info:bmrb/52226
type: datablock
references: doi:10.13018/BMR52226
alternative label: bmr52226
title: NMR chemical shifts of the human Roquin-1 ZnF domain
datablock name: 52226
has assembly category: assemblyCategory
has assembly bio function category: assembly bio functionCategory
has assigned chem shift list category: assigned chem shift listCategory
has atom chem shift category: atom chem shiftCategory
has chem comp category: chem compCategory
has chem comp atom category: chem comp atomCategory
has chem comp descriptor category: chem comp descriptorCategory
has chem comp identifier category: chem comp identifierCategory
has chem shift experiment category: chem shift experimentCategory
has chem shift ref category: chem shift refCategory
has chem shift reference category: chem shift referenceCategory
has chem shift software category: chem shift softwareCategory
has citation category: citationCategory
has citation author category: citation authorCategory
has citation keyword category: citation keywordCategory
has data set category: data setCategory
has datum category: datumCategory
has entity category: entityCategory
has entity assembly category: entity assemblyCategory
has entity common name category: entity common nameCategory
has entity comp index category: entity comp indexCategory
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has entity poly seq category: entity poly seqCategory
has entity systematic name category: entity systematic nameCategory
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has entry author category: entry authorCategory
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has experiment list category: experiment listCategory
has nmr spectrometer category: nmr spectrometerCategory
has release category: releaseCategory
has sample category: sampleCategory
has sample component category: sample componentCategory
has sample condition list category: sample condition listCategory
has sample condition variable category: sample condition variableCategory
has software category: softwareCategory
has task category: taskCategory

52226,1
type: assembly
of datablock: info:bmrb/52226
reference to entry: entry
assembly.entry id: 52226
assembly.id: 1
assembly.ambiguous conformational states: no
assembly.details: Molecular mass: 5568.51 Da (incl. TEV cleavage tag).
assembly.metal ions: 1
assembly.molecular mass: 5568.51
assembly.molecules in chemical exchange: no
assembly.name: Znf
assembly.non standard bonds: no
assembly.number of components: 2
assembly.organic ligands: 0
assembly.paramagnetic: no
assembly.sf category: assembly
assembly.sf framecode: assembly_1

1,RNA-binding within Roquin protein, mRNA suppression,52226
type: assembly bio function
of datablock: info:bmrb/52226
assembly bio function.assembly id: 1
assembly bio function.biological function: RNA-binding within Roquin protein, mRNA suppression, anti-autoimmunogenic
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52226,1
type: assigned chem shift list
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1,52226,1
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atom chem shift.val err: 0.015

1,52226,2
type: atom chem shift
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1,52226,3
type: atom chem shift
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1,52226,4
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atom chem shift.val err: 0.029

1,52226,5
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atom chem shift.val: 1.282
atom chem shift.val err: 0.025

1,52226,6
type: atom chem shift
of datablock: info:bmrb/52226
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atom chem shift.val: 1.282
atom chem shift.val err: 0.025

1,52226,7
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atom chem shift.val: 1.282
atom chem shift.val err: 0.025

1,52226,8
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1,52226,9
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1,52226,10
type: atom chem shift
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1,52226,11
type: atom chem shift
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1,52226,12
type: atom chem shift
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1,52226,13
type: atom chem shift
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1,52226,14
type: atom chem shift
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1,52226,15
type: atom chem shift
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1,52226,16
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1,52226,17
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1,52226,18
type: atom chem shift
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1,52226,19
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1,52226,20
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1,52226,21
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1,52226,22
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1,52226,23
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1,52226,25
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1,52226,27
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1,52226,28
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1,52226,29
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1,52226,30
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1,52226,32
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1,52226,33
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 33
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: 412
atom chem shift.comp id: SER
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: 58.489
atom chem shift.val err: 0.174

1,52226,34
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 34
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: 412
atom chem shift.comp id: SER
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: 63.648
atom chem shift.val err: 0.107

1,52226,35
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 35
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 4.203
atom chem shift.val err: 0.022

1,52226,36
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 36
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.722
atom chem shift.val err: 0.013

1,52226,37
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 37
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.721
atom chem shift.val err: 0.015

1,52226,38
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 38
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.348
atom chem shift.val err: 0.021

1,52226,39
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 39
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.348
atom chem shift.val err: 0.021

1,52226,40
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 40
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.581
atom chem shift.val err: 0.029

1,52226,41
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 41
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 1.833
atom chem shift.val err: 0.021

1,52226,42
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 42
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 2.883
atom chem shift.val err: 0.013

1,52226,43
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 43
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 2.897
atom chem shift.val err: 0.000

1,52226,44
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 44
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 176.606
atom chem shift.val err: 0.000

1,52226,45
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 45
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 56.359
atom chem shift.val err: 0.077

1,52226,46
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 46
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 32.538
atom chem shift.val err: 0.134

1,52226,47
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 47
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 24.837
atom chem shift.val err: 0.141

1,52226,48
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 48
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 28.815
atom chem shift.val err: 0.192

1,52226,49
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 49
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: 413
atom chem shift.comp id: LYS
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 42.112
atom chem shift.val err: 0.010

1,52226,50
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 50
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 7.912
atom chem shift.val err: 0.004

1,52226,51
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 51
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 4.168
atom chem shift.val err: 0.040

1,52226,52
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 52
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 2.657
atom chem shift.val err: 0.003

1,52226,53
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 53
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 2.646
atom chem shift.val err: 0.010

1,52226,54
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 54
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 6.720
atom chem shift.val err: 0.005

1,52226,55
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 55
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: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 6.713
atom chem shift.val err: 0.003

1,52226,56
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 56
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 6.445
atom chem shift.val err: 0.009

1,52226,57
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 57
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: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 6.445
atom chem shift.val err: 0.009

1,52226,58
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 58
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 174.105
atom chem shift.val err: 0.000

1,52226,59
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 59
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 59.223
atom chem shift.val err: 0.117

1,52226,60
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 60
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 38.345
atom chem shift.val err: 0.073

1,52226,61
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 61
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: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 132.874
atom chem shift.val err: 0.084

1,52226,62
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 62
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 132.874
atom chem shift.val err: 0.084

1,52226,63
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 63
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 117.562
atom chem shift.val err: 0.153

1,52226,64
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 64
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 117.562
atom chem shift.val err: 0.153

1,52226,65
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 65
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 414
atom chem shift.comp id: TYR
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: 122.820
atom chem shift.val err: 0.033

1,52226,66
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 66
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: 415
atom chem shift.comp id: LYS
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: 7.943
atom chem shift.val err: 0.021

1,52226,67
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 67
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: 415
atom chem shift.comp id: LYS
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: 3.370
atom chem shift.val err: 0.007

1,52226,68
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 68
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: 415
atom chem shift.comp id: LYS
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: 1.220
atom chem shift.val err: 0.009

1,52226,69
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 69
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: 415
atom chem shift.comp id: LYS
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: 2.337
atom chem shift.val err: 0.023

1,52226,70
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 70
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: 415
atom chem shift.comp id: LYS
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: 1.450
atom chem shift.val err: 0.027

1,52226,71
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 71
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: 415
atom chem shift.comp id: LYS
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: 1.320
atom chem shift.val err: 0.039

1,52226,72
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 72
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: 415
atom chem shift.comp id: LYS
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: 1.591
atom chem shift.val err: 0.026

1,52226,73
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 73
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: 415
atom chem shift.comp id: LYS
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: 1.591
atom chem shift.val err: 0.026

1,52226,74
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 74
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: 415
atom chem shift.comp id: LYS
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: 2.926
atom chem shift.val err: 0.034

1,52226,75
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 75
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: 415
atom chem shift.comp id: LYS
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: 2.926
atom chem shift.val err: 0.034

1,52226,76
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 76
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HZ1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HZ1
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 415
atom chem shift.comp id: LYS
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: 7.346
atom chem shift.val err: 0.000

1,52226,77
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 77
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HZ2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HZ2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 415
atom chem shift.comp id: LYS
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: 7.346
atom chem shift.val err: 0.000

1,52226,78
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 78
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HZ3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HZ3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 415
atom chem shift.comp id: LYS
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: 7.346
atom chem shift.val err: 0.000

1,52226,79
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 79
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 415
atom chem shift.comp id: LYS
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: 173.229
atom chem shift.val err: 0.000

1,52226,80
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 80
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: 415
atom chem shift.comp id: LYS
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: 58.041
atom chem shift.val err: 0.118

1,52226,81
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 81
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: 415
atom chem shift.comp id: LYS
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: 31.394
atom chem shift.val err: 0.113

1,52226,82
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 82
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: 415
atom chem shift.comp id: LYS
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: 25.220
atom chem shift.val err: 0.097

1,52226,83
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 83
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: 415
atom chem shift.comp id: LYS
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: 29.702
atom chem shift.val err: 0.193

1,52226,84
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 84
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: 415
atom chem shift.comp id: LYS
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: 42.121
atom chem shift.val err: 0.000

1,52226,85
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 85
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 415
atom chem shift.comp id: LYS
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: 120.524
atom chem shift.val err: 0.176

1,52226,86
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 86
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: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 7.413
atom chem shift.val err: 0.016

1,52226,87
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 87
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: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 4.206
atom chem shift.val err: 0.050

1,52226,88
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 88
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: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 4.041
atom chem shift.val err: 0.035

1,52226,89
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 89
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: HG21
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 0.908
atom chem shift.val err: 0.020

1,52226,90
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 90
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: HG22
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 0.908
atom chem shift.val err: 0.020

1,52226,91
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 91
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: HG23
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 0.908
atom chem shift.val err: 0.020

1,52226,92
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 92
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 173.479
atom chem shift.val err: 0.000

1,52226,93
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 93
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: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 61.784
atom chem shift.val err: 0.184

1,52226,94
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 94
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: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 69.076
atom chem shift.val err: 0.073

1,52226,95
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 95
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: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 21.781
atom chem shift.val err: 0.045

1,52226,96
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 96
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 416
atom chem shift.comp id: THR
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 103.534
atom chem shift.val err: 0.051

1,52226,97
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 97
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 7.803
atom chem shift.val err: 0.024

1,52226,98
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 98
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 4.687
atom chem shift.val err: 0.019

1,52226,99
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 99
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 2.887
atom chem shift.val err: 0.025

1,52226,100
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 100
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 3.111
atom chem shift.val err: 0.028

1,52226,101
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 101
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 7.155
atom chem shift.val err: 0.027

1,52226,102
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 102
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: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 7.155
atom chem shift.val err: 0.027

1,52226,103
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 103
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 6.741
atom chem shift.val err: 0.009

1,52226,104
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 104
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: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 6.719
atom chem shift.val err: 0.000

1,52226,105
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 105
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 175.188
atom chem shift.val err: 0.000

1,52226,106
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 106
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 56.680
atom chem shift.val err: 0.133

1,52226,107
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 107
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 41.563
atom chem shift.val err: 0.192

1,52226,108
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 108
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: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 133.455
atom chem shift.val err: 0.035

1,52226,109
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 109
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 133.455
atom chem shift.val err: 0.035

1,52226,110
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 110
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE1
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 117.985
atom chem shift.val err: 0.000

1,52226,111
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 111
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE2
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 117.985
atom chem shift.val err: 0.000

1,52226,112
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 112
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 417
atom chem shift.comp id: TYR
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 119.621
atom chem shift.val err: 0.127

1,52226,113
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 113
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 8.883
atom chem shift.val err: 0.018

1,52226,114
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 114
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 4.475
atom chem shift.val err: 0.024

1,52226,115
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 115
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.851
atom chem shift.val err: 0.016

1,52226,116
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 116
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.846
atom chem shift.val err: 0.000

1,52226,117
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 117
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 2.514
atom chem shift.val err: 0.043

1,52226,118
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 118
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 2.529
atom chem shift.val err: 0.043

1,52226,119
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 119
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.741
atom chem shift.val err: 0.028

1,52226,120
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 120
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: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.741
atom chem shift.val err: 0.028

1,52226,121
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 121
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: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.741
atom chem shift.val err: 0.028

1,52226,122
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 122
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 175.888
atom chem shift.val err: 0.000

1,52226,123
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 123
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 54.304
atom chem shift.val err: 0.095

1,52226,124
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 124
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 31.696
atom chem shift.val err: 0.163

1,52226,125
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 125
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 31.226
atom chem shift.val err: 0.655

1,52226,126
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 126
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 15.998
atom chem shift.val err: 0.041

1,52226,127
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 127
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 418
atom chem shift.comp id: MET
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 122.685
atom chem shift.val err: 0.070

1,52226,128
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 128
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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 8.923
atom chem shift.val err: 0.011

1,52226,129
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 129
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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 3.516
atom chem shift.val err: 0.034

1,52226,130
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 130
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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 2.651
atom chem shift.val err: 0.021

1,52226,131
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 131
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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 2.964
atom chem shift.val err: 0.031

1,52226,132
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 132
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 176.332
atom chem shift.val err: 0.000

1,52226,133
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 133
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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 61.133
atom chem shift.val err: 0.112

1,52226,134
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 134
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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 31.328
atom chem shift.val err: 0.139

1,52226,135
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 135
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 419
atom chem shift.comp id: CYS
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 126.460
atom chem shift.val err: 0.092

1,52226,136
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 136
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 8.493
atom chem shift.val err: 0.009

1,52226,137
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 137
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 3.985
atom chem shift.val err: 0.037

1,52226,138
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 138
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.585
atom chem shift.val err: 0.027

1,52226,139
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 139
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.581
atom chem shift.val err: 0.000

1,52226,140
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 140
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: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.564
atom chem shift.val err: 0.008

1,52226,141
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 141
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: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.564
atom chem shift.val err: 0.008

1,52226,142
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 142
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: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 3.126
atom chem shift.val err: 0.017

1,52226,143
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 143
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: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 3.126
atom chem shift.val err: 0.017

1,52226,144
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 144
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 177.475
atom chem shift.val err: 0.000

1,52226,145
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 145
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 58.192
atom chem shift.val err: 0.206

1,52226,146
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 146
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 30.075
atom chem shift.val err: 0.110

1,52226,147
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 147
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 26.972
atom chem shift.val err: 0.176

1,52226,148
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 148
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 44.166
atom chem shift.val err: 0.153

1,52226,149
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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: ARG
atom chem shift.auth seq id: 420
atom chem shift.comp id: ARG
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 130.114
atom chem shift.val err: 0.015

1,52226,150
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 150
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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 8.259
atom chem shift.val err: 0.010

1,52226,151
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 151
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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 4.567
atom chem shift.val err: 0.031

1,52226,152
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 152
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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 2.479
atom chem shift.val err: 0.015

1,52226,153
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 153
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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 2.753
atom chem shift.val err: 0.056

1,52226,154
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 154
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 176.543
atom chem shift.val err: 0.000

1,52226,155
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 155
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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 56.685
atom chem shift.val err: 0.103

1,52226,156
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 156
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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 42.494
atom chem shift.val err: 0.122

1,52226,157
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 157
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 421
atom chem shift.comp id: ASP
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 120.658
atom chem shift.val err: 0.075

1,52226,158
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 158
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 7.585
atom chem shift.val err: 0.025

1,52226,159
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 159
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 3.951
atom chem shift.val err: 0.021

1,52226,160
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 160
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 2.012
atom chem shift.val err: 0.028

1,52226,161
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 161
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 2.038
atom chem shift.val err: 0.000

1,52226,162
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 162
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 2.440
atom chem shift.val err: 0.037

1,52226,163
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 163
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 2.435
atom chem shift.val err: 0.037

1,52226,164
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 164
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 1.979
atom chem shift.val err: 0.029

1,52226,165
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 165
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: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 1.979
atom chem shift.val err: 0.029

1,52226,166
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 166
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: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 1.979
atom chem shift.val err: 0.029

1,52226,167
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 167
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 176.720
atom chem shift.val err: 0.000

1,52226,168
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 168
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 58.000
atom chem shift.val err: 0.226

1,52226,169
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 169
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 32.518
atom chem shift.val err: 0.164

1,52226,170
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 170
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 32.052
atom chem shift.val err: 0.223

1,52226,171
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 171
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 16.773
atom chem shift.val err: 0.097

1,52226,172
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 172
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 422
atom chem shift.comp id: MET
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 118.015
atom chem shift.val err: 0.074

1,52226,173
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 173
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 423
atom chem shift.comp id: LYS
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: 7.648
atom chem shift.val err: 0.004

1,52226,174
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 174
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: 423
atom chem shift.comp id: LYS
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: 4.222
atom chem shift.val err: 0.011

1,52226,175
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 175
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: 423
atom chem shift.comp id: LYS
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: 1.785
atom chem shift.val err: 0.014

1,52226,176
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 176
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: 423
atom chem shift.comp id: LYS
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: 1.884
atom chem shift.val err: 0.012

1,52226,177
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 177
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atom chem shift.auth seq id: 423
atom chem shift.comp id: LYS
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: 1.378
atom chem shift.val err: 0.004

1,52226,178
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 178
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atom chem shift.comp id: LYS
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: 1.602
atom chem shift.val err: 0.012

1,52226,179
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 179
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atom chem shift.atom type: H
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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: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 17
atom chem shift.val: 1.705
atom chem shift.val err: 0.000

1,52226,180
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 180
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atom chem shift.comp id: LYS
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: 1.705
atom chem shift.val err: 0.000

1,52226,181
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 17
atom chem shift.val: 2.891
atom chem shift.val err: 0.000

1,52226,182
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 182
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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: 17
atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.891
atom chem shift.val err: 0.000

1,52226,183
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 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: 17
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 17
atom chem shift.val: 176.996
atom chem shift.val err: 0.000

1,52226,184
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 184
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atom chem shift.comp id: LYS
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: 56.505
atom chem shift.val err: 0.184

1,52226,185
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 185
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atom chem shift.comp id: LYS
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: 32.315
atom chem shift.val err: 0.161

1,52226,186
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 186
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 17
atom chem shift.val: 24.840
atom chem shift.val err: 0.108

1,52226,187
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 187
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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: 17
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 17
atom chem shift.val: 28.929
atom chem shift.val err: 0.000

1,52226,188
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: LYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 42.105
atom chem shift.val err: 0.000

1,52226,189
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 189
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: N
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atom chem shift.auth comp id: LYS
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
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atom chem shift.val: 116.980
atom chem shift.val err: 0.039

1,52226,190
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 18
atom chem shift.val: 7.527
atom chem shift.val err: 0.006

1,52226,191
type: atom chem shift
of datablock: info:bmrb/52226
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: 4.273
atom chem shift.val err: 0.035

1,52226,192
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 192
atom chem shift.ambiguity code: 2
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.049
atom chem shift.val err: 0.009

1,52226,193
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.938
atom chem shift.val err: 0.021

1,52226,194
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 194
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 18
atom chem shift.val: 2.339
atom chem shift.val err: 0.027

1,52226,195
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.val: 2.339
atom chem shift.val err: 0.027

1,52226,196
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 7.447
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1,52226,197
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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1,52226,198
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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1,52226,199
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.val: 55.948
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1,52226,200
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.val: 29.337
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1,52226,201
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: GLN
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 33.475
atom chem shift.val err: 0.221

1,52226,202
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 202
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 424
atom chem shift.comp id: GLN
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 18
atom chem shift.val: 117.934
atom chem shift.val err: 0.054

1,52226,203
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 203
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 18
atom chem shift.val: 111.753
atom chem shift.val err: 0.008

1,52226,204
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 204
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 7.905
atom chem shift.val err: 0.001

1,52226,205
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 3.932
atom chem shift.val err: 0.023

1,52226,206
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 206
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 1.792
atom chem shift.val err: 0.043

1,52226,207
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 207
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.793
atom chem shift.val err: 0.046

1,52226,208
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 208
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 1.485
atom chem shift.val err: 0.027

1,52226,209
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 209
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atom chem shift.comp id: ARG
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: 1.485
atom chem shift.val err: 0.027

1,52226,210
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 210
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atom chem shift.comp id: ARG
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.025
atom chem shift.val err: 0.004

1,52226,211
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 211
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atom chem shift.comp id: ARG
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atom chem shift.val: 3.025
atom chem shift.val err: 0.004

1,52226,212
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.val: 180.978
atom chem shift.val err: 0.000

1,52226,213
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 213
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 425
atom chem shift.comp id: ARG
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: 58.720
atom chem shift.val err: 0.180

1,52226,214
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 214
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 425
atom chem shift.comp id: ARG
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: 30.256
atom chem shift.val err: 0.196

1,52226,215
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 215
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 425
atom chem shift.comp id: ARG
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: 27.809
atom chem shift.val err: 0.241

1,52226,216
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 216
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: ARG
atom chem shift.auth seq id: 425
atom chem shift.comp id: ARG
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: 43.460
atom chem shift.val err: 0.140

1,52226,217
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 217
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 425
atom chem shift.comp id: ARG
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: 127.844
atom chem shift.val err: 0.008

1,52226,218
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 218
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atom chem shift.atom id: H
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 8.045
atom chem shift.val err: 0.354

1,52226,219
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 219
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 4.078
atom chem shift.val err: 0.016

1,52226,220
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 220
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HA3
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atom chem shift.auth seq id: 426
atom chem shift.comp id: GLY
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: 3.752
atom chem shift.val err: 0.032

1,52226,221
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 221
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 426
atom chem shift.comp id: GLY
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: 174.419
atom chem shift.val err: 0.000

1,52226,222
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 222
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 426
atom chem shift.comp id: GLY
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: 45.267
atom chem shift.val err: 0.117

1,52226,223
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 223
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 426
atom chem shift.comp id: GLY
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: 112.340
atom chem shift.val err: 0.000

1,52226,224
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 224
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 427
atom chem shift.comp id: GLY
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: 7.889
atom chem shift.val err: 0.006

1,52226,225
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 225
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 3.823
atom chem shift.val err: 0.026

1,52226,226
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 226
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.894
atom chem shift.val err: 0.018

1,52226,227
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 227
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atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.val: 171.610
atom chem shift.val err: 0.000

1,52226,228
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.val: 44.294
atom chem shift.val err: 0.099

1,52226,229
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 427
atom chem shift.comp id: GLY
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 108.204
atom chem shift.val err: 0.051

1,52226,230
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 230
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: CYS
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atom chem shift.comp id: CYS
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: 8.234
atom chem shift.val err: 0.002

1,52226,231
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 231
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 22
atom chem shift.val: 4.422
atom chem shift.val err: 0.006

1,52226,232
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 232
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: CYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.553
atom chem shift.val err: 0.021

1,52226,233
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: CYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.673
atom chem shift.val err: 0.017

1,52226,234
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 234
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atom chem shift.comp id: CYS
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 176.391
atom chem shift.val err: 0.000

1,52226,235
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 235
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 22
atom chem shift.val: 56.460
atom chem shift.val err: 0.072

1,52226,236
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 236
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
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atom chem shift.val: 30.649
atom chem shift.val err: 0.162

1,52226,237
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 237
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 428
atom chem shift.comp id: CYS
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: 121.917
atom chem shift.val err: 0.044

1,52226,238
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 238
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: PRO
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: 4.449
atom chem shift.val err: 0.018

1,52226,239
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 239
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atom chem shift.val: 2.201
atom chem shift.val err: 0.027

1,52226,240
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 240
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 23
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atom chem shift.val: 1.973
atom chem shift.val err: 0.021

1,52226,241
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 241
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 1.878
atom chem shift.val err: 0.039

1,52226,242
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 242
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atom chem shift.auth seq id: 429
atom chem shift.comp id: PRO
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: 2.223
atom chem shift.val err: 0.005

1,52226,243
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 243
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.995
atom chem shift.val err: 0.028

1,52226,244
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 244
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 3.789
atom chem shift.val err: 0.009

1,52226,245
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 245
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 23
atom chem shift.val: 177.526
atom chem shift.val err: 0.000

1,52226,246
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 246
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 23
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atom chem shift.seq id: 23
atom chem shift.val: 64.152
atom chem shift.val err: 0.079

1,52226,247
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 247
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atom chem shift.comp id: PRO
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atom chem shift.val: 32.103
atom chem shift.val err: 0.107

1,52226,248
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 248
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atom chem shift.comp id: PRO
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atom chem shift.val: 26.742
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1,52226,249
type: atom chem shift
of datablock: info:bmrb/52226
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atom chem shift.id: 249
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 429
atom chem shift.comp id: PRO
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: 51.477
atom chem shift.val err: 0.060

1,52226,250
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 250
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 8.556
atom chem shift.val err: 0.005

1,52226,251
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 251
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: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 4.205
atom chem shift.val err: 0.026

1,52226,252
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 252
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 1.576
atom chem shift.val err: 0.015

1,52226,253
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 253
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 1.785
atom chem shift.val err: 0.020

1,52226,254
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 254
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: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 1.562
atom chem shift.val err: 0.005

1,52226,255
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 255
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: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 1.562
atom chem shift.val err: 0.005

1,52226,256
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 256
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 3.130
atom chem shift.val err: 0.015

1,52226,257
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 257
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 3.114
atom chem shift.val err: 0.000

1,52226,258
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 258
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 177.712
atom chem shift.val err: 0.000

1,52226,259
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 259
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 57.338
atom chem shift.val err: 0.000

1,52226,260
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 260
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 30.873
atom chem shift.val err: 0.090

1,52226,261
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 261
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 27.389
atom chem shift.val err: 0.182

1,52226,262
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 262
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 430
atom chem shift.comp id: ARG
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: 43.123
atom chem shift.val err: 0.193

1,52226,263
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 263
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 430
atom chem shift.comp id: ARG
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: 120.964
atom chem shift.val err: 0.055

1,52226,264
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 264
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: 431
atom chem shift.comp id: GLY
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 25
atom chem shift.val: 7.753
atom chem shift.val err: 0.005

1,52226,265
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 265
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 3.870
atom chem shift.val err: 0.016

1,52226,266
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 266
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 3.871
atom chem shift.val err: 0.010

1,52226,267
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 267
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 175.844
atom chem shift.val err: 0.000

1,52226,268
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 268
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: GLY
atom chem shift.auth seq id: 431
atom chem shift.comp id: GLY
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 25
atom chem shift.val: 46.980
atom chem shift.val err: 0.093

1,52226,269
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 269
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 431
atom chem shift.comp id: GLY
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: 109.415
atom chem shift.val err: 0.036

1,52226,270
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 270
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ALA
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 9.265
atom chem shift.val err: 0.020

1,52226,271
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 271
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 432
atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 4.175
atom chem shift.val err: 0.017

1,52226,272
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 272
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ALA
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 1.440
atom chem shift.val err: 0.005

1,52226,273
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 273
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.440
atom chem shift.val err: 0.005

1,52226,274
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 274
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ALA
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 26
atom chem shift.val: 1.440
atom chem shift.val err: 0.005

1,52226,275
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 275
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 432
atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 26
atom chem shift.val: 178.259
atom chem shift.val err: 0.000

1,52226,276
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 276
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 432
atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 54.024
atom chem shift.val err: 0.092

1,52226,277
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 277
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: ALA
atom chem shift.auth seq id: 432
atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 18.322
atom chem shift.val err: 0.057

1,52226,278
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 278
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 432
atom chem shift.comp id: ALA
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 117.702
atom chem shift.val err: 0.023

1,52226,279
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 279
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: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 7.967
atom chem shift.val err: 0.010

1,52226,280
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 280
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: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 4.431
atom chem shift.val err: 0.011

1,52226,281
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 281
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 3.862
atom chem shift.val err: 0.053

1,52226,282
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 282
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 3.754
atom chem shift.val err: 0.021

1,52226,283
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 283
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 173.731
atom chem shift.val err: 0.000

1,52226,284
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 284
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: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 58.489
atom chem shift.val err: 0.082

1,52226,285
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 285
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 63.681
atom chem shift.val err: 0.058

1,52226,286
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 286
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 433
atom chem shift.comp id: SER
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 111.688
atom chem shift.val err: 0.037

1,52226,287
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 287
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: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 7.499
atom chem shift.val err: 0.013

1,52226,288
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 288
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 3.990
atom chem shift.val err: 0.302

1,52226,289
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 289
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HB2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 2.728
atom chem shift.val err: 0.107

1,52226,290
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 290
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HB3
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atom chem shift.atom type: H
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atom chem shift.auth seq id: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 2.910
atom chem shift.val err: 0.150

1,52226,291
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 291
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: C
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atom chem shift.auth seq id: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 176.212
atom chem shift.val err: 0.000

1,52226,292
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 292
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 61.387
atom chem shift.val err: 2.254

1,52226,293
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 293
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.atom type: C
atom chem shift.auth atom id: CB
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atom chem shift.auth seq id: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 31.120
atom chem shift.val err: 0.154

1,52226,294
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 294
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 434
atom chem shift.comp id: CYS
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 124.984
atom chem shift.val err: 0.158

1,52226,295
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 295
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: THR
atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 7.979
atom chem shift.val err: 0.010

1,52226,296
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 296
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HA
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atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 4.132
atom chem shift.val err: 0.009

1,52226,297
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 297
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HB
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atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 29
atom chem shift.val: 4.363
atom chem shift.val err: 0.016

1,52226,298
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 298
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: HG1
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atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 1.058
atom chem shift.val err: 0.000

1,52226,299
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 299
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 1.160
atom chem shift.val err: 0.028

1,52226,300
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 300
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: THR
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atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 1.160
atom chem shift.val err: 0.028

1,52226,301
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 301
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.160
atom chem shift.val err: 0.028

1,52226,302
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 302
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 29
atom chem shift.val: 173.058
atom chem shift.val err: 0.000

1,52226,303
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 303
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 62.075
atom chem shift.val err: 0.071

1,52226,304
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 304
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.atom type: C
atom chem shift.auth atom id: CB
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atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 68.600
atom chem shift.val err: 0.153

1,52226,305
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 305
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 21.614
atom chem shift.val err: 0.108

1,52226,306
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 306
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 435
atom chem shift.comp id: THR
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 29
atom chem shift.val: 117.211
atom chem shift.val err: 0.046

1,52226,307
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 307
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: PHE
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 8.974
atom chem shift.val err: 0.018

1,52226,308
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 308
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 4.718
atom chem shift.val err: 0.019

1,52226,309
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 309
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 3.065
atom chem shift.val err: 0.019

1,52226,310
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 310
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: PHE
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 3.051
atom chem shift.val err: 0.012

1,52226,311
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 311
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: PHE
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.377
atom chem shift.val err: 0.027

1,52226,312
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 312
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.355
atom chem shift.val err: 0.023

1,52226,313
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 313
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.198
atom chem shift.val err: 0.023

1,52226,314
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 314
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.181
atom chem shift.val err: 0.000

1,52226,315
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 315
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 7.300
atom chem shift.val err: 0.011

1,52226,316
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 316
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 174.780
atom chem shift.val err: 0.000

1,52226,317
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 317
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atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 57.022
atom chem shift.val err: 0.146

1,52226,318
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 318
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 30
atom chem shift.val: 39.570
atom chem shift.val err: 0.070

1,52226,319
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 319
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 132.270
atom chem shift.val err: 0.155

1,52226,320
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 320
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 30
atom chem shift.val: 132.270
atom chem shift.val err: 0.155

1,52226,321
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 321
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE1
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 130.080
atom chem shift.val err: 0.000

1,52226,322
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 322
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE2
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 130.080
atom chem shift.val err: 0.000

1,52226,323
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 323
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CZ
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CZ
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 129.233
atom chem shift.val err: 0.085

1,52226,324
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 324
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 436
atom chem shift.comp id: PHE
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 30
atom chem shift.val: 123.748
atom chem shift.val err: 0.040

1,52226,325
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 325
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
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: 8.891
atom chem shift.val err: 0.010

1,52226,326
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 326
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 4.142
atom chem shift.val err: 0.027

1,52226,327
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 327
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB1
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 1.385
atom chem shift.val err: 0.023

1,52226,328
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 328
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 1.385
atom chem shift.val err: 0.023

1,52226,329
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 329
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 1.385
atom chem shift.val err: 0.023

1,52226,330
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 330
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
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: 177.984
atom chem shift.val err: 0.000

1,52226,331
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 331
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
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: 52.375
atom chem shift.val err: 0.084

1,52226,332
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 332
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
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: 20.013
atom chem shift.val err: 0.045

1,52226,333
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 333
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 437
atom chem shift.comp id: ALA
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: 122.717
atom chem shift.val err: 0.056

1,52226,334
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 334
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 9.261
atom chem shift.val err: 0.014

1,52226,335
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 335
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 5.112
atom chem shift.val err: 0.000

1,52226,336
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 336
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 2.955
atom chem shift.val err: 0.013

1,52226,337
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 337
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 3.482
atom chem shift.val err: 0.012

1,52226,338
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 338
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 7.526
atom chem shift.val err: 0.030

1,52226,339
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 339
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD2
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 6.798
atom chem shift.val err: 0.014

1,52226,340
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 340
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 7.856
atom chem shift.val err: 0.074

1,52226,341
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 341
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 173.948
atom chem shift.val err: 0.000

1,52226,342
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 342
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 54.896
atom chem shift.val err: 0.156

1,52226,343
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 343
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 29.857
atom chem shift.val err: 0.086

1,52226,344
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 344
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD2
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 124.844
atom chem shift.val err: 0.019

1,52226,345
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 345
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE1
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 139.563
atom chem shift.val err: 0.055

1,52226,346
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 346
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 438
atom chem shift.comp id: HIS
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: 117.642
atom chem shift.val err: 0.048

1,52226,347
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 347
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: 439
atom chem shift.comp id: SER
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 7.576
atom chem shift.val err: 0.009

1,52226,348
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 348
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: 439
atom chem shift.comp id: SER
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: 4.555
atom chem shift.val err: 0.017

1,52226,349
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 349
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 439
atom chem shift.comp id: SER
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: 4.139
atom chem shift.val err: 0.029

1,52226,350
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 350
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 439
atom chem shift.comp id: SER
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: 4.217
atom chem shift.val err: 0.033

1,52226,351
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 351
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 439
atom chem shift.comp id: SER
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: 173.819
atom chem shift.val err: 0.000

1,52226,352
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 352
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: 439
atom chem shift.comp id: SER
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: 57.115
atom chem shift.val err: 0.142

1,52226,353
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 353
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: 439
atom chem shift.comp id: SER
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: 65.577
atom chem shift.val err: 0.074

1,52226,354
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 354
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 439
atom chem shift.comp id: SER
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: 110.572
atom chem shift.val err: 0.046

1,52226,355
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 355
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: 440
atom chem shift.comp id: GLN
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: 8.091
atom chem shift.val err: 0.019

1,52226,356
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 356
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: 440
atom chem shift.comp id: GLN
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 3.926
atom chem shift.val err: 0.043

1,52226,357
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 357
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: 440
atom chem shift.comp id: GLN
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: 2.080
atom chem shift.val err: 0.025

1,52226,358
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 358
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: 440
atom chem shift.comp id: GLN
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.995
atom chem shift.val err: 0.017

1,52226,359
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 359
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: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
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: 2.350
atom chem shift.val err: 0.027

1,52226,360
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 360
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: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
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: 2.350
atom chem shift.val err: 0.027

1,52226,361
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 361
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
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
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: 6.656
atom chem shift.val err: 0.001

1,52226,362
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 362
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 7.741
atom chem shift.val err: 0.003

1,52226,363
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 363
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
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: 177.531
atom chem shift.val err: 0.020

1,52226,364
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 364
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: 440
atom chem shift.comp id: GLN
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: 58.934
atom chem shift.val err: 0.224

1,52226,365
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 365
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: 440
atom chem shift.comp id: GLN
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 27.602
atom chem shift.val err: 0.077

1,52226,366
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 366
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
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: 33.025
atom chem shift.val err: 0.090

1,52226,367
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 367
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 440
atom chem shift.comp id: GLN
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: 119.346
atom chem shift.val err: 0.146

1,52226,368
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 368
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: 440
atom chem shift.comp id: GLN
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: 111.910
atom chem shift.val err: 0.013

1,52226,369
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 369
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: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 8.750
atom chem shift.val err: 0.007

1,52226,370
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 370
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: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 3.974
atom chem shift.val err: 0.032

1,52226,371
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 371
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 1.984
atom chem shift.val err: 0.048

1,52226,372
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 372
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 1.984
atom chem shift.val err: 0.048

1,52226,373
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 373
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: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 2.238
atom chem shift.val err: 0.011

1,52226,374
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 374
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: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 2.474
atom chem shift.val err: 0.010

1,52226,375
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 375
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 179.244
atom chem shift.val err: 0.000

1,52226,376
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 376
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: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 59.867
atom chem shift.val err: 0.176

1,52226,377
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 377
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: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 29.149
atom chem shift.val err: 0.206

1,52226,378
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 378
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 37.858
atom chem shift.val err: 0.063

1,52226,379
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 379
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 441
atom chem shift.comp id: GLU
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 119.104
atom chem shift.val err: 0.042

1,52226,380
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 380
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 7.905
atom chem shift.val err: 0.022

1,52226,381
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 381
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 3.997
atom chem shift.val err: 0.035

1,52226,382
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 382
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 2.112
atom chem shift.val err: 0.009

1,52226,383
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 383
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 2.115
atom chem shift.val err: 0.009

1,52226,384
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 384
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 2.116
atom chem shift.val err: 0.000

1,52226,385
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 385
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 2.468
atom chem shift.val err: 0.015

1,52226,386
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 386
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 177.086
atom chem shift.val err: 0.000

1,52226,387
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 387
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 59.865
atom chem shift.val err: 0.109

1,52226,388
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 388
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 30.970
atom chem shift.val err: 0.062

1,52226,389
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 389
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 37.881
atom chem shift.val err: 0.053

1,52226,390
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 390
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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: 442
atom chem shift.comp id: GLU
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 120.860
atom chem shift.val err: 0.118

1,52226,391
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 391
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 7.756
atom chem shift.val err: 0.017

1,52226,392
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 392
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 4.141
atom chem shift.val err: 0.008

1,52226,393
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 393
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 1.742
atom chem shift.val err: 0.145

1,52226,394
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 394
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 1.623
atom chem shift.val err: 0.163

1,52226,395
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 395
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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 1.576
atom chem shift.val err: 0.030

1,52226,396
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 396
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: HD11
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.670
atom chem shift.val err: 0.034

1,52226,397
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 397
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: HD12
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.670
atom chem shift.val err: 0.034

1,52226,398
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 398
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: HD13
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.670
atom chem shift.val err: 0.034

1,52226,399
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 399
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.732
atom chem shift.val err: 0.022

1,52226,400
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 400
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.732
atom chem shift.val err: 0.022

1,52226,401
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 401
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: HD23
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 0.732
atom chem shift.val err: 0.022

1,52226,402
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 402
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 179.109
atom chem shift.val err: 0.000

1,52226,403
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 403
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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 57.899
atom chem shift.val err: 0.080

1,52226,404
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 404
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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 42.452
atom chem shift.val err: 0.100

1,52226,405
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 405
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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 26.818
atom chem shift.val err: 0.268

1,52226,406
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 406
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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 24.994
atom chem shift.val err: 0.232

1,52226,407
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 407
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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 25.489
atom chem shift.val err: 0.090

1,52226,408
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 408
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 443
atom chem shift.comp id: LEU
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 120.083
atom chem shift.val err: 0.128

1,52226,409
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 409
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 8.214
atom chem shift.val err: 0.007

1,52226,410
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 410
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 3.898
atom chem shift.val err: 0.031

1,52226,411
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 411
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 1.938
atom chem shift.val err: 0.076

1,52226,412
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 412
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 1.970
atom chem shift.val err: 0.044

1,52226,413
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 413
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 2.263
atom chem shift.val err: 0.019

1,52226,414
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 414
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 2.376
atom chem shift.val err: 0.017

1,52226,415
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 415
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 178.918
atom chem shift.val err: 0.000

1,52226,416
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 416
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 59.049
atom chem shift.val err: 0.095

1,52226,417
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 417
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 29.066
atom chem shift.val err: 0.225

1,52226,418
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 418
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: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 36.437
atom chem shift.val err: 0.165

1,52226,419
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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: GLU
atom chem shift.auth seq id: 444
atom chem shift.comp id: GLU
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 116.591
atom chem shift.val err: 0.040

1,52226,420
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 7.748
atom chem shift.val err: 0.010

1,52226,421
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 3.848
atom chem shift.val err: 0.043

1,52226,422
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.793
atom chem shift.val err: 0.023

1,52226,423
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.796
atom chem shift.val err: 0.024

1,52226,424
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 424
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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.433
atom chem shift.val err: 0.024

1,52226,425
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 425
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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.433
atom chem shift.val err: 0.024

1,52226,426
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 426
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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.426
atom chem shift.val err: 0.031

1,52226,427
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 427
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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 1.426
atom chem shift.val err: 0.031

1,52226,428
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 428
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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 2.617
atom chem shift.val err: 0.010

1,52226,429
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 429
atom chem shift.ambiguity code: 1
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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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 2.617
atom chem shift.val err: 0.010

1,52226,430
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 430
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 179.161
atom chem shift.val err: 0.000

1,52226,431
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 431
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: CA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 59.364
atom chem shift.val err: 0.186

1,52226,432
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 432
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 32.308
atom chem shift.val err: 0.068

1,52226,433
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 433
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 24.502
atom chem shift.val err: 0.000

1,52226,434
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 434
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 29.463
atom chem shift.val err: 0.045

1,52226,435
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.auth seq id: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 42.008
atom chem shift.val err: 0.040

1,52226,436
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 436
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: N
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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: 445
atom chem shift.comp id: LYS
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 119.971
atom chem shift.val err: 0.113

1,52226,437
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 437
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 446
atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 40
atom chem shift.val: 8.173
atom chem shift.val err: 0.008

1,52226,438
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 438
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 446
atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 40
atom chem shift.val: 4.199
atom chem shift.val err: 0.021

1,52226,439
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 439
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HB2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: PHE
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 40
atom chem shift.val: 2.997
atom chem shift.val err: 0.015

1,52226,440
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 440
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 2.981
atom chem shift.val err: 0.021

1,52226,441
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 441
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 7.440
atom chem shift.val err: 0.009

1,52226,442
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 7.440
atom chem shift.val err: 0.009

1,52226,443
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.ambiguity code: 1
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atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 7.148
atom chem shift.val err: 0.000

1,52226,444
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 444
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atom chem shift.comp id: PHE
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 7.185
atom chem shift.val err: 0.000

1,52226,445
type: atom chem shift
of datablock: info:bmrb/52226
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: 40
atom chem shift.val: 7.311
atom chem shift.val err: 0.007

1,52226,446
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 446
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atom chem shift.comp id: PHE
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 178.725
atom chem shift.val err: 0.000

1,52226,447
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.val: 61.728
atom chem shift.val err: 0.153

1,52226,448
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 448
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atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.val: 38.259
atom chem shift.val err: 0.065

1,52226,449
type: atom chem shift
of datablock: info:bmrb/52226
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: 131.657
atom chem shift.val err: 0.000

1,52226,450
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 131.657
atom chem shift.val err: 0.000

1,52226,451
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 130.410
atom chem shift.val err: 0.000

1,52226,452
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: PHE
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 130.410
atom chem shift.val err: 0.000

1,52226,453
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 129.520
atom chem shift.val err: 0.000

1,52226,454
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 454
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 446
atom chem shift.comp id: PHE
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 40
atom chem shift.val: 117.405
atom chem shift.val err: 0.030

1,52226,455
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 455
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atom chem shift.comp id: ARG
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atom chem shift.val: 8.471
atom chem shift.val err: 0.008

1,52226,456
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 456
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 4.027
atom chem shift.val err: 0.014

1,52226,457
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 457
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 41
atom chem shift.val: 1.828
atom chem shift.val err: 0.018

1,52226,458
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 458
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 41
atom chem shift.val: 1.837
atom chem shift.val err: 0.009

1,52226,459
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 459
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 447
atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 1.496
atom chem shift.val err: 0.018

1,52226,460
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 460
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 1.496
atom chem shift.val err: 0.018

1,52226,461
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 461
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 41
atom chem shift.val: 3.023
atom chem shift.val err: 0.000

1,52226,462
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 462
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
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atom chem shift.val: 3.131
atom chem shift.val err: 0.008

1,52226,463
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
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atom chem shift.seq id: 41
atom chem shift.val: 178.446
atom chem shift.val err: 0.000

1,52226,464
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 59.740
atom chem shift.val err: 0.092

1,52226,465
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 465
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 447
atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 30.241
atom chem shift.val err: 0.087

1,52226,466
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 466
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 447
atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 26.607
atom chem shift.val err: 0.000

1,52226,467
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 467
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 447
atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 43.260
atom chem shift.val err: 0.087

1,52226,468
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 468
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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: 447
atom chem shift.comp id: ARG
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 120.760
atom chem shift.val err: 0.034

1,52226,469
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 469
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 7.673
atom chem shift.val err: 0.005

1,52226,470
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 470
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 4.048
atom chem shift.val err: 0.021

1,52226,471
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 471
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.820
atom chem shift.val err: 0.033

1,52226,472
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 472
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.806
atom chem shift.val err: 0.000

1,52226,473
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 473
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.476
atom chem shift.val err: 0.000

1,52226,474
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 474
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.476
atom chem shift.val err: 0.000

1,52226,475
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 475
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.822
atom chem shift.val err: 0.021

1,52226,476
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 476
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 1.822
atom chem shift.val err: 0.021

1,52226,477
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 477
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 2.885
atom chem shift.val err: 0.000

1,52226,478
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 478
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 2.885
atom chem shift.val err: 0.000

1,52226,479
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 479
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 177.962
atom chem shift.val err: 0.000

1,52226,480
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 480
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 58.063
atom chem shift.val err: 0.096

1,52226,481
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 481
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 32.363
atom chem shift.val err: 0.110

1,52226,482
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 482
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 25.296
atom chem shift.val err: 0.000

1,52226,483
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 483
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 29.082
atom chem shift.val err: 0.280

1,52226,484
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 484
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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 42.089
atom chem shift.val err: 0.000

1,52226,485
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 485
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 448
atom chem shift.comp id: LYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 118.270
atom chem shift.val err: 0.058

1,52226,486
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 486
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 7.623
atom chem shift.val err: 0.015

1,52226,487
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 487
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 4.168
atom chem shift.val err: 0.012

1,52226,488
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 488
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.015
atom chem shift.val err: 0.018

1,52226,489
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 489
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.034
atom chem shift.val err: 0.000

1,52226,490
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 490
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: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.391
atom chem shift.val err: 0.000

1,52226,491
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 491
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: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.391
atom chem shift.val err: 0.000

1,52226,492
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 492
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.001
atom chem shift.val err: 0.028

1,52226,493
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 493
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: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.001
atom chem shift.val err: 0.028

1,52226,494
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 494
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
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atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 2.001
atom chem shift.val err: 0.028

1,52226,495
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 495
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 176.622
atom chem shift.val err: 0.000

1,52226,496
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 496
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 57.222
atom chem shift.val err: 0.198

1,52226,497
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 497
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 32.990
atom chem shift.val err: 0.250

1,52226,498
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 498
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 31.901
atom chem shift.val err: 0.000

1,52226,499
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 499
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CE
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CE
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 16.981
atom chem shift.val err: 0.110

1,52226,500
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 500
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 449
atom chem shift.comp id: MET
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 118.167
atom chem shift.val err: 0.039

1,52226,501
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 501
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 7.948
atom chem shift.val err: 0.007

1,52226,502
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 502
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 4.619
atom chem shift.val err: 0.017

1,52226,503
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 503
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 2.798
atom chem shift.val err: 0.027

1,52226,504
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 504
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 2.706
atom chem shift.val err: 0.029

1,52226,505
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 505
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 7.442
atom chem shift.val err: 0.002

1,52226,506
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 506
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 6.988
atom chem shift.val err: 0.003

1,52226,507
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 507
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 175.067
atom chem shift.val err: 0.000

1,52226,508
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 508
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 53.663
atom chem shift.val err: 0.076

1,52226,509
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 509
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 38.953
atom chem shift.val err: 0.084

1,52226,510
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 510
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 117.870
atom chem shift.val err: 0.111

1,52226,511
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 511
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: 450
atom chem shift.comp id: ASN
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 112.788
atom chem shift.val err: 0.022

1,52226,512
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 512
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 7.900
atom chem shift.val err: 0.015

1,52226,513
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 513
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 4.211
atom chem shift.val err: 0.005

1,52226,514
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 514
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.747
atom chem shift.val err: 0.000

1,52226,515
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 515
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.747
atom chem shift.val err: 0.000

1,52226,516
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 516
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.353
atom chem shift.val err: 0.000

1,52226,517
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 517
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.353
atom chem shift.val err: 0.000

1,52226,518
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 518
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.794
atom chem shift.val err: 0.034

1,52226,519
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 519
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 1.794
atom chem shift.val err: 0.034

1,52226,520
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 520
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 2.903
atom chem shift.val err: 0.000

1,52226,521
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 521
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 2.903
atom chem shift.val err: 0.000

1,52226,522
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 522
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 176.175
atom chem shift.val err: 0.000

1,52226,523
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 523
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 56.747
atom chem shift.val err: 0.003

1,52226,524
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 524
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 32.671
atom chem shift.val err: 0.084

1,52226,525
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 525
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 24.762
atom chem shift.val err: 0.000

1,52226,526
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 526
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 28.888
atom chem shift.val err: 0.000

1,52226,527
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 527
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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 42.124
atom chem shift.val err: 0.000

1,52226,528
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 528
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 451
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 120.840
atom chem shift.val err: 0.106

1,52226,529
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 529
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 8.119
atom chem shift.val err: 0.008

1,52226,530
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 530
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 4.241
atom chem shift.val err: 0.019

1,52226,531
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 531
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 1.724
atom chem shift.val err: 0.012

1,52226,532
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 532
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 1.726
atom chem shift.val err: 0.000

1,52226,533
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 533
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 1.559
atom chem shift.val err: 0.005

1,52226,534
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 534
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 1.542
atom chem shift.val err: 0.000

1,52226,535
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 535
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: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 3.146
atom chem shift.val err: 0.028

1,52226,536
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 536
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: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 3.146
atom chem shift.val err: 0.028

1,52226,537
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 537
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 175.934
atom chem shift.val err: 0.000

1,52226,538
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 538
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 56.235
atom chem shift.val err: 0.059

1,52226,539
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 539
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 30.623
atom chem shift.val err: 0.108

1,52226,540
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 540
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 28.929
atom chem shift.val err: 0.244

1,52226,541
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 541
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 43.362
atom chem shift.val err: 0.000

1,52226,542
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 542
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 452
atom chem shift.comp id: ARG
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 121.441
atom chem shift.val err: 0.046

1,52226,543
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 543
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 8.204
atom chem shift.val err: 0.003

1,52226,544
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 544
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 4.343
atom chem shift.val err: 0.031

1,52226,545
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 545
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: 453
atom chem shift.comp id: LEU
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: 1.571
atom chem shift.val err: 0.029

1,52226,546
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 546
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: 453
atom chem shift.comp id: LEU
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: 1.623
atom chem shift.val err: 0.008

1,52226,547
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 547
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: 453
atom chem shift.comp id: LEU
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: 1.554
atom chem shift.val err: 0.000

1,52226,548
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 548
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: HD11
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 0.781
atom chem shift.val err: 0.008

1,52226,549
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 549
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: HD12
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 0.781
atom chem shift.val err: 0.008

1,52226,550
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 550
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: HD13
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 0.781
atom chem shift.val err: 0.008

1,52226,551
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 551
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 0.842
atom chem shift.val err: 0.038

1,52226,552
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 552
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 0.842
atom chem shift.val err: 0.038

1,52226,553
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 553
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: HD23
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 0.842
atom chem shift.val err: 0.038

1,52226,554
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 554
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 453
atom chem shift.comp id: LEU
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: 176.217
atom chem shift.val err: 0.000

1,52226,555
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 555
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: 453
atom chem shift.comp id: LEU
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: 55.339
atom chem shift.val err: 0.120

1,52226,556
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 556
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: 453
atom chem shift.comp id: LEU
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: 42.202
atom chem shift.val err: 0.139

1,52226,557
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 557
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: 453
atom chem shift.comp id: LEU
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: 26.944
atom chem shift.val err: 0.108

1,52226,558
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 558
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: 453
atom chem shift.comp id: LEU
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: 23.321
atom chem shift.val err: 0.214

1,52226,559
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 559
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: 453
atom chem shift.comp id: LEU
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: 24.909
atom chem shift.val err: 0.238

1,52226,560
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 560
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 453
atom chem shift.comp id: LEU
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: 124.072
atom chem shift.val err: 0.048

1,52226,561
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 561
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: 454
atom chem shift.comp id: VAL
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: 7.484
atom chem shift.val err: 0.009

1,52226,562
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 562
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: 454
atom chem shift.comp id: VAL
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 3.977
atom chem shift.val err: 0.024

1,52226,563
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 563
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: 454
atom chem shift.comp id: VAL
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: 1.990
atom chem shift.val err: 0.014

1,52226,564
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 564
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: HG11
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 0.796
atom chem shift.val err: 0.001

1,52226,565
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 565
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: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 0.796
atom chem shift.val err: 0.001

1,52226,566
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 566
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: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 0.796
atom chem shift.val err: 0.001

1,52226,567
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 567
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: HG21
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 0.816
atom chem shift.val err: 0.001

1,52226,568
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 568
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: HG22
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 0.816
atom chem shift.val err: 0.001

1,52226,569
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 569
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: HG23
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 0.816
atom chem shift.val err: 0.001

1,52226,570
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 570
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 454
atom chem shift.comp id: VAL
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: 180.792
atom chem shift.val err: 0.000

1,52226,571
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 571
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: 454
atom chem shift.comp id: VAL
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: 63.409
atom chem shift.val err: 0.106

1,52226,572
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 572
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: 454
atom chem shift.comp id: VAL
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: 33.332
atom chem shift.val err: 0.074

1,52226,573
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 573
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: 454
atom chem shift.comp id: VAL
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: 20.025
atom chem shift.val err: 0.056

1,52226,574
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 574
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: 454
atom chem shift.comp id: VAL
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: 21.452
atom chem shift.val err: 0.058

1,52226,575
type: atom chem shift
of datablock: info:bmrb/52226
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52226
atom chem shift.id: 575
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 454
atom chem shift.comp id: VAL
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: 124.058
atom chem shift.val err: 0.131

52226,ZN
type: chem comp
of datablock: info:bmrb/52226
reference to entry: entry
chem comp.entry id: 52226
chem comp.id: ZN
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: ZN
chem comp.formal charge: 2+
chem comp.formula: Zn
chem comp.formula weight: 65.409
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/Zn/q+2
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.name: ZINC ION
chem comp.number atoms all: 1
chem comp.number atoms nh: 1
chem comp.pdb code: ZN
chem comp.processing site: RCSB
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_ZN
chem comp.three letter code: ZN
chem comp.type: NON-POLYMER

info:pdb-ccd/ZN

pdb-ccd:ZN

info:pdb.ligand/ZN

pdb.ligand:ZN

ZN,ZN,52226
type: chem comp atom
of datablock: info:bmrb/52226
reference to entry: entry
chem comp atom.atom id: ZN
chem comp atom.comp id: ZN
chem comp atom.entry id: 52226
chem comp atom.align: 0
chem comp atom.alt atom id: ZN
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: ZN
chem comp atom.charge: 2
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.000
chem comp atom.model cartn x ideal: 0.000
chem comp atom.model cartn y: 0.000
chem comp atom.model cartn y ideal: 0.000
chem comp atom.model cartn z: 0.000
chem comp atom.model cartn z ideal: 0.000
chem comp atom.pdb atom id: ZN
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: ZN

http://bmrbpub.pdbj.org/rdf/bmr52226/chem_comp_descriptor/ZN,InChI%3D1S%2FZn%2Fq%2B2,52226,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: InChI=1S/Zn/q+2
chem comp descriptor.entry id: 52226
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

ZN,PTFCDOFLOPIGGS-UHFFFAOYSA-N,52226,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: PTFCDOFLOPIGGS-UHFFFAOYSA-N
chem comp descriptor.entry id: 52226
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

ZN,[Zn++],52226,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: [Zn++]
chem comp descriptor.entry id: 52226
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

ZN,[Zn++],52226,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: [Zn++]
chem comp descriptor.entry id: 52226
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

ZN,[Zn+2],52226,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: [Zn+2]
chem comp descriptor.entry id: 52226
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

ZN,[Zn+2],52226,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: [Zn+2]
chem comp descriptor.entry id: 52226
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

ZN,[Zn+2],52226,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/52226
chem comp descriptor.comp id: ZN
chem comp descriptor.descriptor: [Zn+2]
chem comp descriptor.entry id: 52226
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

ZN,52226,zinc,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/52226
chem comp identifier.comp id: ZN
chem comp identifier.entry id: 52226
chem comp identifier.identifier: zinc
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

ZN,52226,zinc(+2) cation,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/52226
chem comp identifier.comp id: ZN
chem comp identifier.entry id: 52226
chem comp identifier.identifier: zinc(+2) cation
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

1,52226,1
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: 1D 1H
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,2
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 2
chem shift experiment.experiment name: 2D 1H-15N HSQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,3
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 3
chem shift experiment.experiment name: 2D 1H-13C HSQC aliphatic
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,4
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 4
chem shift experiment.experiment name: 3D CCH-TOCSY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,5
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 5
chem shift experiment.experiment name: 3D 1H-15N NOESY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,6
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 6
chem shift experiment.experiment name: 3D 1H-13C NOESY aromatic
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,7
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 7
chem shift experiment.experiment name: 2D 1H-13C HSQC aromatic
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,8
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 8
chem shift experiment.experiment name: 3D HN(CA)CO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,9
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 9
chem shift experiment.experiment name: 3D HBHANH
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,10
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 10
chem shift experiment.experiment name: 3D HNCACB
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,11
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 11
chem shift experiment.experiment name: 3D 1H-13C NOESY aliphatic
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52226,12
type: chem shift experiment
of datablock: info:bmrb/52226
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52226
chem shift experiment.experiment id: 12
chem shift experiment.experiment name: 3D HNCO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

13,C,1,52226,DSS
type: chem shift ref
of datablock: info:bmrb/52226
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: 52226
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl carbon
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0
chem shift ref.correction val cit id: 0
chem shift ref.external ref loc: separate tube (no insert) similar to the experimental sample tube
chem shift ref.indirect shift ratio: 1
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: external
chem shift ref.ref type: direct

1,H,1,52226,DSS
type: chem shift ref
of datablock: info:bmrb/52226
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: 52226
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
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 1
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

15,N,1,52226,urea
type: chem shift ref
of datablock: info:bmrb/52226
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: 52226
chem shift ref.mol common name: urea
chem shift ref.atom group: nitrogen
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0
chem shift ref.correction val cit id: 0
chem shift ref.external ref loc: separate tube (no insert) similar to the experimental sample tube
chem shift ref.indirect shift ratio: 1
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: external
chem shift ref.ref type: direct

52226,1
type: chem shift reference
of datablock: info:bmrb/52226
reference to entry: entry
chem shift reference.entry id: 52226
chem shift reference.id: 1
chem shift reference.name: CSref1
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chem_shift_reference_1

1,52226,1
type: chem shift software
of datablock: info:bmrb/52226
chem shift software.assigned chem shift list id: 1
chem shift software.entry id: 52226
chem shift software.software id: 1
chem shift software.method id: 0
chem shift software.software label: software_1

1,52226,2
type: chem shift software
of datablock: info:bmrb/52226
chem shift software.assigned chem shift list id: 1
chem shift software.entry id: 52226
chem shift software.software id: 2
chem shift software.method id: 0
chem shift software.software label: software_2

52226,1
type: citation
of datablock: info:bmrb/52226
reference to entry: entry
citation.entry id: 52226
citation.id: 1
citation.class: entry citation
citation.doi: 10.1093/nar/gkae555
citation.journal abbrev: Nucleic Acids Res.
citation.journal issn: 0305-1048
citation.journal name full: Nucleic acids research
citation.pubmed id: 38953172
citation.sf category: citations
citation.sf framecode: citations_1
citation.status: in preparation
citation.title: Structure and RNA-binding of the helically extended Roquin CCCH-type zinc finger.
citation.type: journal
citation.year: 2024

info:doi/10.1093/nar/gkae555

doi:10.1093/nar/gkae555

urn:ISSN:0305-1048

issn:0305-1048

info:pmid/38953172

pubmed:38953172

1,52226,1
type: citation author
of datablock: info:bmrb/52226
citation author.citation id: 1
citation author.entry id: 52226
citation author.ordinal: 1
citation author.family name: Tants
citation author.given name: Jan-Niklas
citation author.pdbx name: Tants, J.

1,52226,2
type: citation author
of datablock: info:bmrb/52226
citation author.citation id: 1
citation author.entry id: 52226
citation author.ordinal: 2
citation author.family name: Oberstrass
citation author.given name: Lasse
citation author.pdbx name: Oberstrass, L.

1,52226,3
type: citation author
of datablock: info:bmrb/52226
citation author.citation id: 1
citation author.entry id: 52226
citation author.ordinal: 3
citation author.family name: Weigand
citation author.given name: Julia
citation author.pdbx name: Weigand, J.

1,52226,4
type: citation author
of datablock: info:bmrb/52226
citation author.citation id: 1
citation author.entry id: 52226
citation author.ordinal: 4
citation author.family name: Schlundt
citation author.given name: Andreas
citation author.pdbx name: Schlundt, A.

1,52226,zinc finger, RNA-binding, DNA-binding, mRNA regulation
type: citation keyword
of datablock: info:bmrb/52226
citation keyword.citation id: 1
citation keyword.entry id: 52226
citation keyword.keyword: zinc finger, RNA-binding, DNA-binding, mRNA regulation, immune regulation, Roquin protein

52226,assigned chemical shifts
type: data set
of datablock: info:bmrb/52226
reference to entry: entry
data set.entry id: 52226
data set.type: assigned_chemical_shifts
data set.count: 1

52226,13C chemical shifts
type: datum
of datablock: info:bmrb/52226
reference to entry: entry
datum.entry id: 52226
datum.type: 13C chemical shifts
datum.count: 208

52226,15N chemical shifts
type: datum
of datablock: info:bmrb/52226
reference to entry: entry
datum.entry id: 52226
datum.type: 15N chemical shifts
datum.count: 43

52226,1H chemical shifts
type: datum
of datablock: info:bmrb/52226
reference to entry: entry
datum.entry id: 52226
datum.type: 1H chemical shifts
datum.count: 324

52226,1
type: entity
of datablock: info:bmrb/52226
reference to entry: entry
entity.entry id: 52226
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 5568.467
entity.name: entity 1
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 48
entity.paramagnetic: no
entity.parent entity id: 1
entity.polymer author defined seq: 407-454
entity.polymer author seq details: residues 407-410 are artificial, natural sequence starts with His 411
entity.polymer seq one letter code: GAMAHSKYKTYMCRDMKQRGGCPRGASCTFAHSQEELEKFRKMNKRLV
entity.polymer seq one letter code can: GAMAHSKYKTYMCRDMKQRGGCPRGASCTFAHSQEELEKFRKMNKRLV
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: entity_1
entity.thiol state: all free
entity.type: polymer

52226,2
type: entity
of datablock: info:bmrb/52226
reference to entry: entry
entity.entry id: 52226
entity.id: 2
entity.bmrb code: ZN
entity.formula weight: 65.409
entity.name: entity ZN
entity.nonpolymer comp id: ZN
entity.nonpolymer comp label: chem_comp_ZN
entity.number of nonpolymer components: 1
entity.parent entity id: 2
entity.polymer seq one letter code can: (ZN)
entity.sf category: entity
entity.sf framecode: entity_ZN
entity.type: non-polymer

1,52226,1
type: entity assembly
of datablock: info:bmrb/52226
entity assembly.assembly id: 1
entity assembly.entry id: 52226
entity assembly.id: 1
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Znf
entity assembly.entity id: 1
entity assembly.entity label: entity_1
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,52226,2
type: entity assembly
of datablock: info:bmrb/52226
entity assembly.assembly id: 1
entity assembly.entry id: 52226
entity assembly.id: 2
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Zn
entity assembly.entity id: 2
entity assembly.entity label: entity_ZN
entity assembly.experimental data reported: no
entity assembly.physical state: native

2,52226,ZINC ION,BMRB
type: entity common name
of datablock: info:bmrb/52226
entity common name.entity id: 2
entity common name.entry id: 52226
entity common name.name: ZINC ION
entity common name.type: BMRB

1,52226,1
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 1
entity comp index.auth seq id: 407
entity comp index.comp id: GLY

1,52226,2
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 2
entity comp index.auth seq id: 408
entity comp index.comp id: ALA

1,52226,3
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 3
entity comp index.auth seq id: 409
entity comp index.comp id: MET

1,52226,4
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 4
entity comp index.auth seq id: 410
entity comp index.comp id: ALA

1,52226,5
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 5
entity comp index.auth seq id: 411
entity comp index.comp id: HIS

1,52226,6
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 6
entity comp index.auth seq id: 412
entity comp index.comp id: SER

1,52226,7
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 7
entity comp index.auth seq id: 413
entity comp index.comp id: LYS

1,52226,8
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 8
entity comp index.auth seq id: 414
entity comp index.comp id: TYR

1,52226,9
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 9
entity comp index.auth seq id: 415
entity comp index.comp id: LYS

1,52226,10
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 10
entity comp index.auth seq id: 416
entity comp index.comp id: THR

1,52226,11
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 11
entity comp index.auth seq id: 417
entity comp index.comp id: TYR

1,52226,12
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 12
entity comp index.auth seq id: 418
entity comp index.comp id: MET

1,52226,13
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 13
entity comp index.auth seq id: 419
entity comp index.comp id: CYS

1,52226,14
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 14
entity comp index.auth seq id: 420
entity comp index.comp id: ARG

1,52226,15
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 15
entity comp index.auth seq id: 421
entity comp index.comp id: ASP

1,52226,16
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 16
entity comp index.auth seq id: 422
entity comp index.comp id: MET

1,52226,17
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 17
entity comp index.auth seq id: 423
entity comp index.comp id: LYS

1,52226,18
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 18
entity comp index.auth seq id: 424
entity comp index.comp id: GLN

1,52226,19
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 19
entity comp index.auth seq id: 425
entity comp index.comp id: ARG

1,52226,20
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 20
entity comp index.auth seq id: 426
entity comp index.comp id: GLY

1,52226,21
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 21
entity comp index.auth seq id: 427
entity comp index.comp id: GLY

1,52226,22
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 22
entity comp index.auth seq id: 428
entity comp index.comp id: CYS

1,52226,23
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 23
entity comp index.auth seq id: 429
entity comp index.comp id: PRO

1,52226,24
type: entity comp index
of datablock: info:bmrb/52226
entity comp index.entity id: 1
entity comp index.entry id: 52226
entity comp index.id: 24
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http://bmrbpub.pdbj.org/rdf/bmr52226/entry/52226
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entry.id: 52226
entry.accession date: 2023-12-01Z
entry.assigned pdb deposition code: <!DOCTYPE html PUBLIC -//W3C//DTD XHTML 1.0 Strict//EN
entry.details: Backbone and sidechain NMR chemical shifts of the human and murine Roquin-1 ZnF domain
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2023-12-03Z
entry.nmr star version: 3.2.14.0
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entry.original release date: 2023-12-03Z
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entry.title: NMR chemical shifts of the human Roquin-1 ZnF domain
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experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D CCH-TOCSY
experiment.nmr spectrometer id: 2
experiment.nmr spectrometer label: NMR_spectrometer_3
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,5
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 5
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D 1H-15N NOESY
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

52226,1,6
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 6
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D 1H-13C NOESY aromatic
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,7
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 7
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 2D 1H-13C HSQC aromatic
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,8
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 8
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D HN(CA)CO
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,9
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 9
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D HBHANH
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,10
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 10
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D HNCACB
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,11
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 11
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D 1H-13C NOESY aliphatic
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1,12
type: experiment
of datablock: info:bmrb/52226
experiment.entry id: 52226
experiment.experiment list id: 1
experiment.id: 12
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D HNCO
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 2
experiment.sample label: sample_2
experiment.sample state: isotropic

52226,1
type: experiment list
of datablock: info:bmrb/52226
reference to entry: entry
experiment list.entry id: 52226
experiment list.id: 1
experiment list.sf category: experiment_list
experiment list.sf framecode: experiment_list_1

52226,1
type: nmr spectrometer
of datablock: info:bmrb/52226
reference to entry: entry
nmr spectrometer.entry id: 52226
nmr spectrometer.id: 1
nmr spectrometer.field strength: 500
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: Avance
nmr spectrometer.name: Bruker500
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: NMR_spectrometer_1

52226,2
type: nmr spectrometer
of datablock: info:bmrb/52226
reference to entry: entry
nmr spectrometer.entry id: 52226
nmr spectrometer.id: 2
nmr spectrometer.field strength: 600
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: Avance
nmr spectrometer.name: Bruker600
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: NMR_spectrometer_3

52226,3
type: nmr spectrometer
of datablock: info:bmrb/52226
reference to entry: entry
nmr spectrometer.entry id: 52226
nmr spectrometer.id: 3
nmr spectrometer.field strength: 800
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: AVANCE III
nmr spectrometer.name: Bruker800
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: NMR_spectrometer_2

52226,1
type: release
of datablock: info:bmrb/52226
reference to entry: entry
release.entry id: 52226
release.release number: 1
release.author: BMRB
release.date: 2024-06-23Z
release.type: original

52226,1
type: sample
of datablock: info:bmrb/52226
reference to entry: entry
sample.entry id: 52226
sample.id: 1
sample.aggregate sample number: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.details: 15N 1H
sample.name: sample1
sample.sf category: sample
sample.sf framecode: sample_1
sample.solvent system: 90% H2O/10% D2O
sample.type: solution

52226,2
type: sample
of datablock: info:bmrb/52226
reference to entry: entry
sample.entry id: 52226
sample.id: 2
sample.aggregate sample number: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.details: 13C 15N 1H
sample.name: sample 2
sample.sf category: sample
sample.sf framecode: sample_2
sample.solvent system: 90% H2O/10% D2O
sample.type: solution

52226,1,1
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 360
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: [U-99% 15N]
sample component.mol common name: Roquin zinc finger

52226,2,1
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 20
sample component.concentration val units: uM
sample component.entity id: 2
sample component.entity label: entity_ZN
sample component.isotopic labeling: natural abundance
sample component.mol common name: zinc

52226,3,1
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 150
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

52226,4,1
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 4
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 25
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: TRIS

52226,5,1
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 5
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 2
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: TCEP

52226,6,2
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 6
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 740
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: [U-99% 13C; U-99% 15N]
sample component.mol common name: Roquin zinc finger

52226,7,2
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 7
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 20
sample component.concentration val units: uM
sample component.entity id: 2
sample component.entity label: entity_ZN
sample component.isotopic labeling: natural abundance
sample component.mol common name: zinc

52226,8,2
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 8
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 150
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

52226,9,2
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 9
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 25
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: TRIS

52226,10,2
type: sample component
of datablock: info:bmrb/52226
sample component.entry id: 52226
sample component.id: 10
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 2
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: TCEP

52226,1
type: sample condition list
of datablock: info:bmrb/52226
reference to entry: entry
sample condition list.entry id: 52226
sample condition list.id: 1
sample condition list.name: condition 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

52226,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/52226
sample condition variable.entry id: 52226
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 0.15
sample condition variable.val units: M

52226,1,pH
type: sample condition variable
of datablock: info:bmrb/52226
sample condition variable.entry id: 52226
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 7.0
sample condition variable.val units: pH

52226,1,pressure
type: sample condition variable
of datablock: info:bmrb/52226
sample condition variable.entry id: 52226
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

52226,1,temperature
type: sample condition variable
of datablock: info:bmrb/52226
sample condition variable.entry id: 52226
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

52226,1
type: software
of datablock: info:bmrb/52226
reference to entry: entry
software.entry id: 52226
software.id: 1
software.name: TOPSPIN
software.sf category: software
software.sf framecode: software_1
software.version: 3

52226,2
type: software
of datablock: info:bmrb/52226
reference to entry: entry
software.entry id: 52226
software.id: 2
software.name: CcpNMR
software.sf category: software
software.sf framecode: software_2
software.version: 2.1

52226,2,chemical shift assignment
type: task
of datablock: info:bmrb/52226
task.entry id: 52226
task.software id: 2
task.task: chemical shift assignment

52226,1,collection
type: task
of datablock: info:bmrb/52226
task.entry id: 52226
task.software id: 1
task.task: collection

52226,1,processing
type: task
of datablock: info:bmrb/52226
task.entry id: 52226
task.software id: 1
task.task: processing