 1.524
atom chem shift.val err: 0.020

1,51358,481
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 481
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 1.866
atom chem shift.val err: 0.020

1,51358,482
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 482
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 1.925
atom chem shift.val err: 0.020

1,51358,483
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 483
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 54.878
atom chem shift.val err: 0.3

1,51358,484
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 484
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 34.213
atom chem shift.val err: 0.3

1,51358,485
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 485
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 36.136
atom chem shift.val err: 0.3

1,51358,486
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 486
atom chem 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: 56
atom chem shift.comp id: GLU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 121.814
atom chem shift.val err: 0.3

1,51358,487
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 487
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: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 8.500
atom chem shift.val err: 0.020

1,51358,488
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 488
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 6.039
atom chem shift.val err: 0.020

1,51358,489
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 489
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 2.542
atom chem shift.val err: 0.020

1,51358,490
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 490
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 2.607
atom chem shift.val err: 0.020

1,51358,491
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 491
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 7.269
atom chem shift.val err: 0.020

1,51358,492
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 492
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 6.670
atom chem shift.val err: 0.020

1,51358,493
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 493
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 51.824
atom chem shift.val err: 0.3

1,51358,494
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 494
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 42.808
atom chem shift.val err: 0.3

1,51358,495
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 495
atom chem 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: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 117.798
atom chem shift.val err: 0.3

1,51358,496
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 496
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: ND2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASN
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 111.711
atom chem shift.val err: 0.3

1,51358,497
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 497
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: 58
atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 8.765
atom chem shift.val err: 0.020

1,51358,498
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 498
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 58
atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 4.630
atom chem shift.val err: 0.020

1,51358,499
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 499
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 58
atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 1.358
atom chem shift.val err: 0.020

1,51358,500
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 500
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 58
atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 1.534
atom chem shift.val err: 0.020

1,51358,501
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 501
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 0.994
atom chem shift.val err: 0.020

1,51358,502
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 502
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 1.466
atom chem shift.val err: 0.020

1,51358,503
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 503
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 6.208
atom chem shift.val err: 0.020

1,51358,504
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 504
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 5.443
atom chem shift.val err: 0.020

1,51358,505
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
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atom chem shift.val: 54.144
atom chem shift.val err: 0.3

1,51358,506
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 506
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 58
atom chem shift.val: 31.368
atom chem shift.val err: 0.3

1,51358,507
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 507
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 30.891
atom chem shift.val err: 0.3

1,51358,508
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 508
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.auth seq id: 58
atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 117.863
atom chem shift.val err: 0.3

1,51358,509
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 509
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 107.916
atom chem shift.val err: 0.3

1,51358,510
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 510
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 8.078
atom chem shift.val err: 0.020

1,51358,511
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 511
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 4.674
atom chem shift.val err: 0.020

1,51358,512
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 512
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atom chem shift.comp id: ILE
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 1.633
atom chem shift.val err: 0.020

1,51358,513
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 513
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atom chem shift.comp id: ILE
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 1.172
atom chem shift.val err: 0.020

1,51358,514
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 514
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 1.561
atom chem shift.val err: 0.020

1,51358,515
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.864
atom chem shift.val err: 0.020

1,51358,516
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.864
atom chem shift.val err: 0.020

1,51358,517
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 0.864
atom chem shift.val err: 0.020

1,51358,518
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 0.812
atom chem shift.val err: 0.020

1,51358,519
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.812
atom chem shift.val err: 0.020

1,51358,520
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.812
atom chem shift.val err: 0.020

1,51358,521
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 60.508
atom chem shift.val err: 0.3

1,51358,522
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 37.766
atom chem shift.val err: 0.3

1,51358,523
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 28.028
atom chem shift.val err: 0.3

1,51358,524
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.seq id: 59
atom chem shift.val: 17.467
atom chem shift.val err: 0.3

1,51358,525
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 12.713
atom chem shift.val err: 0.3

1,51358,526
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
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atom chem shift.val: 122.158
atom chem shift.val err: 0.3

1,51358,527
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: CYS
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atom chem shift.val err: 0.020

1,51358,528
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: CYS
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atom chem shift.val: 4.742
atom chem shift.val err: 0.020

1,51358,529
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: CYS
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atom chem shift.val: 52.537
atom chem shift.val err: 0.3

1,51358,530
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 60
atom chem shift.val: 120.462
atom chem shift.val err: 0.3

1,51358,531
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: ASN
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atom chem shift.val: 8.985
atom chem shift.val err: 0.020

1,51358,532
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.630
atom chem shift.val err: 0.020

1,51358,533
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.881
atom chem shift.val err: 0.020

1,51358,534
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val err: 0.020

1,51358,535
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.val: 53.531
atom chem shift.val err: 0.3

1,51358,536
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
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atom chem shift.val: 117.426
atom chem shift.val err: 0.3

1,51358,537
type: atom chem shift
of datablock: info:bmrb/51358
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atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: ND2
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 113.850
atom chem shift.val err: 0.3

1,51358,538
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 538
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: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 8.299
atom chem shift.val err: 0.020

1,51358,539
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 539
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 3.556
atom chem shift.val err: 0.020

1,51358,540
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 540
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.616
atom chem shift.val err: 0.020

1,51358,541
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 541
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.650
atom chem shift.val err: 0.020

1,51358,542
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 542
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.216
atom chem shift.val err: 0.020

1,51358,543
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 543
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.345
atom chem shift.val err: 0.020

1,51358,544
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 544
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.553
atom chem shift.val err: 0.020

1,51358,545
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 545
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 1.553
atom chem shift.val err: 0.020

1,51358,546
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 546
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 2.866
atom chem shift.val err: 0.020

1,51358,547
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 547
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 2.866
atom chem shift.val err: 0.020

1,51358,548
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 548
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 57.044
atom chem shift.val err: 0.3

1,51358,549
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 549
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 33.068
atom chem shift.val err: 0.3

1,51358,550
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 550
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 24.986
atom chem shift.val err: 0.3

1,51358,551
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 551
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 29.170
atom chem shift.val err: 0.3

1,51358,552
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 552
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 41.672
atom chem shift.val err: 0.3

1,51358,553
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 553
atom chem 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: 62
atom chem shift.comp id: LYS
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 115.226
atom chem shift.val err: 0.3

1,51358,554
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 554
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: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 8.764
atom chem shift.val err: 0.020

1,51358,555
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 555
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 4.166
atom chem shift.val err: 0.020

1,51358,556
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 556
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 2.047
atom chem shift.val err: 0.020

1,51358,557
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 557
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 2.161
atom chem shift.val err: 0.020

1,51358,558
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 558
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 2.369
atom chem shift.val err: 0.020

1,51358,559
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 559
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 2.536
atom chem shift.val err: 0.020

1,51358,560
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 560
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
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atom chem shift.auth comp id: GLN
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 7.633
atom chem shift.val err: 0.020

1,51358,561
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 561
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
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atom chem shift.auth comp id: GLN
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 6.522
atom chem shift.val err: 0.020

1,51358,562
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 562
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 55.586
atom chem shift.val err: 0.3

1,51358,563
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 563
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 26.910
atom chem shift.val err: 0.3

1,51358,564
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 564
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
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atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 32.057
atom chem shift.val err: 0.3

1,51358,565
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 565
atom chem 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: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 121.094
atom chem shift.val err: 0.3

1,51358,566
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 566
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 63
atom chem shift.comp id: GLN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 110.434
atom chem shift.val err: 0.3

1,51358,567
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 567
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 64
atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 8.486
atom chem shift.val err: 0.020

1,51358,568
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 568
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 64
atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 4.394
atom chem shift.val err: 0.020

1,51358,569
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 569
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 64
atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 2.442
atom chem shift.val err: 0.020

1,51358,570
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 570
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 2.662
atom chem shift.val err: 0.020

1,51358,571
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 571
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.auth seq id: 64
atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 54.937
atom chem shift.val err: 0.3

1,51358,572
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 572
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atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 40.541
atom chem shift.val err: 0.3

1,51358,573
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 573
atom chem 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: 64
atom chem shift.comp id: ASP
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 121.757
atom chem shift.val err: 0.3

1,51358,574
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 574
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: 65
atom chem shift.comp id: CYS
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 9.074
atom chem shift.val err: 0.020

1,51358,575
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 575
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 65
atom chem shift.comp id: CYS
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 2.726
atom chem shift.val err: 0.020

1,51358,576
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 576
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 65
atom chem shift.comp id: CYS
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 3.321
atom chem shift.val err: 0.020

1,51358,577
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 577
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 65
atom chem shift.comp id: CYS
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 39.697
atom chem shift.val err: 0.3

1,51358,578
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 578
atom chem 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: 65
atom chem shift.comp id: CYS
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 65
atom chem shift.val: 120.106
atom chem shift.val err: 0.3

1,51358,579
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 579
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 4.411
atom chem shift.val err: 0.020

1,51358,580
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 580
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 1.795
atom chem shift.val err: 0.020

1,51358,581
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 581
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.285
atom chem shift.val err: 0.020

1,51358,582
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 582
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.035
atom chem shift.val err: 0.020

1,51358,583
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 583
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 2.035
atom chem shift.val err: 0.020

1,51358,584
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 584
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 3.653
atom chem shift.val err: 0.020

1,51358,585
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 585
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 3.979
atom chem shift.val err: 0.020

1,51358,586
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 586
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 63.078
atom chem shift.val err: 0.3

1,51358,587
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 587
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 32.016
atom chem shift.val err: 0.3

1,51358,588
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 588
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
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atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 27.253
atom chem shift.val err: 0.3

1,51358,589
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 589
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
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atom chem shift.atom type: C
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 66
atom chem shift.comp id: PRO
atom chem shift.comp index id: 66
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 66
atom chem shift.val: 50.499
atom chem shift.val err: 0.3

1,51358,590
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 590
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: 67
atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 8.311
atom chem shift.val err: 0.020

1,51358,591
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 591
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 67
atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 4.067
atom chem shift.val err: 0.020

1,51358,592
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 592
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 1.786
atom chem shift.val err: 0.020

1,51358,593
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 593
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 1.147
atom chem shift.val err: 0.020

1,51358,594
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 594
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG13
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 1.470
atom chem shift.val err: 0.020

1,51358,595
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 595
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 0.831
atom chem shift.val err: 0.020

1,51358,596
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 596
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 0.831
atom chem shift.val err: 0.020

1,51358,597
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 597
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 0.831
atom chem shift.val err: 0.020

1,51358,598
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 0.823
atom chem shift.val err: 0.020

1,51358,599
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 599
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 0.823
atom chem shift.val err: 0.020

1,51358,600
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 600
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 0.823
atom chem shift.val err: 0.020

1,51358,601
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 601
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 67
atom chem shift.val: 60.954
atom chem shift.val err: 0.3

1,51358,602
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 602
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 38.486
atom chem shift.val err: 0.3

1,51358,603
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 603
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 27.179
atom chem shift.val err: 0.3

1,51358,604
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.val: 17.424
atom chem shift.val err: 0.3

1,51358,605
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.val: 12.724
atom chem shift.val err: 0.3

1,51358,606
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 606
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 67
atom chem shift.comp id: ILE
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 67
atom chem shift.val: 122.119
atom chem shift.val err: 0.3

1,51358,607
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.317
atom chem shift.val err: 0.020

1,51358,608
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.337
atom chem shift.val err: 0.020

1,51358,609
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 609
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 1.457
atom chem shift.val err: 0.020

1,51358,610
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 610
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 1.534
atom chem shift.val err: 0.020

1,51358,611
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 611
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 1.515
atom chem shift.val err: 0.020

1,51358,612
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 612
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 0.803
atom chem shift.val err: 0.020

1,51358,613
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 613
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 0.803
atom chem shift.val err: 0.020

1,51358,614
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 614
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 0.803
atom chem shift.val err: 0.020

1,51358,615
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 615
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 0.870
atom chem shift.val err: 0.020

1,51358,616
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 616
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 0.870
atom chem shift.val err: 0.020

1,51358,617
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 617
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD23
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 0.870
atom chem shift.val err: 0.020

1,51358,618
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 618
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 54.719
atom chem shift.val err: 0.3

1,51358,619
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 619
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 42.332
atom chem shift.val err: 0.3

1,51358,620
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 620
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 26.852
atom chem shift.val err: 0.3

1,51358,621
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 621
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 23.417
atom chem shift.val err: 0.3

1,51358,622
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 622
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 24.756
atom chem shift.val err: 0.3

1,51358,623
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 623
atom chem 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: 68
atom chem shift.comp id: LEU
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 68
atom chem shift.val: 127.080
atom chem shift.val err: 0.3

1,51358,624
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 624
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: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 8.284
atom chem shift.val err: 0.020

1,51358,625
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 625
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 4.183
atom chem shift.val err: 0.020

1,51358,626
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 626
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 1.832
atom chem shift.val err: 0.020

1,51358,627
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 627
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 1.867
atom chem shift.val err: 0.020

1,51358,628
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 628
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 2.111
atom chem shift.val err: 0.020

1,51358,629
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 629
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 2.169
atom chem shift.val err: 0.020

1,51358,630
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 630
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 56.248
atom chem shift.val err: 0.3

1,51358,631
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 631
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 30.442
atom chem shift.val err: 0.3

1,51358,632
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 632
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 36.025
atom chem shift.val err: 0.3

1,51358,633
type: atom chem shift
of datablock: info:bmrb/51358
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51358
atom chem shift.id: 633
atom chem 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: 69
atom chem shift.comp id: GLU
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 122.042
atom chem shift.val err: 0.3

1,51358,1
type: bond
of datablock: info:bmrb/51358
bond.assembly id: 1
bond.entry id: 51358
bond.id: 1
bond.atom id 1: OG1
bond.atom id 2: C1
bond.comp id 1: THR
bond.comp id 2: FUC
bond.comp index id 1: 26
bond.comp index id 2: 1
bond.entity assembly id 1: 1
bond.entity assembly id 2: 2
bond.entity assembly name 1: TSR3
bond.entity assembly name 2: fucose
bond.entity id 1: 1
bond.entity id 2: 2
bond.seq id 1: 26
bond.seq id 2: 1
bond.type: covalent
bond.value order: sing

1,51358,2
type: bond
of datablock: info:bmrb/51358
bond.assembly id: 1
bond.entry id: 51358
bond.id: 2
bond.atom id 1: O3
bond.atom id 2: C1
bond.comp id 1: FUC
bond.comp id 2: BGC
bond.comp index id 1: 1
bond.comp index id 2: 1
bond.entity assembly id 1: 2
bond.entity assembly id 2: 3
bond.entity assembly name 1: fucose
bond.entity assembly name 2: glucose
bond.entity id 1: 2
bond.entity id 2: 3
bond.seq id 1: 1
bond.seq id 2: 1
bond.type: covalent
bond.value order: sing

1,51358,3
type: bond
of datablock: info:bmrb/51358
bond.assembly id: 1
bond.entry id: 51358
bond.id: 3
bond.atom id 1: SG
bond.atom id 2: SG
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 23
bond.comp index id 2: 60
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity assembly name 1: TSR3
bond.entity assembly name 2: TSR3
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 23
bond.seq id 2: 60
bond.type: disulfide
bond.value order: sing

1,51358,4
type: bond
of datablock: info:bmrb/51358
bond.assembly id: 1
bond.entry id: 51358
bond.id: 4
bond.atom id 1: SG
bond.atom id 2: SG
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 27
bond.comp index id 2: 65
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity assembly name 1: TSR3
bond.entity assembly name 2: TSR3
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 27
bond.seq id 2: 65
bond.type: disulfide
bond.value order: sing

1,51358,5
type: bond
of datablock: info:bmrb/51358
bond.assembly id: 1
bond.entry id: 51358
bond.id: 5
bond.atom id 1: SG
bond.atom id 2: SG
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 38
bond.comp index id 2: 50
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity assembly name 1: TSR3
bond.entity assembly name 2: TSR3
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 38
bond.seq id 2: 50
bond.type: disulfide
bond.value order: sing

51358,FUC
type: chem comp
of datablock: info:bmrb/51358
reference to entry: entry
chem comp.entry id: 51358
chem comp.id: FUC
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: FUC
chem comp.formal charge: 0
chem comp.formula: C6 H12 O5
chem comp.formula weight: 164.156
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6+/m0/s1
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates db code: 1AX0
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.name: ALPHA-L-FUCOSE
chem comp.number atoms all: 23
chem comp.number atoms nh: 11
chem comp.pdb code: FUC
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_FUC
chem comp.three letter code: FUC
chem comp.type: OTHER

info:pdb-ccd/FUC

pdb-ccd:FUC

info:pdb.ligand/FUC

pdb.ligand:FUC

51358,BGC
type: chem comp
of datablock: info:bmrb/51358
reference to entry: entry
chem comp.entry id: 51358
chem comp.id: BGC
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: BGC
chem comp.formal charge: 0
chem comp.formula: C6 H12 O6
chem comp.formula weight: 180.156
chem comp.ideal coordinates details: Corina
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates db code: 1GU3
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.name: BETA-D-GLUCOSE
chem comp.number atoms all: 24
chem comp.number atoms nh: 12
chem comp.pdb code: BGC
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_BGC
chem comp.three letter code: BGC
chem comp.type: OTHER

info:pdb-ccd/BGC

pdb-ccd:BGC

info:pdb.ligand/BGC

pdb.ligand:BGC

C1,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C1
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -7.415
chem comp atom.model cartn x ideal: 1.410
chem comp atom.model cartn y: -4.708
chem comp atom.model cartn y ideal: 0.468
chem comp atom.model cartn z: 4.071
chem comp atom.model cartn z ideal: -0.410
chem comp atom.pdb atom id: C1
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: R
chem comp atom.type symbol: C

C2,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C2
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -7.978
chem comp atom.model cartn x ideal: 0.120
chem comp atom.model cartn y: -3.315
chem comp atom.model cartn y ideal: 0.513
chem comp atom.model cartn z: 4.329
chem comp atom.model cartn z ideal: -1.233
chem comp atom.pdb atom id: C2
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: S
chem comp atom.type symbol: C

C3,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C3
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -8.027
chem comp atom.model cartn x ideal: -0.831
chem comp atom.model cartn y: -2.528
chem comp atom.model cartn y ideal: -0.576
chem comp atom.model cartn z: 3.024
chem comp atom.model cartn z ideal: -0.728
chem comp atom.pdb atom id: C3
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: R
chem comp atom.type symbol: C

C4,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C4
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -8.835
chem comp atom.model cartn x ideal: -1.016
chem comp atom.model cartn y: -3.301
chem comp atom.model cartn y ideal: -0.402
chem comp atom.model cartn z: 1.987
chem comp atom.model cartn z ideal: 0.783
chem comp atom.pdb atom id: C4
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: S
chem comp atom.type symbol: C

C5,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C5
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -8.262
chem comp atom.model cartn x ideal: 0.359
chem comp atom.model cartn y: -4.708
chem comp atom.model cartn y ideal: -0.379
chem comp atom.model cartn z: 1.820
chem comp atom.model cartn z ideal: 1.454
chem comp atom.pdb atom id: C5
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: S
chem comp atom.type symbol: C

C6,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C6
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -9.101
chem comp atom.model cartn x ideal: 0.185
chem comp atom.model cartn y: -5.570
chem comp atom.model cartn y ideal: -0.241
chem comp atom.model cartn z: 0.898
chem comp atom.model cartn z ideal: 2.967
chem comp atom.pdb atom id: C6
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O1,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O1
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: O1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -6.071
chem comp atom.model cartn x ideal: 2.007
chem comp atom.model cartn y: -4.612
chem comp atom.model cartn y ideal: -0.823
chem comp atom.model cartn z: 3.693
chem comp atom.model cartn z ideal: -0.535
chem comp atom.pdb atom id: O1
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O2
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -7.160
chem comp atom.model cartn x ideal: 0.424
chem comp atom.model cartn y: -2.636
chem comp atom.model cartn y ideal: 0.284
chem comp atom.model cartn z: 5.269
chem comp atom.model cartn z ideal: -2.610
chem comp atom.pdb atom id: O2
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O3
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -8.624
chem comp atom.model cartn x ideal: -2.094
chem comp atom.model cartn y: -1.259
chem comp atom.model cartn y ideal: -0.452
chem comp atom.model cartn z: 3.250
chem comp atom.model cartn z ideal: -1.385
chem comp atom.pdb atom id: O3
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O4,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O4
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -10.192
chem comp atom.model cartn x ideal: -1.700
chem comp atom.model cartn y: -3.382
chem comp atom.model cartn y ideal: 0.824
chem comp atom.model cartn z: 2.400
chem comp atom.model cartn z ideal: 1.044
chem comp atom.pdb atom id: O4
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O5,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O5
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -8.205
chem comp atom.model cartn x ideal: 1.116
chem comp atom.model cartn y: -5.378
chem comp atom.model cartn y ideal: 0.724
chem comp atom.model cartn z: 3.096
chem comp atom.model cartn z ideal: 0.961
chem comp atom.pdb atom id: O5
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: O

H1,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H1
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -7.457
chem comp atom.model cartn x ideal: 2.101
chem comp atom.model cartn y: -5.315
chem comp atom.model cartn y ideal: 1.225
chem comp atom.model cartn z: 5.005
chem comp atom.model cartn z ideal: -0.780
chem comp atom.pdb atom id: H1
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H2
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -9.010
chem comp atom.model cartn x ideal: -0.350
chem comp atom.model cartn y: -3.406
chem comp atom.model cartn y ideal: 1.489
chem comp atom.model cartn z: 4.739
chem comp atom.model cartn z ideal: -1.121
chem comp atom.pdb atom id: H2
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H3,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H3
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -6.988
chem comp atom.model cartn x ideal: -0.406
chem comp atom.model cartn y: -2.381
chem comp atom.model cartn y ideal: -1.558
chem comp atom.model cartn z: 2.645
chem comp atom.model cartn z ideal: -0.935
chem comp atom.pdb atom id: H3
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H4
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
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: -8.777
chem comp atom.model cartn x ideal: -1.598
chem comp atom.model cartn y: -2.767
chem comp atom.model cartn y ideal: -1.235
chem comp atom.model cartn z: 1.009
chem comp atom.model cartn z ideal: 1.178
chem comp atom.pdb atom id: H4
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H5
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: H5
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: -7.245
chem comp atom.model cartn x ideal: 0.886
chem comp atom.model cartn y: -4.579
chem comp atom.model cartn y ideal: -1.307
chem comp atom.model cartn z: 1.379
chem comp atom.model cartn z ideal: 1.232
chem comp atom.pdb atom id: H5
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H61,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H61
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: 1H6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H61
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -8.683
chem comp atom.model cartn x ideal: 1.164
chem comp atom.model cartn y: -6.596
chem comp atom.model cartn y ideal: -0.226
chem comp atom.model cartn z: 0.776
chem comp atom.model cartn z ideal: 3.446
chem comp atom.pdb atom id: H61
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H62,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H62
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: 2H6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H62
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -10.162
chem comp atom.model cartn x ideal: -0.341
chem comp atom.model cartn y: -5.606
chem comp atom.model cartn y ideal: 0.686
chem comp atom.model cartn z: 1.238
chem comp atom.model cartn z ideal: 3.190
chem comp atom.pdb atom id: H62
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H63,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H63
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: 3H6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H63
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -9.246
chem comp atom.model cartn x ideal: -0.391
chem comp atom.model cartn y: -5.076
chem comp atom.model cartn y ideal: -1.085
chem comp atom.model cartn z: -0.090
chem comp atom.model cartn z ideal: 3.345
chem comp atom.pdb atom id: H63
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO1,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HO1
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: HO1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HO1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -5.720
chem comp atom.model cartn x ideal: 2.818
chem comp atom.model cartn y: -5.480
chem comp atom.model cartn y ideal: -0.808
chem comp atom.model cartn z: 3.532
chem comp atom.model cartn z ideal: -0.008
chem comp atom.pdb atom id: HO1
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO2,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HO2
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
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: yes
chem comp atom.model cartn x: -7.510
chem comp atom.model cartn x ideal: 1.029
chem comp atom.model cartn y: -1.767
chem comp atom.model cartn y ideal: 0.986
chem comp atom.model cartn z: 5.429
chem comp atom.model cartn z ideal: -2.884
chem comp atom.pdb atom id: HO2
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO3,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HO3
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
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: -8.654
chem comp atom.model cartn x ideal: -1.928
chem comp atom.model cartn y: -0.768
chem comp atom.model cartn y ideal: -0.555
chem comp atom.model cartn z: 2.436
chem comp atom.model cartn z ideal: -2.332
chem comp atom.pdb atom id: HO3
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO4,FUC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HO4
chem comp atom.comp id: FUC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: HO4
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HO4
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -10.695
chem comp atom.model cartn x ideal: -1.794
chem comp atom.model cartn y: -3.863
chem comp atom.model cartn y ideal: 0.893
chem comp atom.model cartn z: 1.754
chem comp atom.model cartn z ideal: 2.004
chem comp atom.pdb atom id: HO4
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: H

C2,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C2
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -10.996
chem comp atom.model cartn x ideal: -1.599
chem comp atom.model cartn y: 33.341
chem comp atom.model cartn y ideal: 0.273
chem comp atom.model cartn z: 27.027
chem comp atom.model cartn z ideal: -0.228
chem comp atom.pdb atom id: C2
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: R
chem comp atom.type symbol: C

C3,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C3
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -12.038
chem comp atom.model cartn x ideal: -1.032
chem comp atom.model cartn y: 32.592
chem comp atom.model cartn y ideal: -1.069
chem comp atom.model cartn z: 26.187
chem comp atom.model cartn z ideal: 0.244
chem comp atom.pdb atom id: C3
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: S
chem comp atom.type symbol: C

C4,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C4
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -11.494
chem comp atom.model cartn x ideal: 0.406
chem comp atom.model cartn y: 31.246
chem comp atom.model cartn y ideal: -1.210
chem comp atom.model cartn z: 25.653
chem comp atom.model cartn z ideal: -0.265
chem comp atom.pdb atom id: C4
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: S
chem comp atom.type symbol: C

C5,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C5
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -10.708
chem comp atom.model cartn x ideal: 1.234
chem comp atom.model cartn y: 30.453
chem comp atom.model cartn y ideal: -0.022
chem comp atom.model cartn z: 26.718
chem comp atom.model cartn z ideal: 0.232
chem comp atom.pdb atom id: C5
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: R
chem comp atom.type symbol: C

C6,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C6
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -9.957
chem comp atom.model cartn x ideal: 2.657
chem comp atom.model cartn y: 29.291
chem comp atom.model cartn y ideal: -0.124
chem comp atom.model cartn z: 26.064
chem comp atom.model cartn z ideal: -0.322
chem comp atom.pdb atom id: C6
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C1,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: C1
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -10.467
chem comp atom.model cartn x ideal: -0.694
chem comp atom.model cartn y: 32.372
chem comp atom.model cartn y ideal: 1.404
chem comp atom.model cartn z: 28.084
chem comp atom.model cartn z ideal: 0.269
chem comp atom.pdb atom id: C1
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O1,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O1
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: O1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -9.562
chem comp atom.model cartn x ideal: -1.186
chem comp atom.model cartn y: 33.031
chem comp atom.model cartn y ideal: 2.655
chem comp atom.model cartn z: 28.945
chem comp atom.model cartn z ideal: -0.214
chem comp atom.pdb atom id: O1
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O2
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -11.604
chem comp atom.model cartn x ideal: -2.915
chem comp atom.model cartn y: 34.434
chem comp atom.model cartn y ideal: 0.448
chem comp atom.model cartn z: 27.662
chem comp atom.model cartn z ideal: 0.302
chem comp atom.pdb atom id: O2
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O3
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -12.595
chem comp atom.model cartn x ideal: -1.829
chem comp atom.model cartn y: 33.387
chem comp atom.model cartn y ideal: -2.135
chem comp atom.model cartn z: 25.141
chem comp atom.model cartn z ideal: -0.276
chem comp atom.pdb atom id: O3
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O4,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O4
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -12.566
chem comp atom.model cartn x ideal: 0.971
chem comp atom.model cartn y: 30.471
chem comp atom.model cartn y ideal: -2.426
chem comp atom.model cartn z: 25.149
chem comp atom.model cartn z ideal: 0.229
chem comp atom.pdb atom id: O4
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O5,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O5
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -9.808
chem comp atom.model cartn x ideal: 0.635
chem comp atom.model cartn y: 31.290
chem comp atom.model cartn y ideal: 1.195
chem comp atom.model cartn z: 27.452
chem comp atom.model cartn z ideal: -0.215
chem comp atom.pdb atom id: O5
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O6,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: O6
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -9.968
chem comp atom.model cartn x ideal: 3.460
chem comp atom.model cartn y: 28.157
chem comp atom.model cartn y ideal: 0.918
chem comp atom.model cartn z: 26.895
chem comp atom.model cartn z ideal: 0.235
chem comp atom.pdb atom id: O6
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: O

H2,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H2
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -10.168
chem comp atom.model cartn x ideal: -1.639
chem comp atom.model cartn y: 33.665
chem comp atom.model cartn y ideal: 0.290
chem comp atom.model cartn z: 26.379
chem comp atom.model cartn z ideal: -1.317
chem comp atom.pdb atom id: H2
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H3,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H3
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -12.857
chem comp atom.model cartn x ideal: -1.038
chem comp atom.model cartn y: 32.335
chem comp atom.model cartn y ideal: -1.105
chem comp atom.model cartn z: 26.875
chem comp atom.model cartn z ideal: 1.333
chem comp atom.pdb atom id: H3
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H4
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -10.799
chem comp atom.model cartn x ideal: 0.407
chem comp atom.model cartn y: 31.475
chem comp atom.model cartn y ideal: -1.223
chem comp atom.model cartn z: 24.832
chem comp atom.model cartn z ideal: -1.355
chem comp atom.pdb atom id: H4
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H5
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: H5
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: -11.442
chem comp atom.model cartn x ideal: 1.266
chem comp atom.model cartn y: 30.023
chem comp atom.model cartn y ideal: -0.033
chem comp atom.model cartn z: 27.416
chem comp atom.model cartn z ideal: 1.322
chem comp atom.pdb atom id: H5
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H6C1,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H6C1
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 0
chem comp atom.alt atom id: H6C1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H6C1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -10.441
chem comp atom.model cartn x ideal: 3.082
chem comp atom.model cartn y: 29.042
chem comp atom.model cartn y ideal: -1.092
chem comp atom.model cartn z: 25.108
chem comp atom.model cartn z ideal: -0.056
chem comp atom.pdb atom id: H6C1
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H6C2,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H6C2
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 0
chem comp atom.alt atom id: H6C2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H6C2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -8.915
chem comp atom.model cartn x ideal: 2.632
chem comp atom.model cartn y: 29.593
chem comp atom.model cartn y ideal: -0.024
chem comp atom.model cartn z: 25.880
chem comp atom.model cartn z ideal: -1.407
chem comp atom.pdb atom id: H6C2
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H1,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H1
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
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: -11.323
chem comp atom.model cartn x ideal: -0.687
chem comp atom.model cartn y: 31.996
chem comp atom.model cartn y ideal: 1.412
chem comp atom.model cartn z: 28.663
chem comp atom.model cartn z ideal: 1.359
chem comp atom.pdb atom id: H1
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HA,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HA
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: HA
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HA
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -9.241
chem comp atom.model cartn x ideal: -0.660
chem comp atom.model cartn y: 32.419
chem comp atom.model cartn y ideal: 3.418
chem comp atom.model cartn z: 29.596
chem comp atom.model cartn z ideal: 0.062
chem comp atom.pdb atom id: HA
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HB
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: HB
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HB
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -10.958
chem comp atom.model cartn x ideal: -3.336
chem comp atom.model cartn y: 34.898
chem comp atom.model cartn y ideal: 1.279
chem comp atom.model cartn z: 28.182
chem comp atom.model cartn z ideal: 0.043
chem comp atom.pdb atom id: HB
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HC,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HC
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: HC
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HC
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -13.231
chem comp atom.model cartn x ideal: -2.755
chem comp atom.model cartn y: 32.874
chem comp atom.model cartn y ideal: -2.104
chem comp atom.model cartn z: 24.657
chem comp atom.model cartn z ideal: 0.001
chem comp atom.pdb atom id: HC
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HD,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: HD
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: HD
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HD
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -12.233
chem comp atom.model cartn x ideal: 0.493
chem comp atom.model cartn y: 29.644
chem comp atom.model cartn y ideal: -3.221
chem comp atom.model cartn z: 24.821
chem comp atom.model cartn z ideal: -0.044
chem comp atom.pdb atom id: HD
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H6,BGC,51358
type: chem comp atom
of datablock: info:bmrb/51358
reference to entry: entry
chem comp atom.atom id: H6
chem comp atom.comp id: BGC
chem comp atom.entry id: 51358
chem comp atom.align: 1
chem comp atom.alt atom id: H6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H6
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: -9.498
chem comp atom.model cartn x ideal: 4.377
chem comp atom.model cartn y: 27.449
chem comp atom.model cartn y ideal: 0.915
chem comp atom.model cartn z: 26.471
chem comp atom.model cartn z ideal: -0.072
chem comp atom.pdb atom id: H6
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: N
chem comp atom.type symbol: H

BGC,51358,1
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 1
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C3
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,2
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 2
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: C2
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,3
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 3
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C1
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,4
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 4
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O1
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,5
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 5
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O5
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,6
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 6
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: O2
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,7
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 7
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H2
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,8
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H1
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,9
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 9
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,10
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 10
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C3
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,11
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 11
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: O2
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,12
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 12
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: O3
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,13
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 13
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H2
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,14
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 14
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H3
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,15
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 15
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,16
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 16
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: C5
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,17
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 17
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: O3
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,18
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 18
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: O4
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,19
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 19
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H3
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,20
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 20
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H4
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,21
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 21
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,22
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 22
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: C5
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,23
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 23
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: O4
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,24
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 24
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: O5
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,25
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 25
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H4
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,26
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 26
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: H5
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,27
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 27
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: O6
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,28
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 28
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,29
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 29
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: O5
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,30
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 30
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H6C1
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,31
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 31
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H6C2
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,32
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 32
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: H5
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,33
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 33
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H61
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,34
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 34
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O1
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,35
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 35
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H62
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,36
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 36
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O5
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,37
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 37
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H1
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,38
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 38
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H63
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,39
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 39
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O1
chem comp bond.atom id 2: HO1
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,40
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 40
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O1
chem comp bond.atom id 2: HA
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,41
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 41
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2
chem comp bond.atom id 2: HB
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,42
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 42
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2
chem comp bond.atom id 2: HO2
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,43
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 43
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3
chem comp bond.atom id 2: HO3
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,44
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 44
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3
chem comp bond.atom id 2: HC
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,51358,45
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: FUC
chem comp bond.entry id: 51358
chem comp bond.id: 45
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O4
chem comp bond.atom id 2: HO4
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,46
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 46
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O4
chem comp bond.atom id 2: HD
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

BGC,51358,47
type: chem comp bond
of datablock: info:bmrb/51358
chem comp bond.comp id: BGC
chem comp bond.entry id: 51358
chem comp bond.id: 47
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O6
chem comp bond.atom id 2: H6
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.value order: SING

FUC,CC1C(C(C(C(O1)O)O)O)O,51358,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: CC1C(C(C(C(O1)O)O)O)O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

FUC,C[C@@H]1O[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1O,51358,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: C[C@@H]1O[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

FUC,C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)O)O)O,51358,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)O)O)O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

FUC,C[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O,51358,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: C[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr51358/chem_comp_descriptor/FUC,InChI%3D1S%2FC6H12O5%2Fc1-2-3(7)4(8)5(9)6(10)11-2%2Fh2-10H,1H3%2Ft2-,3%2B,51358,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6+/m0/s1
chem comp descriptor.entry id: 51358
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

FUC,OC1C(O)C(OC(O)C1O)C,51358,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: OC1C(O)C(OC(O)C1O)C
chem comp descriptor.entry id: 51358
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

FUC,SHZGCJCMOBCMKK-SXUWKVJYSA-N,51358,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: FUC
chem comp descriptor.descriptor: SHZGCJCMOBCMKK-SXUWKVJYSA-N
chem comp descriptor.entry id: 51358
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

BGC,C(C1C(C(C(C(O1)O)O)O)O)O,51358,OECHEM,1.7.6,SMILES
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: C(C1C(C(C(C(O1)O)O)O)O)O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES

BGC,C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O,51358,OECHEM,1.7.6,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr51358/chem_comp_descriptor/BGC,InChI%3D1S%2FC6H12O6%2Fc7-1-2-3(8)4(9)5(10)6(11)12-2%2Fh2-11H,1H2%2Ft2-,51358,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1
chem comp descriptor.entry id: 51358
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

BGC,OC1C(O)C(OC(O)C1O)CO,51358,ACD,12.01,SMILES
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: OC1C(O)C(OC(O)C1O)CO
chem comp descriptor.entry id: 51358
chem comp descriptor.program: ACD
chem comp descriptor.program version: 12.01
chem comp descriptor.type: SMILES

BGC,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,51358,CACTVS,3.370,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.370
chem comp descriptor.type: SMILES_CANONICAL

BGC,OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O,51358,CACTVS,3.370,SMILES
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
chem comp descriptor.entry id: 51358
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.370
chem comp descriptor.type: SMILES

BGC,WQZGKKKJIJFFOK-VFUOTHLCSA-N,51358,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/51358
chem comp descriptor.comp id: BGC
chem comp descriptor.descriptor: WQZGKKKJIJFFOK-VFUOTHLCSA-N
chem comp descriptor.entry id: 51358
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

FUC,51358,(2R,3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/51358
chem comp identifier.comp id: FUC
chem comp identifier.entry id: 51358
chem comp identifier.identifier: (2R,3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

FUC,51358,6-deoxy-alpha-L-galactopyranose,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/51358
chem comp identifier.comp id: FUC
chem comp identifier.entry id: 51358
chem comp identifier.identifier: 6-deoxy-alpha-L-galactopyranose
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

FUC,51358,a-L-fucopyranose,OTHER,1.0,common name
type: chem comp identifier
of datablock: info:bmrb/51358
chem comp identifier.comp id: FUC
chem comp identifier.entry id: 51358
chem comp identifier.identifier: a-L-fucopyranose
chem comp identifier.program: OTHER
chem comp identifier.program version: 1.0
chem comp identifier.type: common name

BGC,51358,(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol,OECHEM,1.7.6,systematic name
type: chem comp identifier
of datablock: info:bmrb/51358
chem comp identifier.comp id: BGC
chem comp identifier.entry id: 51358
chem comp identifier.identifier: (2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.7.6
chem comp identifier.type: systematic name

BGC,51358,b-D-glucopyranose,OTHER,1.0,common name
type: chem comp identifier
of datablock: info:bmrb/51358
chem comp identifier.comp id: BGC
chem comp identifier.entry id: 51358
chem comp identifier.identifier: b-D-glucopyranose
chem comp identifier.program: OTHER
chem comp identifier.program version: 1.0
chem comp identifier.type: common name

BGC,51358,beta-D-glucopyranose,ACD,12.01,systematic name
type: chem comp identifier
of datablock: info:bmrb/51358
chem comp identifier.comp id: BGC
chem comp identifier.entry id: 51358
chem comp identifier.identifier: beta-D-glucopyranose
chem comp identifier.program: ACD
chem comp identifier.program version: 12.01
chem comp identifier.type: systematic name

1,51358,1
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 1
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 19
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,2
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 2
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 15n coverage: 1.000
chem shift completeness char.arom chem shift 1h coverage: 0.167
chem shift completeness char.arom chem shift coverage: 0.167
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.125
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.300
chem shift completeness char.chem shift coverage: 0.300
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 20
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.125
chem shift completeness char.sc chem shift coverage: 0.133
chem shift completeness char.sf id: 513580301

1,51358,3
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 3
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 21
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,4
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 4
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: ILE
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 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,5
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 5
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 23
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
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: 513580301

1,51358,6
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 6
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 24
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
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: 513580301

1,51358,7
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 7
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 25
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,8
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 8
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: THR
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 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,9
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 9
chem shift completeness char.bb chem shift 13c coverage: 0.333
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: 0.500
chem shift completeness char.chem shift 13c coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.625
chem shift completeness char.comp id: CYS
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,10
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 10
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 28
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 513580301

1,51358,11
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 11
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
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.sf id: 513580301

1,51358,12
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 12
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
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.sf id: 513580301

1,51358,13
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 13
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
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 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,14
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 14
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 32
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
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: 513580301

1,51358,15
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 15
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.941
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,16
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 16
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.400
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.222
chem shift completeness char.chem shift coverage: 0.313
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 34
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
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: 0.091
chem shift completeness char.sf id: 513580301

1,51358,17
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 17
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 35
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,18
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 18
chem shift completeness char.bb chem shift 13c coverage: 0.333
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: 0.500
chem shift completeness char.chem shift 13c coverage: 0.200
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: 0.188
chem shift completeness char.comp id: ARG
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 13c coverage: 0.333
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: 0.091
chem shift completeness char.sf id: 513580301

1,51358,19
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 19
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 37
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.778
chem shift completeness char.sf id: 513580301

1,51358,20
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 20
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 38
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,21
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 21
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 39
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,22
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 22
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 40
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,23
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 23
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,24
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 24
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 42
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,25
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 25
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 43
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,26
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 26
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: GLN
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,27
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 27
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.389
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 45
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 513580301

1,51358,28
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 28
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
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.sf id: 513580301

1,51358,29
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 29
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
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.sf id: 513580301

1,51358,30
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 30
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.941
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 48
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,31
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 31
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: 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 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,32
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 32
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 50
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,33
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 33
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 51
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,34
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 34
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 52
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 513580301

1,51358,35
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 35
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 53
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,36
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 36
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: VAL
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 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,37
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 37
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 55
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,38
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 38
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 56
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,39
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 39
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,40
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 40
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 58
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,41
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 41
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 59
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,42
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 42
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 60
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,43
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 43
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 61
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,44
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 44
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.941
chem shift completeness char.comp id: LYS
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,45
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 45
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.786
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,46
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 46
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 64
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,47
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 47
chem shift completeness char.bb chem shift 13c coverage: 0.333
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: 0.500
chem shift completeness char.chem shift 13c coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.625
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 65
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,48
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 48
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 66
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,49
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 49
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 67
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,50
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 50
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 68
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,51
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 51
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 69
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,52
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 52
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.000
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 13c 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: 70
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,53
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 53
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.000
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 13c 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: 71
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,54
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 54
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.000
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 13c 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: 72
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,55
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 55
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.000
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 13c 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: 73
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,56
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 56
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.000
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 13c 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: 74
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 513580301

1,51358,57
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 57
chem shift completeness char.arom chem shift 13c coverage: 0.500
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 13c coverage: 0.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.167
chem shift completeness char.chem shift 13c coverage: 0.200
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 75
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.250
chem shift completeness char.sc chem shift coverage: 0.286
chem shift completeness char.sf id: 513580301

1,51358,58
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 58
chem shift completeness char.bb chem shift 13c 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 13c 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: 1
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 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: 513580301

1,51358,59
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 59
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.625
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 2
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,60
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 60
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 3
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,61
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 61
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
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.sf id: 513580301

1,51358,62
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 62
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: ILE
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,63
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 63
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,64
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 64
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 7
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,65
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 65
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,66
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 66
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,67
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 67
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,68
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 68
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 11
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,69
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 69
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
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: 513580301

1,51358,70
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 70
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
chem shift completeness char.comp id: GLY
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.sf id: 513580301

1,51358,71
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 71
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 15n coverage: 1.000
chem shift completeness char.arom chem shift 1h coverage: 0.167
chem shift completeness char.arom chem shift coverage: 0.167
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.125
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.300
chem shift completeness char.chem shift coverage: 0.300
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.125
chem shift completeness char.sc chem shift coverage: 0.133
chem shift completeness char.sf id: 513580301

1,51358,72
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 72
chem shift completeness char.bb chem shift 13c coverage: 0.500
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.833
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: 513580301

1,51358,73
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 73
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358,74
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 74
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 15n coverage: 1.000
chem shift completeness char.arom chem shift 1h coverage: 0.167
chem shift completeness char.arom chem shift coverage: 0.167
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 0.125
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.300
chem shift completeness char.chem shift coverage: 0.300
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 17
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.125
chem shift completeness char.sc chem shift coverage: 0.133
chem shift completeness char.sf id: 513580301

1,51358,75
type: chem shift completeness char
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 51358
chem shift completeness char.id: 75
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 18
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 513580301

1,51358
type: chem shift completeness list
of datablock: info:bmrb/51358
reference to entry: entry
chem shift completeness list.assigned chem shift list id: 1
chem shift completeness list.entry id: 51358
chem shift completeness list.arom chem shift 13c fraction: 1/32
chem shift completeness list.arom chem shift 15n fraction: 3/3
chem shift completeness list.arom chem shift 1h fraction: 4/35
chem shift completeness list.arom chem shift fraction: 8/70
chem shift completeness list.assigned residue coverage: 0.920
chem shift completeness list.bb chem shift 13c fraction: 120/215
chem shift completeness list.bb chem shift 15n fraction: 61/69
chem shift completeness list.bb chem shift 1h fraction: 135/154
chem shift completeness list.bb chem shift fraction: 316/438
chem shift completeness list.chem shift 13c fraction: 180/314
chem shift completeness list.chem shift 15n fraction: 74/84
chem shift completeness list.chem shift 1h fraction: 335/433
chem shift completeness list.chem shift fraction: 589/831
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr51358_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 13c fraction: 27/27
chem shift completeness list.methyl chem shift 1h fraction: 27/27
chem shift completeness list.methyl chem shift fraction: 54/54
chem shift completeness list.output file name: bmr51358_chem_shift_completeness.str
chem shift completeness list.queried date: 2022-06-07Z
chem shift completeness list.sc chem shift 13c fraction: 111/164
chem shift completeness list.sc chem shift 15n fraction: 13/15
chem shift completeness list.sc chem shift 1h fraction: 200/279
chem shift completeness list.sc chem shift fraction: 324/458
chem shift completeness list.sf category: chem_shift_completeness_list
chem shift completeness list.sf framecode: chem_shift_completeness_list_1
chem shift completeness list.sf id: 513580301

1,51358,1
type: chem shift experiment
of datablock: info:bmrb/51358
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 51358
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: 2D 1H-15N HSQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,51358,2
type: chem shift experiment
of datablock: info:bmrb/51358
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 51358
chem shift experiment.experiment id: 2
chem shift experiment.experiment name: 2D 1H-13C CT-HSQC aliphatic
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

13,C,1,51358,DSS
type: chem shift ref
of datablock: info:bmrb/51358
chem shift ref.atom isotope number: 13
chem shift ref.atom type: C
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 51358
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 0.2514495
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
chem shift ref.ref type: indirect

1,H,1,51358,DSS
type: chem shift ref
of datablock: info:bmrb/51358
chem shift ref.atom isotope number: 1
chem shift ref.atom type: H
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 51358
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 1.000000
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

15,N,1,51358,DSS
type: chem shift ref
of datablock: info:bmrb/51358
chem shift ref.atom isotope number: 15
chem shift ref.atom type: N
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 51358
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 0.1013291
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
chem shift ref.ref type: indirect

51358,1
type: chem shift reference
of datablock: info:bmrb/51358
reference to entry: entry
chem shift reference.entry id: 51358
chem shift reference.id: 1
chem shift reference.name: DSS_25C
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chem_shift_reference_1

1,51358,2
type: chem shift software
of datablock: info:bmrb/51358
chem shift software.assigned chem shift list id: 1
chem shift software.entry id: 51358
chem shift software.software id: 2
chem shift software.method id: 0
chem shift software.software label: software_2

51358,1
type: citation
of datablock: info:bmrb/51358
reference to entry: entry
citation.entry id: 51358
citation.id: 1
citation.class: entry citation
citation.doi: 10.1016/j.jbc.2022.102047
citation.journal abbrev: J. Biol. Chem.
citation.journal issn: 0021-9258
citation.journal issue: 6
citation.journal name full: The Journal of biological chemistry
citation.journal volume: 298
citation.page first: 102047
citation.page last: 102047
citation.pubmed id: 35597280
citation.sf category: citations
citation.sf framecode: citations_1
citation.status: published
citation.title: O-Fucosylation stabilizes the TSR3 motif in Thrombospondin-1 by interacting with nearby amino acids and protecting a disulfide bond.
citation.type: journal
citation.year: 2022

info:doi/10.1016/j.jbc.2022.102047

doi:10.1016/j.jbc.2022.102047

urn:ISSN:0021-9258

issn:0021-9258

info:pmid/35597280

pubmed:35597280

1,51358,1
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 1
citation author.family name: Berardinelli
citation author.given name: Steven
citation author.middle initials: J.
citation author.pdbx name: Berardinelli, S.J.

1,51358,2
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 2
citation author.family name: Eletsky
citation author.given name: Alexander
citation author.pdbx name: Eletsky, A.

1,51358,3
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 3
citation author.family name: Valero-Gonzales
citation author.given name: Jessika
citation author.pdbx name: Valero-Gonzales, J.

1,51358,4
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 4
citation author.family name: Ito
citation author.given name: Atsuko
citation author.pdbx name: Ito, A.

1,51358,5
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 5
citation author.family name: Manjunath
citation author.given name: Rajashri
citation author.pdbx name: Manjunath, R.

1,51358,6
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 6
citation author.family name: Hurtado-Gurerro
citation author.given name: Ramon
citation author.pdbx name: Hurtado-Gurerro, R.

1,51358,7
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 7
citation author.family name: Prestegard
citation author.given name: James
citation author.middle initials: H.
citation author.pdbx name: Prestegard, J.H.

1,51358,8
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 8
citation author.family name: Woods
citation author.given name: Robert
citation author.middle initials: J.
citation author.pdbx name: Woods, R.J.

1,51358,9
type: citation author
of datablock: info:bmrb/51358
citation author.citation id: 1
citation author.entry id: 51358
citation author.ordinal: 9
citation author.family name: Haltiwanger
citation author.given name: Robert
citation author.middle initials: S.
citation author.pdbx name: Haltiwanger, R.S.

1,51358,glycosylation, extracellular matrix, O-fucose
type: citation keyword
of datablock: info:bmrb/51358
citation keyword.citation id: 1
citation keyword.entry id: 51358
citation keyword.keyword: glycosylation, extracellular matrix, O-fucose, thrombospondin type 1 repeats, protein folding

51358,assigned chemical shifts
type: data set
of datablock: info:bmrb/51358
reference to entry: entry
data set.entry id: 51358
data set.type: assigned_chemical_shifts
data set.count: 1

51358,spectral peak list
type: data set
of datablock: info:bmrb/51358
reference to entry: entry
data set.entry id: 51358
data set.type: spectral_peak_list
data set.count: 1

51358,13C chemical shifts
type: datum
of datablock: info:bmrb/51358
reference to entry: entry
datum.entry id: 51358
datum.type: 13C chemical shifts
datum.count: 173

51358,15N chemical shifts
type: datum
of datablock: info:bmrb/51358
reference to entry: entry
datum.entry id: 51358
datum.type: 15N chemical shifts
datum.count: 74

51358,1H chemical shifts
type: datum
of datablock: info:bmrb/51358
reference to entry: entry
datum.entry id: 51358
datum.type: 1H chemical shifts
datum.count: 386

51358,1
type: entity
of datablock: info:bmrb/51358
reference to entry: entry
entity.entry id: 51358
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 8216.061
entity.fragment: TSR3
entity.name: entity 1
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 75
entity.paramagnetic: no
entity.parent entity id: 1
entity.polymer author seq details: Residues 9-67 correspond to segment 490-548 of the native thrombospondin-1. Residues 1-8 and 68-75 represent non-native expression and purification tags. Residue 42 represents a naturally occuring sequence variant p.Thr523Ala.
entity.polymer seq one letter code: MDIGINSDPINGGWGPWSPWDICSVTCGGGVQKRSRLCNNPAPQFGGKDCVGDVTENQICNKQDCPILEHHHHHH
entity.polymer seq one letter code can: MDIGINSDPINGGWGPWSPWDICSVTCGGGVQKRSRLCNNPAPQFGGKDCVGDVTENQICNKQDCPILEHHHHHH
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: entity_1
entity.thiol state: all disulfide bound
entity.type: polymer

51358,2
type: entity
of datablock: info:bmrb/51358
reference to entry: entry
entity.entry id: 51358
entity.id: 2
entity.bmrb code: FUC
entity.formula weight: 164.156
entity.name: entity FUC
entity.nonpolymer comp id: FUC
entity.nonpolymer comp label: chem_comp_FUC
entity.number of nonpolymer components: 1
entity.parent entity id: 2
entity.polymer seq one letter code can: (FUC)
entity.sf category: entity
entity.sf framecode: entity_FUC
entity.type: non-polymer

51358,3
type: entity
of datablock: info:bmrb/51358
reference to entry: entry
entity.entry id: 51358
entity.id: 3
entity.bmrb code: BGC
entity.formula weight: 180.156
entity.name: entity BGC
entity.nonpolymer comp id: BGC
entity.nonpolymer comp label: chem_comp_BGC
entity.number of nonpolymer components: 1
entity.parent entity id: 3
entity.polymer seq one letter code can: (BGC)
entity.sf category: entity
entity.sf framecode: entity_BGC
entity.type: non-polymer

1,51358,1
type: entity assembly
of datablock: info:bmrb/51358
entity assembly.assembly id: 1
entity assembly.entry id: 51358
entity assembly.id: 1
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: TSR3
entity assembly.entity id: 1
entity assembly.entity label: entity_1
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,51358,2
type: entity assembly
of datablock: info:bmrb/51358
entity assembly.assembly id: 1
entity assembly.entry id: 51358
entity assembly.id: 2
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: fucose
entity assembly.entity id: 2
entity assembly.entity label: entity_FUC
entity assembly.experimental data reported: no
entity assembly.physical state: native

1,51358,3
type: entity assembly
of datablock: info:bmrb/51358
entity assembly.assembly id: 1
entity assembly.entry id: 51358
entity assembly.id: 3
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: glucose
entity assembly.entity id: 3
entity assembly.entity label: entity_BGC
entity assembly.experimental data reported: no
entity assembly.physical state: native

2,51358,ALPHA-L-FUCOSE,BMRB
type: entity common name
of datablock: info:bmrb/51358
entity common name.entity id: 2
entity common name.entry id: 51358
entity common name.name: ALPHA-L-FUCOSE
entity common name.type: BMRB

3,51358,BETA-D-GLUCOSE,BMRB
type: entity common name
of datablock: info:bmrb/51358
entity common name.entity id: 3
entity common name.entry id: 51358
entity common name.name: BETA-D-GLUCOSE
entity common name.type: BMRB

1,51358,1
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 1
entity comp index.comp id: MET

1,51358,2
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 2
entity comp index.comp id: ASP

1,51358,3
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 3
entity comp index.comp id: ILE

1,51358,4
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 4
entity comp index.comp id: GLY

1,51358,5
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 5
entity comp index.comp id: ILE

1,51358,6
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 6
entity comp index.comp id: ASN

1,51358,7
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 7
entity comp index.comp id: SER

1,51358,8
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 8
entity comp index.comp id: ASP

1,51358,9
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 9
entity comp index.comp id: PRO

1,51358,10
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 10
entity comp index.comp id: ILE

1,51358,11
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 11
entity comp index.comp id: ASN

1,51358,12
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 12
entity comp index.comp id: GLY

1,51358,13
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 13
entity comp index.comp id: GLY

1,51358,14
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 14
entity comp index.comp id: TRP

1,51358,15
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 15
entity comp index.comp id: GLY

1,51358,16
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 16
entity comp index.comp id: PRO

1,51358,17
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 17
entity comp index.comp id: TRP

1,51358,18
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 18
entity comp index.comp id: SER

1,51358,19
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 19
entity comp index.comp id: PRO

1,51358,20
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 20
entity comp index.comp id: TRP

1,51358,21
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 21
entity comp index.comp id: ASP

1,51358,22
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 22
entity comp index.comp id: ILE

1,51358,23
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 23
entity comp index.comp id: CYS

1,51358,24
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 24
entity comp index.comp id: SER

1,51358,25
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 25
entity comp index.comp id: VAL

1,51358,26
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 26
entity comp index.comp id: THR

1,51358,27
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 27
entity comp index.comp id: CYS

1,51358,28
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 28
entity comp index.comp id: GLY

1,51358,29
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 29
entity comp index.comp id: GLY

1,51358,30
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 30
entity comp index.comp id: GLY

1,51358,31
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 31
entity comp index.comp id: VAL

1,51358,32
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 32
entity comp index.comp id: GLN

1,51358,33
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 33
entity comp index.comp id: LYS

1,51358,34
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 34
entity comp index.comp id: ARG

1,51358,35
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 35
entity comp index.comp id: SER

1,51358,36
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 36
entity comp index.comp id: ARG

1,51358,37
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 37
entity comp index.comp id: LEU

1,51358,38
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 38
entity comp index.comp id: CYS

1,51358,39
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 39
entity comp index.comp id: ASN

1,51358,40
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 40
entity comp index.comp id: ASN

1,51358,41
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 41
entity comp index.comp id: PRO

1,51358,42
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 42
entity comp index.comp id: ALA

1,51358,43
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 43
entity comp index.comp id: PRO

1,51358,44
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 44
entity comp index.comp id: GLN

1,51358,45
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 45
entity comp index.comp id: PHE

1,51358,46
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 46
entity comp index.comp id: GLY

1,51358,47
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 47
entity comp index.comp id: GLY

1,51358,48
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 48
entity comp index.comp id: LYS

1,51358,49
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 49
entity comp index.comp id: ASP

1,51358,50
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 50
entity comp index.comp id: CYS

1,51358,51
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 51
entity comp index.comp id: VAL

1,51358,52
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 52
entity comp index.comp id: GLY

1,51358,53
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 53
entity comp index.comp id: ASP

1,51358,54
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 54
entity comp index.comp id: VAL

1,51358,55
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 55
entity comp index.comp id: THR

1,51358,56
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 56
entity comp index.comp id: GLU

1,51358,57
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 57
entity comp index.comp id: ASN

1,51358,58
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 58
entity comp index.comp id: GLN

1,51358,59
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 59
entity comp index.comp id: ILE

1,51358,60
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 60
entity comp index.comp id: CYS

1,51358,61
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 61
entity comp index.comp id: ASN

1,51358,62
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 62
entity comp index.comp id: LYS

1,51358,63
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 63
entity comp index.comp id: GLN

1,51358,64
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 64
entity comp index.comp id: ASP

1,51358,65
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 65
entity comp index.comp id: CYS

1,51358,66
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 66
entity comp index.comp id: PRO

1,51358,67
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 67
entity comp index.comp id: ILE

1,51358,68
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 68
entity comp index.comp id: LEU

1,51358,69
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 69
entity comp index.comp id: GLU

1,51358,70
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 70
entity comp index.comp id: HIS

1,51358,71
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 71
entity comp index.comp id: HIS

1,51358,72
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 72
entity comp index.comp id: HIS

1,51358,73
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 73
entity comp index.comp id: HIS

1,51358,74
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 74
entity comp index.comp id: HIS

1,51358,75
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 1
entity comp index.entry id: 51358
entity comp index.id: 75
entity comp index.comp id: HIS

2,51358,76
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 2
entity comp index.entry id: 51358
entity comp index.id: 76
entity comp index.auth seq id: 1
entity comp index.comp id: FUC
entity comp index.comp label: chem_comp_FUC

3,51358,77
type: entity comp index
of datablock: info:bmrb/51358
entity comp index.entity id: 3
entity comp index.entry id: 51358
entity comp index.id: 77
entity comp index.auth seq id: 1
entity comp index.comp id: BGC
entity comp index.comp label: chem_comp_BGC

P07996,SP,1,51358
type: entity db link
of datablock: info:bmrb/51358
entity db link.accession code: P07996
entity db link.database code: SP
entity db link.entity id: 1
entity db link.entry id: 51358
entity db link.author supplied: yes
entity db link.entry mol name: THBS1
entity db link.ordinal: 1

info:uniprot/P07996

uniprot:P07996

1,51358,1
type: entity experimental src
of datablock: info:bmrb/51358
entity experimental src.entity experimental src list id: 1
entity experimental src.entry id: 51358
entity experimental src.id: 1
entity experimental src.citation id: 0
entity experimental src.entity chimera segment id: 0
entity experimental src.entity id: 1
entity experimental src.entity label: entity_1
entity experimental src.host org genus: Escherichia
entity experimental src.host org name common: E. coli
entity experimental src.host org ncbi taxonomy id: 562
entity experimental src.host org scientific name: Escherichia coli
entity experimental src.host org species: coli
entity experimental src.host org strain: BL21(DE3)
entity experimental src.production method: recombinant technology
entity experimental src.vector name: pET20b+
entity experimental src.vector type: plasmid

info:taxonomy/562

taxonomy:562

51358,1
type: entity experimental src list
of datablock: info:bmrb/51358
reference to entry: entry
entity experimental src list.entry id: 51358
entity experimental src list.id: 1
entity experimental src list.sf category: experimental_source
entity experimental src list.sf framecode: experimental_source_1

1,51358,1
type: entity natural src
of datablock: info:bmrb/51358
reference to entry: entry
entity natural src.entity natural src list id: 1
entity natural src.entry id: 51358
entity natural src.id: 1
entity natural src.citation id: 0
entity natural src.entity chimera segment id: 0
entity natural src.entity id: 1
entity natural src.entity label: entity_1
entity natural src.gene mnemonic: THBS1
entity natural src.genus: Homo
entity natural src.kingdom: Metazoa
entity natural src.ncbi taxonomy id: 9606
entity natural src.organism name common: Human
entity natural src.organism name scientific: Homo sapiens
entity natural src.species: sapiens
entity natural src.superkingdom: Eukaryota
entity natural src.type: organism

info:taxonomy/9606

taxonomy:9606

51358,1
type: entity natural src list
of datablock: info:bmrb/51358
reference to entry: entry
entity natural src list.entry id: 51358
entity natural src list.id: 1
entity natural src list.sf category: natural_source
entity natural src list.sf framecode: natural_source_1

1,51358,1
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 1
entity poly seq.comp index id: 1
entity poly seq.mon id: MET

1,51358,2
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 2
entity poly seq.comp index id: 2
entity poly seq.mon id: ASP

1,51358,3
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 3
entity poly seq.comp index id: 3
entity poly seq.mon id: ILE

1,51358,4
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 4
entity poly seq.comp index id: 4
entity poly seq.mon id: GLY

1,51358,5
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 5
entity poly seq.comp index id: 5
entity poly seq.mon id: ILE

1,51358,6
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 6
entity poly seq.comp index id: 6
entity poly seq.mon id: ASN

1,51358,7
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 7
entity poly seq.comp index id: 7
entity poly seq.mon id: SER

1,51358,8
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 8
entity poly seq.comp index id: 8
entity poly seq.mon id: ASP

1,51358,9
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 9
entity poly seq.comp index id: 9
entity poly seq.mon id: PRO

1,51358,10
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
entity poly seq.entry id: 51358
entity poly seq.num: 10
entity poly seq.comp index id: 10
entity poly seq.mon id: ILE

1,51358,11
type: entity poly seq
of datablock: info:bmrb/51358
entity poly seq.entity id: 1
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2,51358,BMRB
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http://bmrbpub.pdbj.org/rdf/bmr51358/entry/51358
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entry.id: 51358
entry.accession date: 2022-03-09Z
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2022-03-09Z
entry.nmr star version: 3.2.14.0
entry.original nmr star version: 3.1
entry.original release date: 2022-03-09Z
entry.origination: author
entry.sf category: entry_information
entry.sf framecode: entry_information_1
entry.submission date: 2022-03-09Z
entry.title: 1H, 13C and 15N resonance assignments of diglycosylated TSR3 domain of human Thrombospondin-1
entry.type: macromolecule
entry.version type: original

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orcid:0000-0002-1291-4315

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51358,1,1
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pdbx chem comp feature.comp id: BGC
pdbx chem comp feature.entry id: 51358
pdbx chem comp feature.source: PDB
pdbx chem comp feature.type: CARBOHYDRATE RING
pdbx chem comp feature.value: pyranose

51351,BMRB,51358
type: related entries
of datablock: info:bmrb/51358
reference to entry: entry
related entries.database accession code: 51351
related entries.database name: BMRB
related entries.entry id: 51358
related entries.relationship: Chemical shifts of non-glycosylated TSR3

info:bmrb/51351

51356,BMRB,51358
type: related entries
of datablock: info:bmrb/51358
reference to entry: entry
related entries.database accession code: 51356
related entries.database name: BMRB
related entries.entry id: 51358
related entries.relationship: Chemical shifts of fucosylated TSR3

info:bmrb/51356

1LSL,PDB,51358
type: related entries
of datablock: info:bmrb/51358
reference to entry: entry
related entries.database accession code: 1LSL
related entries.database name: PDB
related entries.entry id: 51358
related entries.relationship: Crystal structure

info:pdb/1LSL

pdb:1LSL

3R6B,PDB,51358
type: related entries
of datablock: info:bmrb/51358
reference to entry: entry
related entries.database accession code: 3R6B
related entries.database name: PDB
related entries.entry id: 51358
related entries.relationship: Crystal structure

info:pdb/3R6B

pdb:3R6B

7YYK,PDB,51358
type: related entries
of datablock: info:bmrb/51358
reference to entry: entry
related entries.database accession code: 7YYK
related entries.database name: PDB
related entries.entry id: 51358
related entries.relationship: Crystal structure

info:pdb/7YYK

pdb:7YYK

P07996,SP,51358
type: related entries
of datablock: info:bmrb/51358
reference to entry: entry
related entries.database accession code: P07996
related entries.database name: SP
related entries.entry id: 51358
related entries.relationship: Protein sequence

51358,2
type: release
of datablock: info:bmrb/51358
reference to entry: entry
release.entry id: 51358
release.release number: 2
release.author: BMRB
release.date: 2022-09-08Z
release.detail: update entry citation
release.submission date: 2022-03-09Z
release.type: update

51358,1
type: release
of datablock: info:bmrb/51358
reference to entry: entry
release.entry id: 51358
release.release number: 1
release.author: author
release.date: 2022-05-26Z
release.detail: original release
release.submission date: 2022-03-09Z
release.type: original

51358,1
type: sample
of datablock: info:bmrb/51358
reference to entry: entry
sample.entry id: 51358
sample.id: 1
sample.aggregate sample number: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.name: TSR3NC3_FucGlc
sample.sf category: sample
sample.sf framecode: sample_1
sample.solvent system: 93% H2O/7% D2O
sample.type: solution

51358,1,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 240
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: [U-13C; U-15N]
sample component.mol common name: TSR3

51358,2,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 240
sample component.concentration val units: uM
sample component.entity id: 2
sample component.entity label: entity_FUC
sample component.isotopic labeling: natural abundance
sample component.mol common name: fucose

51358,3,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 240
sample component.concentration val units: uM
sample component.entity id: 3
sample component.entity label: entity_BGC
sample component.isotopic labeling: natural abundance
sample component.mol common name: glucose

51358,4,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 4
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 20
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium phosphate

51358,5,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 5
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 100
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

51358,6,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 6
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 4
sample component.concentration val units: uM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: DSS

51358,7,1
type: sample component
of datablock: info:bmrb/51358
sample component.entry id: 51358
sample component.id: 7
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 0.02
sample component.concentration val units: %
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium azide

51358,1
type: sample condition list
of datablock: info:bmrb/51358
reference to entry: entry
sample condition list.entry id: 51358
sample condition list.id: 1
sample condition list.name: sample_conditions_25C
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

51358,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/51358
sample condition variable.entry id: 51358
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 100
sample condition variable.val units: mM

51358,1,pH
type: sample condition variable
of datablock: info:bmrb/51358
sample condition variable.entry id: 51358
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 6.5
sample condition variable.val units: pH

51358,1,pressure
type: sample condition variable
of datablock: info:bmrb/51358
sample condition variable.entry id: 51358
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

51358,1,temperature
type: sample condition variable
of datablock: info:bmrb/51358
sample condition variable.entry id: 51358
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

51358,1
type: software
of datablock: info:bmrb/51358
reference to entry: entry
software.entry id: 51358
software.id: 1
software.name: TOPSPIN
software.sf category: software
software.sf framecode: software_1

51358,2
type: software
of datablock: info:bmrb/51358
reference to entry: entry
software.entry id: 51358
software.id: 2
software.name: CARA
software.sf category: software
software.sf framecode: software_2

H,51358,1,1,amide
type: spectral dim
of datablock: info:bmrb/51358
spectral dim.atom type: H
spectral dim.entry id: 51358
spectral dim.id: 1
spectral dim.spectral peak list id: 1
spectral dim.spectral region: amide
spectral dim.atom isotope number: 1
spectral dim.sweep width: 6.61525
spectral dim.sweep width units: ppm
spectral dim.under sampling type: aliased

N,51358,2,1,amide
type: spectral dim
of datablock: info:bmrb/51358
spectral dim.atom type: N
spectral dim.entry id: 51358
spectral dim.id: 2
spectral dim.spectral peak list id: 1
spectral dim.spectral region: amide
spectral dim.atom isotope number: 15
spectral dim.sweep width: 35
spectral dim.sweep width units: ppm
spectral dim.under sampling type: aliased

51358,2,chemical shift assignment
type: task
of datablock: info:bmrb/51358
task.entry id: 51358
task.software id: 2
task.task: chemical shift assignment

51358,1,collection
type: task
of datablock: info:bmrb/51358
task.entry id: 51358
task.software id: 1
task.task: collection

51358,1,processing
type: task
of datablock: info:bmrb/51358
task.entry id: 51358
task.software id: 1
task.task: processing