info:bmrb/51729
type: datablock
references: doi:10.13018/BMR51729
alternative label: bmr51729
title: 1H, 13C, and 15N Chemical Shift Assignments for a-Cobratoxin from Naja Atra
datablock name: 51729
has assembly category: assemblyCategory
has assigned chem shift list category: assigned chem shift listCategory
has atom chem shift category: atom chem shiftCategory
has bond category: bondCategory
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 data set category: data setCategory
has datum category: datumCategory
has entity category: entityCategory
has entity assembly category: entity assemblyCategory
has entity comp index category: entity comp indexCategory
has entity experimental src category: entity experimental srcCategory
has entity experimental src list category: entity experimental src listCategory
has entity natural src category: entity natural srcCategory
has entity natural src list category: entity natural src listCategory
has entity poly seq category: entity poly seqCategory
has entry category: entryCategory
has entry author category: entry authorCategory
has experiment category: experimentCategory
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

51729,1
type: assembly
of datablock: info:bmrb/51729
reference to entry: entry
assembly.entry id: 51729
assembly.id: 1
assembly.ambiguous conformational states: no
assembly.metal ions: 0
assembly.molecules in chemical exchange: no
assembly.name: Neurotoxin
assembly.non standard bonds: no
assembly.number of components: 1
assembly.organic ligands: 0
assembly.paramagnetic: no
assembly.sf category: assembly
assembly.sf framecode: assembly_1

51729,1
type: assigned chem shift list
of datablock: info:bmrb/51729
reference to entry: entry
assigned chem shift list.entry id: 51729
assigned chem shift list.id: 1
assigned chem shift list.chem shift reference id: 1
assigned chem shift list.chem shift reference label: chem_shift_reference_1
assigned chem shift list.name: rsNTX
assigned chem shift list.sample condition list id: 1
assigned chem shift list.sample condition list label: sample_conditions_1
assigned chem shift list.sf category: assigned_chemical_shifts
assigned chem shift list.sf framecode: assigned_chemical_shifts_1

1,51729,1
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 1
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA2
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 0
atom chem shift.comp id: GLY
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 1
atom chem shift.val: 3.84
atom chem shift.val err: 0.000

1,51729,2
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 2
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA3
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 0
atom chem shift.comp id: GLY
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 1
atom chem shift.val: 3.84
atom chem shift.val err: 0.000

1,51729,3
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 3
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: 0
atom chem shift.comp id: GLY
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 1
atom chem shift.val: 169.3
atom chem shift.val err: 0.000

1,51729,4
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 4
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 0
atom chem shift.comp id: GLY
atom chem shift.comp index id: 1
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 1
atom chem shift.val: 43.51
atom chem shift.val err: 0.012

1,51729,5
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 5
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 8.426
atom chem shift.val err: 0.006

1,51729,6
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 6
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: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 4.489
atom chem shift.val err: 0.011

1,51729,7
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 7
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: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 1.351
atom chem shift.val err: 0.004

1,51729,8
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 8
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: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 1.351
atom chem shift.val err: 0.004

1,51729,9
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 9
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
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 1.444
atom chem shift.val err: 0.002

1,51729,10
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 10
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: MD1
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 0.618
atom chem shift.val err: 0.003

1,51729,11
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 11
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
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 0.618
atom chem shift.val err: 0.003

1,51729,12
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 12
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
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 0.618
atom chem shift.val err: 0.003

1,51729,13
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 13
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: MD2
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 0.723
atom chem shift.val err: 0.002

1,51729,14
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 14
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
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 0.723
atom chem shift.val err: 0.002

1,51729,15
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 15
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
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 0.723
atom chem shift.val err: 0.002

1,51729,16
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 16
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth comp id: LEU
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 174.7
atom chem shift.val err: 0.000

1,51729,17
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 17
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
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 1
atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 55.25
atom chem shift.val err: 0.036

1,51729,18
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 18
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth comp id: LEU
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 2
atom chem shift.val: 44.89
atom chem shift.val err: 0.023

1,51729,19
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 19
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
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atom chem shift.atom type: C
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atom chem shift.comp index id: 2
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atom chem shift.seq id: 2
atom chem shift.val: 26.64
atom chem shift.val err: 0.025

1,51729,20
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 20
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.comp id: LEU
atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 2
atom chem shift.val: 26.50
atom chem shift.val err: 0.025

1,51729,21
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 21
atom chem shift.ambiguity code: 2
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atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 2
atom chem shift.val: 22.58
atom chem shift.val err: 0.038

1,51729,22
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 22
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.comp index id: 2
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 2
atom chem shift.val: 124.4
atom chem shift.val err: 0.070

1,51729,23
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 23
atom chem shift.ambiguity code: 1
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atom chem shift.seq id: 3
atom chem shift.val: 8.423
atom chem shift.val err: 0.006

1,51729,24
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 5.076
atom chem shift.val err: 0.007

1,51729,25
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 2.064
atom chem shift.val err: 0.009

1,51729,26
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,27
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 27
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atom chem shift.seq id: 3
atom chem shift.val: 1.796
atom chem shift.val err: 0.005

1,51729,28
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.seq id: 3
atom chem shift.val: 1.796
atom chem shift.val err: 0.005

1,51729,29
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 3
atom chem shift.val: 175.2
atom chem shift.val err: 0.000

1,51729,30
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 30
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atom chem shift.comp index id: 3
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 3
atom chem shift.val: 54.58
atom chem shift.val err: 0.018

1,51729,31
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 31
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atom chem shift.seq id: 3
atom chem shift.val: 32.39
atom chem shift.val err: 0.097

1,51729,32
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 32
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atom chem shift.comp index id: 3
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atom chem shift.seq id: 3
atom chem shift.val: 36.71
atom chem shift.val err: 0.035

1,51729,33
type: atom chem shift
of datablock: info:bmrb/51729
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 3
atom chem shift.val: 126.0
atom chem shift.val err: 0.052

1,51729,34
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 34
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 8.456
atom chem shift.val err: 0.007

1,51729,35
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: CYS
atom chem shift.auth seq id: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 5.089
atom chem shift.val err: 0.115

1,51729,36
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: CYS
atom chem shift.auth seq id: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 2.951
atom chem shift.val err: 0.006

1,51729,37
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: CYS
atom chem shift.auth seq id: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 2.313
atom chem shift.val err: 0.011

1,51729,38
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 38
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: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 175.7
atom chem shift.val err: 0.000

1,51729,39
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 39
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: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 51.41
atom chem shift.val err: 0.025

1,51729,40
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 40
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 41.48
atom chem shift.val err: 0.028

1,51729,41
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 41
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 3
atom chem shift.comp id: CYS
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 120.6
atom chem shift.val err: 0.080

1,51729,42
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 42
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 9.512
atom chem shift.val err: 0.005

1,51729,43
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 43
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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 5.138
atom chem shift.val err: 0.007

1,51729,44
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 44
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: HIS
atom chem shift.auth seq id: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 3.533
atom chem shift.val err: 0.008

1,51729,45
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 45
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: HIS
atom chem shift.auth seq id: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.682
atom chem shift.val err: 0.007

1,51729,46
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 46
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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 6.567
atom chem shift.val err: 0.012

1,51729,47
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 47
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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 7.947
atom chem shift.val err: 0

1,51729,48
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 48
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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 176.8
atom chem shift.val err: 0.000

1,51729,49
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 49
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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 58.36
atom chem shift.val err: 0.019

1,51729,50
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 50
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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 28.71
atom chem shift.val err: 0.198

1,51729,51
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 51
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 4
atom chem shift.comp id: HIS
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 120.6
atom chem shift.val err: 0.056

1,51729,52
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 52
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 4.82
atom chem shift.val err: 0.018

1,51729,53
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 53
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 3.11
atom chem shift.val err: 0.008

1,51729,54
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 54
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 2.21
atom chem shift.val err: 0.012

1,51729,55
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 55
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
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 7.62
atom chem shift.val err: 0.010

1,51729,56
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 56
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
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atom chem shift.auth seq id: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 6.90
atom chem shift.val err: 0.011

1,51729,57
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 57
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 174.8
atom chem shift.val err: 0.000

1,51729,58
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 58
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 51.9
atom chem shift.val err: 0.034

1,51729,59
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 59
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 38.69
atom chem shift.val err: 0.143

1,51729,60
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 60
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 116.6
atom chem shift.val err: 0.072

1,51729,61
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 61
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: 5
atom chem shift.comp id: ASN
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 111.9
atom chem shift.val err: 0.042

1,51729,62
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 62
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 6
atom chem shift.comp id: GLN
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: 9.135
atom chem shift.val err: 0.057

1,51729,63
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 63
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: 6
atom chem shift.comp id: GLN
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: 4.581
atom chem shift.val err: 0.009

1,51729,64
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 64
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: 6
atom chem shift.comp id: GLN
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: 2.702
atom chem shift.val err: 0.001

1,51729,65
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 65
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: 6
atom chem shift.comp id: GLN
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: 2.562
atom chem shift.val err: 0.020

1,51729,66
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 66
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 6
atom chem shift.comp id: GLN
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: 2.072
atom chem shift.val err: 0.000

1,51729,67
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 67
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 6
atom chem shift.comp id: GLN
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: 2.015
atom chem shift.val err: 0.035

1,51729,68
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 68
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 6
atom chem shift.comp id: GLN
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 7.676
atom chem shift.val err: 0.005

1,51729,69
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 69
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 6
atom chem shift.comp id: GLN
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: 6.974
atom chem shift.val err: 0.005

1,51729,70
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 70
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: 6
atom chem shift.comp id: GLN
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: 175.2
atom chem shift.val err: 0.000

1,51729,71
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 71
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: 6
atom chem shift.comp id: GLN
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: 55.99
atom chem shift.val err: 0.080

1,51729,72
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 72
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: 6
atom chem shift.comp id: GLN
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: 26.98
atom chem shift.val err: 0.032

1,51729,73
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 73
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: 6
atom chem shift.comp id: GLN
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: 33.12
atom chem shift.val err: 0.024

1,51729,74
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 74
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 6
atom chem shift.comp id: GLN
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: 125.8
atom chem shift.val err: 0.041

1,51729,75
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 75
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: 6
atom chem shift.comp id: GLN
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: 112.3
atom chem shift.val err: 0.089

1,51729,76
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 76
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 7
atom chem shift.comp id: GLN
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: 8.474
atom chem shift.val err: 0.009

1,51729,77
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 77
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: 7
atom chem shift.comp id: GLN
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: 4.581
atom chem shift.val err: 0.009

1,51729,78
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 78
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: 7
atom chem shift.comp id: GLN
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: 2.282
atom chem shift.val err: 0.012

1,51729,79
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 79
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: 7
atom chem shift.comp id: GLN
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: 2.020
atom chem shift.val err: 0.008

1,51729,80
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 80
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 7
atom chem shift.comp id: GLN
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: 2.613
atom chem shift.val err: 0.028

1,51729,81
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 81
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 7
atom chem shift.comp id: GLN
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: 2.613
atom chem shift.val err: 0.028

1,51729,82
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 82
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 7
atom chem shift.comp id: GLN
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: 7.812
atom chem shift.val err: 0.008

1,51729,83
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 83
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 7
atom chem shift.comp id: GLN
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: 6.482
atom chem shift.val err: 0.013

1,51729,84
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 84
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: 7
atom chem shift.comp id: GLN
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: 176.5
atom chem shift.val err: 0.000

1,51729,85
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 85
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: 7
atom chem shift.comp id: GLN
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: 54.86
atom chem shift.val err: 0.018

1,51729,86
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 86
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: 7
atom chem shift.comp id: GLN
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: 30.61
atom chem shift.val err: 0.007

1,51729,87
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 87
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: 7
atom chem shift.comp id: GLN
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: 34.44
atom chem shift.val err: 0.024

1,51729,88
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 88
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 7
atom chem shift.comp id: GLN
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: 120.9
atom chem shift.val err: 0.145

1,51729,89
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 89
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: 7
atom chem shift.comp id: GLN
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: 109.4
atom chem shift.val err: 0.033

1,51729,90
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 90
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 8
atom chem shift.comp id: SER
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: 9.040
atom chem shift.val err: 0.009

1,51729,91
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 91
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: 8
atom chem shift.comp id: SER
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 4.776
atom chem shift.val err: 0.039

1,51729,92
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 92
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: 8
atom chem shift.comp id: SER
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 4.278
atom chem shift.val err: 0.078

1,51729,93
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 93
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: 8
atom chem shift.comp id: SER
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 4.278
atom chem shift.val err: 0.078

1,51729,94
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 94
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: 8
atom chem shift.comp id: SER
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: 59.83
atom chem shift.val err: 0.073

1,51729,95
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 95
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: 8
atom chem shift.comp id: SER
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: 62.60
atom chem shift.val err: 0.000

1,51729,96
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: SER
atom chem shift.auth seq id: 8
atom chem shift.comp id: SER
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: 114.5
atom chem shift.val err: 0.055

1,51729,97
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 97
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: 9
atom chem shift.comp id: SER
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: 4.706
atom chem shift.val err: 0.000

1,51729,98
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 98
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: 9
atom chem shift.comp id: SER
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: 4.027
atom chem shift.val err: 0.000

1,51729,99
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 99
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: 9
atom chem shift.comp id: SER
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: 4.027
atom chem shift.val err: 0.000

1,51729,100
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 100
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: 9
atom chem shift.comp id: SER
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: 174.1
atom chem shift.val err: 0.000

1,51729,101
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 101
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: 9
atom chem shift.comp id: SER
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: 57.78
atom chem shift.val err: 0.000

1,51729,102
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 102
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: 9
atom chem shift.comp id: SER
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: 62.74
atom chem shift.val err: 0.000

1,51729,103
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 103
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 10
atom chem shift.comp id: GLN
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: 7.976
atom chem shift.val err: 0.005

1,51729,104
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 104
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: 10
atom chem shift.comp id: GLN
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: 4.294
atom chem shift.val err: 0.008

1,51729,105
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 105
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: 10
atom chem shift.comp id: GLN
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: 2.339
atom chem shift.val err: 0.007

1,51729,106
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 106
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: 10
atom chem shift.comp id: GLN
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: 2.102
atom chem shift.val err: 0.004

1,51729,107
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 107
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 10
atom chem shift.comp id: GLN
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: 2.526
atom chem shift.val err: 0.011

1,51729,108
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 108
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 10
atom chem shift.comp id: GLN
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: 2.526
atom chem shift.val err: 0.011

1,51729,109
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 109
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE21
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 10
atom chem shift.comp id: GLN
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: 7.615
atom chem shift.val err: 0.010

1,51729,110
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 110
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 10
atom chem shift.comp id: GLN
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: 6.929
atom chem shift.val err: 0.007

1,51729,111
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 111
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: 10
atom chem shift.comp id: GLN
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: 175.8
atom chem shift.val err: 0.000

1,51729,112
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 112
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: 10
atom chem shift.comp id: GLN
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: 55.96
atom chem shift.val err: 0.026

1,51729,113
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 113
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: 10
atom chem shift.comp id: GLN
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: 29.81
atom chem shift.val err: 0.026

1,51729,114
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 114
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: 10
atom chem shift.comp id: GLN
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: 34.62
atom chem shift.val err: 0.065

1,51729,115
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 115
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 10
atom chem shift.comp id: GLN
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: 120.0
atom chem shift.val err: 0.049

1,51729,116
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 116
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: 10
atom chem shift.comp id: GLN
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: 112.3
atom chem shift.val err: 0.009

1,51729,117
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 117
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 11
atom chem shift.comp id: THR
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: 8.347
atom chem shift.val err: 0.005

1,51729,118
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 118
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: 11
atom chem shift.comp id: THR
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: 4.308
atom chem shift.val err: 0.006

1,51729,119
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 119
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
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 11
atom chem shift.comp id: THR
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: 4.015
atom chem shift.val err: 0.010

1,51729,120
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 120
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: MG
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 11
atom chem shift.comp id: THR
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: 1.321
atom chem shift.val err: 0.002

1,51729,121
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 121
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
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 11
atom chem shift.comp id: THR
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: 1.321
atom chem shift.val err: 0.002

1,51729,122
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 122
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: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.321
atom chem shift.val err: 0.002

1,51729,123
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 123
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 seq id: 11
atom chem shift.comp id: THR
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: 61.54
atom chem shift.val err: 0.000

1,51729,124
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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
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atom chem shift.auth seq id: 11
atom chem shift.comp id: THR
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: 69.99
atom chem shift.val err: 0.077

1,51729,125
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 125
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
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atom chem shift.comp id: THR
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: 21.28
atom chem shift.val err: 0.112

1,51729,126
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 126
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 11
atom chem shift.comp id: THR
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: 118.1
atom chem shift.val err: 0.060

1,51729,127
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 127
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 3.877
atom chem shift.val err: 0.007

1,51729,128
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 128
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 12
atom chem shift.comp id: PRO
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: 1.997
atom chem shift.val err: 0.012

1,51729,129
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 129
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: PRO
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: 1.954
atom chem shift.val err: 0.000

1,51729,130
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 130
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: PRO
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: 2.112
atom chem shift.val err: 0.006

1,51729,131
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 131
atom chem shift.ambiguity code: 2
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atom chem shift.auth seq id: 12
atom chem shift.comp id: PRO
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: 1.837
atom chem shift.val err: 0.004

1,51729,132
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 132
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HD2
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atom chem shift.auth seq id: 12
atom chem shift.comp id: PRO
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: 4.030
atom chem shift.val err: 0.005

1,51729,133
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 133
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HD3
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atom chem shift.auth seq id: 12
atom chem shift.comp id: PRO
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: 3.665
atom chem shift.val err: 0.000

1,51729,134
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 134
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 atom id: C
atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
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: 176.2
atom chem shift.val err: 0.000

1,51729,135
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 135
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
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atom chem shift.comp id: PRO
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: 64.21
atom chem shift.val err: 0.016

1,51729,136
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 136
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 12
atom chem shift.comp id: PRO
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: 32.22
atom chem shift.val err: 0.093

1,51729,137
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 137
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: PRO
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 13
atom chem shift.val: 28.02
atom chem shift.val err: 0.067

1,51729,138
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 138
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
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atom chem shift.comp id: PRO
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: 51.54
atom chem shift.val err: 0.000

1,51729,139
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 139
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
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atom chem shift.atom type: H
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atom chem shift.auth comp id: THR
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atom chem shift.comp id: THR
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: 8.020
atom chem shift.val err: 0.006

1,51729,140
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 140
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
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: 4.782
atom chem shift.val err: 0.009

1,51729,141
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 141
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
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: 4.561
atom chem shift.val err: 0.005

1,51729,142
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 1.247
atom chem shift.val err: 0.013

1,51729,143
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 143
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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: 1.247
atom chem shift.val err: 0.013

1,51729,144
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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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: 1.247
atom chem shift.val err: 0.013

1,51729,145
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 175.2
atom chem shift.val err: 0.000

1,51729,146
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 60.42
atom chem shift.val err: 0.075

1,51729,147
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 72.94
atom chem shift.val err: 0.082

1,51729,148
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 21.51
atom chem shift.val err: 0.037

1,51729,149
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 14
atom chem shift.val: 114.6
atom chem shift.val err: 0.006

1,51729,150
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 150
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atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 15
atom chem shift.val: 8.575
atom chem shift.val err: 0.008

1,51729,151
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 15
atom chem shift.val: 5.088
atom chem shift.val err: 0.010

1,51729,152
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 152
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atom chem shift.comp id: THR
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 15
atom chem shift.val: 3.785
atom chem shift.val err: 0.006

1,51729,153
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 0.468
atom chem shift.val err: 0.005

1,51729,154
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.468
atom chem shift.val err: 0.005

1,51729,155
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.468
atom chem shift.val err: 0.005

1,51729,156
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 173.2
atom chem shift.val err: 0.000

1,51729,157
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 59.81
atom chem shift.val err: 0.033

1,51729,158
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 72.22
atom chem shift.val err: 0.106

1,51729,159
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 21.17
atom chem shift.val err: 0.056

1,51729,160
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 112.1
atom chem shift.val err: 0.093

1,51729,161
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.724
atom chem shift.val err: 0.006

1,51729,162
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.625
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1,51729,163
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 3.868
atom chem shift.val err: 0.006

1,51729,164
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.036
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1,51729,165
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,166
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,167
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,168
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,169
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,170
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,171
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,172
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,173
type: atom chem shift
of datablock: info:bmrb/51729
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1,51729,174
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,175
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,176
type: atom chem shift
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1,51729,177
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: GLY
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1,51729,178
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 178
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 8.733
atom chem shift.val err: 0.070

1,51729,179
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 179
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: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 4.984
atom chem shift.val err: 0.004

1,51729,180
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 180
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 2.814
atom chem shift.val err: 0.002

1,51729,181
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 181
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 3.634
atom chem shift.val err: 0.008

1,51729,182
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 182
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: C
atom chem shift.auth comp id: CYS
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 176.0
atom chem shift.val err: 0.000

1,51729,183
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 183
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: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 52.97
atom chem shift.val err: 0.192

1,51729,184
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 184
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 38.05
atom chem shift.val err: 0.106

1,51729,185
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 185
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 17
atom chem shift.comp id: CYS
atom chem shift.comp index id: 18
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 18
atom chem shift.val: 124.0
atom chem shift.val err: 0.044

1,51729,186
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 186
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 9.202
atom chem shift.val err: 0.007

1,51729,187
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 187
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 4.785
atom chem shift.val err: 0.000

1,51729,188
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 188
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.999
atom chem shift.val err: 0.010

1,51729,189
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 189
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: SER
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: 3.999
atom chem shift.val err: 0.010

1,51729,190
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 190
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
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atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 175.3
atom chem shift.val err: 0.000

1,51729,191
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 191
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: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 58.91
atom chem shift.val err: 0.002

1,51729,192
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 192
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 64.38
atom chem shift.val err: 0.020

1,51729,193
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 193
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 18
atom chem shift.comp id: SER
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 119.1
atom chem shift.val err: 0.035

1,51729,194
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 194
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 9.054
atom chem shift.val err: 0.007

1,51729,195
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 195
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.124
atom chem shift.val err: 0.007

1,51729,196
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 196
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.843
atom chem shift.val err: 0.009

1,51729,197
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 197
atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 13
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.val: 175.4
atom chem shift.val err: 0.000

1,51729,198
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 198
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 46.58
atom chem shift.val err: 0.054

1,51729,199
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 199
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 19
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: 111.6
atom chem shift.val err: 0.045

1,51729,200
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 200
atom chem shift.ambiguity code: 1
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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: 8.631
atom chem shift.val err: 0.006

1,51729,201
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 201
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
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 4.032
atom chem shift.val err: 0.007

1,51729,202
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 202
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
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 3.860
atom chem shift.val err: 0.008

1,51729,203
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 203
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.comp id: 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: 174.6
atom chem shift.val err: 0.000

1,51729,204
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 204
atom chem shift.ambiguity code: 1
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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: 45.02
atom chem shift.val err: 0.097

1,51729,205
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 205
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 20
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: 110.5
atom chem shift.val err: 0.051

1,51729,206
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 206
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLU
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 8.266
atom chem shift.val err: 0.006

1,51729,207
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 207
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.196
atom chem shift.val err: 0.009

1,51729,208
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 208
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.233
atom chem shift.val err: 0.006

1,51729,209
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 209
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.047
atom chem shift.val err: 0.000

1,51729,210
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 210
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLU
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: 2.496
atom chem shift.val err: 0.000

1,51729,211
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 211
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atom chem shift.comp id: GLU
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.496
atom chem shift.val err: 0.000

1,51729,212
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: GLU
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: 176.4
atom chem shift.val err: 0.000

1,51729,213
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 213
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atom chem shift.comp id: GLU
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: 57.92
atom chem shift.val err: 0.040

1,51729,214
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLU
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 30.47
atom chem shift.val err: 0.033

1,51729,215
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 215
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLU
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: 37.04
atom chem shift.val err: 0.000

1,51729,216
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 216
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: N
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atom chem shift.comp id: GLU
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: 121.2
atom chem shift.val err: 0.051

1,51729,217
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 217
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atom chem shift.comp id: THR
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 8.252
atom chem shift.val err: 0.007

1,51729,218
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 218
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atom chem shift.comp id: THR
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: 4.445
atom chem shift.val err: 0.007

1,51729,219
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 219
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atom chem shift.comp id: THR
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: 3.603
atom chem shift.val err: 0.000

1,51729,220
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 23
atom chem shift.val: 1.234
atom chem shift.val err: 0.003

1,51729,221
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 221
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 23
atom chem shift.val: 1.234
atom chem shift.val err: 0.003

1,51729,222
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 222
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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: 1.234
atom chem shift.val err: 0.003

1,51729,223
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 174.2
atom chem shift.val err: 0.000

1,51729,224
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.seq id: 23
atom chem shift.val: 61.31
atom chem shift.val err: 0.049

1,51729,225
type: atom chem shift
of datablock: info:bmrb/51729
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: 70.52
atom chem shift.val err: 0.079

1,51729,226
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 21.69
atom chem shift.val err: 0.000

1,51729,227
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: THR
atom chem shift.comp index id: 23
atom chem shift.entity assembly id: 1
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atom chem shift.val: 113.2
atom chem shift.val err: 0.062

1,51729,228
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.670
atom chem shift.val err: 0.006

1,51729,229
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.675
atom chem shift.val err: 0.001

1,51729,230
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 2.690
atom chem shift.val err: 0.001

1,51729,231
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 2.324
atom chem shift.val err: 0.010

1,51729,232
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 7.125
atom chem shift.val err: 0.005

1,51729,233
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 6.783
atom chem shift.val err: 0.008

1,51729,234
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 174.3
atom chem shift.val err: 0.000

1,51729,235
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 52.57
atom chem shift.val err: 0.083

1,51729,236
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 44.83
atom chem shift.val err: 0.018

1,51729,237
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.assembly atom id: 0
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 120.6
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1,51729,238
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 111.6
atom chem shift.val err: 0.048

1,51729,239
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 25
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atom chem shift.val: 9.087
atom chem shift.val err: 0.006

1,51729,240
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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1,51729,241
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,242
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,243
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.000

1,51729,244
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,245
type: atom chem shift
of datablock: info:bmrb/51729
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1,51729,246
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,247
type: atom chem shift
of datablock: info:bmrb/51729
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1,51729,248
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,249
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,250
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 250
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: TYR
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: 2.840
atom chem shift.val err: 0.011

1,51729,251
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 251
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: TYR
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 26
atom chem shift.val: 175.8
atom chem shift.val err: 0.000

1,51729,252
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 252
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atom chem shift.comp id: TYR
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: 56.46
atom chem shift.val err: 0.033

1,51729,253
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: TYR
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: 42.26
atom chem shift.val err: 0.039

1,51729,254
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
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atom chem shift.val: 113.5
atom chem shift.val err: 0.043

1,51729,255
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 255
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.856
atom chem shift.val err: 0.006

1,51729,256
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.135
atom chem shift.val err: 0.019

1,51729,257
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 257
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 1.972
atom chem shift.val err: 0.072

1,51729,258
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 258
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atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 1.972
atom chem shift.val err: 0.072

1,51729,259
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 259
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 1.298
atom chem shift.val err: 0.000

1,51729,260
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 27
atom chem shift.val: 1.229
atom chem shift.val err: 0.000

1,51729,261
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.675
atom chem shift.val err: 0.000

1,51729,262
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 1.675
atom chem shift.val err: 0.000

1,51729,263
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 174.4
atom chem shift.val err: 0.000

1,51729,264
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 56.33
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1,51729,265
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 36.45
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1,51729,266
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 25.63
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1,51729,267
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 267
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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: 123.9
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1,51729,268
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.990
atom chem shift.val err: 0.006

1,51729,269
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 5.709
atom chem shift.val err: 0.010

1,51729,270
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 270
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atom chem shift.val: 2.078
atom chem shift.val err: 0.000

1,51729,271
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,272
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,273
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,274
type: atom chem shift
of datablock: info:bmrb/51729
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1,51729,275
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 54.58
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1,51729,276
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,277
type: atom chem shift
of datablock: info:bmrb/51729
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: 130.7
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1,51729,278
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 9.448
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1,51729,279
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 5.296
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1,51729,280
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,281
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,282
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,283
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,284
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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1,51729,285
type: atom chem shift
of datablock: info:bmrb/51729
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1,51729,286
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 286
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: 28
atom chem shift.comp id: ARG
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: 34.89
atom chem shift.val err: 0.070

1,51729,287
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 287
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: 28
atom chem shift.comp id: ARG
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: 27.64
atom chem shift.val err: 0.000

1,51729,288
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 288
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 28
atom chem shift.comp id: ARG
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: 125.3
atom chem shift.val err: 0.077

1,51729,289
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 289
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 8.873
atom chem shift.val err: 0.007

1,51729,290
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 290
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 5.226
atom chem shift.val err: 0.008

1,51729,291
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 291
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 3.583
atom chem shift.val err: 0.003

1,51729,292
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 292
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 3.425
atom chem shift.val err: 0.010

1,51729,293
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 293
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD1
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 6.976
atom chem shift.val err: 0.017

1,51729,294
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 294
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 172.1
atom chem shift.val err: 0.000

1,51729,295
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 295
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 56.70
atom chem shift.val err: 0.016

1,51729,296
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 296
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 32.56
atom chem shift.val err: 0.105

1,51729,297
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 297
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TRP
atom chem shift.auth seq id: 29
atom chem shift.comp id: TRP
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: 124.6
atom chem shift.val err: 0.103

1,51729,298
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 298
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 30
atom chem shift.comp id: ARG
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: 8.732
atom chem shift.val err: 0.005

1,51729,299
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 299
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: 30
atom chem shift.comp id: ARG
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: 4.550
atom chem shift.val err: 0.010

1,51729,300
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 300
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: 30
atom chem shift.comp id: ARG
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: 1.574
atom chem shift.val err: 0.013

1,51729,301
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 301
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: 30
atom chem shift.comp id: ARG
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: 1.308
atom chem shift.val err: 0.017

1,51729,302
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 302
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: 30
atom chem shift.comp id: ARG
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: 1.060
atom chem shift.val err: 0.010

1,51729,303
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 303
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: 30
atom chem shift.comp id: ARG
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: 1.060
atom chem shift.val err: 0.010

1,51729,304
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 304
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: 30
atom chem shift.comp id: ARG
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: 2.948
atom chem shift.val err: 0.007

1,51729,305
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 305
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: 30
atom chem shift.comp id: ARG
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 3.014
atom chem shift.val err: 0.013

1,51729,306
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 306
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: 30
atom chem shift.comp id: ARG
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 175.8
atom chem shift.val err: 0.000

1,51729,307
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 307
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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atom chem shift.comp id: ARG
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: 55.02
atom chem shift.val err: 0.017

1,51729,308
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 308
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: 30
atom chem shift.comp id: ARG
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: 32.33
atom chem shift.val err: 0.055

1,51729,309
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 309
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: 30
atom chem shift.comp id: ARG
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 31
atom chem shift.val: 27.16
atom chem shift.val err: 0.000

1,51729,310
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 310
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: 30
atom chem shift.comp id: ARG
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: 43.30
atom chem shift.val err: 0.000

1,51729,311
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 311
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 30
atom chem shift.comp id: ARG
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: 120.4
atom chem shift.val err: 0.050

1,51729,312
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 312
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 31
atom chem shift.comp id: ASP
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 8.330
atom chem shift.val err: 0.006

1,51729,313
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 313
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
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 31
atom chem shift.comp id: ASP
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: 4.878
atom chem shift.val err: 0.000

1,51729,314
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 314
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 31
atom chem shift.comp id: ASP
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: 3.160
atom chem shift.val err: 0.000

1,51729,315
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 315
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 31
atom chem shift.comp id: ASP
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: 2.736
atom chem shift.val err: 0.000

1,51729,316
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 316
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 31
atom chem shift.comp id: ASP
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: 52.41
atom chem shift.val err: 0.000

1,51729,317
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 317
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 31
atom chem shift.comp id: ASP
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: 42.20
atom chem shift.val err: 0.000

1,51729,318
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 318
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 31
atom chem shift.comp id: ASP
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: 126.0
atom chem shift.val err: 0.045

1,51729,319
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 319
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: 32
atom chem shift.comp id: HIS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 3.239
atom chem shift.val err: 0.000

1,51729,320
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 320
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 32
atom chem shift.comp id: HIS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 3.170
atom chem shift.val err: 0.006

1,51729,321
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 321
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: 32
atom chem shift.comp id: HIS
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: 7.109
atom chem shift.val err: 0.000

1,51729,322
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 322
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: 32
atom chem shift.comp id: HIS
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: 176.3
atom chem shift.val err: 0.000

1,51729,323
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 323
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: CA
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 32
atom chem shift.comp id: HIS
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: 58.72
atom chem shift.val err: 0.071

1,51729,324
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 324
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 32
atom chem shift.comp id: HIS
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 33
atom chem shift.val: 29.56
atom chem shift.val err: 0.094

1,51729,325
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 325
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 33
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 8.310
atom chem shift.val err: 0.011

1,51729,326
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 326
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 4.277
atom chem shift.val err: 0.012

1,51729,327
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 327
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HB2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.806
atom chem shift.val err: 0.060

1,51729,328
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 328
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.683
atom chem shift.val err: 0.090

1,51729,329
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 329
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HG2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 33
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.353
atom chem shift.val err: 0.010

1,51729,330
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 330
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HG3
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atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 33
atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 1.078
atom chem shift.val err: 0.008

1,51729,331
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 331
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 3.078
atom chem shift.val err: 0.000

1,51729,332
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 332
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: ARG
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 3.129
atom chem shift.val err: 0.000

1,51729,333
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 333
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: ARG
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 176.2
atom chem shift.val err: 0.000

1,51729,334
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 334
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 56.03
atom chem shift.val err: 0.014

1,51729,335
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 335
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 30.50
atom chem shift.val err: 0.510

1,51729,336
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 336
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 26.77
atom chem shift.val err: 0.000

1,51729,337
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 337
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 43.23
atom chem shift.val err: 0.030

1,51729,338
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 338
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
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atom chem shift.val: 119.2
atom chem shift.val err: 0.069

1,51729,339
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 339
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atom chem shift.comp id: GLY
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.775
atom chem shift.val err: 0.031

1,51729,340
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 340
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 35
atom chem shift.val: 172.4
atom chem shift.val err: 0.018

1,51729,341
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 341
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 35
atom chem shift.val: 44.50
atom chem shift.val err: 0.012

1,51729,342
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 342
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.comp id: GLY
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 35
atom chem shift.val: 108.6
atom chem shift.val err: 0.155

1,51729,343
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 343
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 36
atom chem shift.val: 8.534
atom chem shift.val err: 0.007

1,51729,344
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 344
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 36
atom chem shift.val: 4.726
atom chem shift.val err: 0.013

1,51729,345
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 345
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 36
atom chem shift.val: 2.736
atom chem shift.val err: 0.008

1,51729,346
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 346
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.736
atom chem shift.val err: 0.008

1,51729,347
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 347
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atom chem shift.comp id: TYR
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: 6.950
atom chem shift.val err: 0.012

1,51729,348
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: TYR
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: 6.950
atom chem shift.val err: 0.012

1,51729,349
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
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atom chem shift.val: 6.760
atom chem shift.val err: 0.000

1,51729,350
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 350
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
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atom chem shift.val: 6.760
atom chem shift.val err: 0.000

1,51729,351
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 351
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: TYR
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: 176.4
atom chem shift.val err: 0.000

1,51729,352
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 352
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: TYR
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: 59.10
atom chem shift.val err: 0.099

1,51729,353
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 353
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atom chem shift.auth comp id: TYR
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 39.61
atom chem shift.val err: 0.183

1,51729,354
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: TYR
atom chem shift.auth seq id: 35
atom chem shift.comp id: TYR
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: 119.5
atom chem shift.val err: 0.039

1,51729,355
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 355
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: ARG
atom chem shift.auth seq id: 36
atom chem shift.comp id: ARG
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 8.890
atom chem shift.val err: 0.008

1,51729,356
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 356
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
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: 4.314
atom chem shift.val err: 0.009

1,51729,357
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 357
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.comp id: ARG
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: 0.971
atom chem shift.val err: 0.002

1,51729,358
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
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: 0.085
atom chem shift.val err: 0.010

1,51729,359
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 359
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
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: 0.148
atom chem shift.val err: 0.001

1,51729,360
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 360
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atom chem shift.comp id: ARG
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: 0.148
atom chem shift.val err: 0.001

1,51729,361
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 361
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atom chem shift.comp id: ARG
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: 2.886
atom chem shift.val err: 0.000

1,51729,362
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 362
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atom chem shift.comp id: ARG
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: 2.788
atom chem shift.val err: 0.000

1,51729,363
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 363
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atom chem shift.comp id: ARG
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: 174.3
atom chem shift.val err: 0.000

1,51729,364
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 54.04
atom chem shift.val err: 0.042

1,51729,365
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 365
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atom chem shift.comp id: ARG
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: 31.62
atom chem shift.val err: 0.131

1,51729,366
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 366
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atom chem shift.comp id: ARG
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: 25.44
atom chem shift.val err: 0.000

1,51729,367
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 367
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atom chem shift.comp id: ARG
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: 42.60
atom chem shift.val err: 0.000

1,51729,368
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 15
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atom chem shift.comp id: ARG
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 124.3
atom chem shift.val err: 0.057

1,51729,369
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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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.seq id: 38
atom chem shift.val: 7.760
atom chem shift.val err: 0.006

1,51729,370
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 370
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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.seq id: 38
atom chem shift.val: 5.632
atom chem shift.val err: 0.009

1,51729,371
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 371
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atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 38
atom chem shift.val: 3.793
atom chem shift.val err: 0.008

1,51729,372
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 372
atom chem shift.ambiguity code: 1
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atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 38
atom chem shift.val: 1.153
atom chem shift.val err: 0.008

1,51729,373
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 373
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 38
atom chem shift.val: 1.153
atom chem shift.val err: 0.008

1,51729,374
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 38
atom chem shift.val: 1.153
atom chem shift.val err: 0.008

1,51729,375
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 375
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atom chem shift.val: 174.1
atom chem shift.val err: 0.000

1,51729,376
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 60.84
atom chem shift.val err: 0.132

1,51729,377
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 377
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 72.02
atom chem shift.val err: 0.122

1,51729,378
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 22.12
atom chem shift.val err: 0.000

1,51729,379
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 113.2
atom chem shift.val err: 0.054

1,51729,380
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: GLU
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atom chem shift.val: 9.657
atom chem shift.val err: 0.006

1,51729,381
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.977
atom chem shift.val err: 0.014

1,51729,382
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 382
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
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atom chem shift.seq id: 39
atom chem shift.val: 2.344
atom chem shift.val err: 0.017

1,51729,383
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 383
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
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atom chem shift.val: 2.344
atom chem shift.val err: 0.017

1,51729,384
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.val: 2.632
atom chem shift.val err: 0.006

1,51729,385
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 39
atom chem shift.val: 2.604
atom chem shift.val err: 0.010

1,51729,386
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
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atom chem shift.val: 173.7
atom chem shift.val err: 0.000

1,51729,387
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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atom chem shift.comp id: GLU
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 54.78
atom chem shift.val err: 0.044

1,51729,388
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 388
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 39
atom chem shift.val: 35.23
atom chem shift.val err: 0.083

1,51729,389
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 389
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 39
atom chem shift.val: 37.76
atom chem shift.val err: 0.196

1,51729,390
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 390
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: GLU
atom chem shift.auth seq id: 38
atom chem shift.comp id: GLU
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.val: 128.0
atom chem shift.val err: 0.055

1,51729,391
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 391
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atom chem shift.comp id: ARG
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: 8.821
atom chem shift.val err: 0.007

1,51729,392
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 392
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atom chem shift.comp id: ARG
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: 4.871
atom chem shift.val err: 0.011

1,51729,393
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 393
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atom chem shift.comp id: ARG
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: 1.540
atom chem shift.val err: 0.009

1,51729,394
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: ARG
atom chem shift.auth seq id: 39
atom chem shift.comp id: ARG
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: 1.540
atom chem shift.val err: 0.009

1,51729,395
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 395
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: 39
atom chem shift.comp id: ARG
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: 1.135
atom chem shift.val err: 0.007

1,51729,396
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 396
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: 39
atom chem shift.comp id: ARG
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: 1.135
atom chem shift.val err: 0.007

1,51729,397
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 397
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: 39
atom chem shift.comp id: ARG
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: 3.114
atom chem shift.val err: 0.015

1,51729,398
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 398
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ARG
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: 3.114
atom chem shift.val err: 0.015

1,51729,399
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 399
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
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atom chem shift.comp id: ARG
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: 174.8
atom chem shift.val err: 0.000

1,51729,400
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 400
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ARG
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: 53.93
atom chem shift.val err: 0.032

1,51729,401
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 401
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: 39
atom chem shift.comp id: ARG
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: 35.06
atom chem shift.val err: 0.052

1,51729,402
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 402
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: 39
atom chem shift.comp id: ARG
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: 28.76
atom chem shift.val err: 0.000

1,51729,403
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 403
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: 39
atom chem shift.comp id: ARG
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: 44.01
atom chem shift.val err: 0.000

1,51729,404
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 404
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 39
atom chem shift.comp id: ARG
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: 124.9
atom chem shift.val err: 0.045

1,51729,405
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 405
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
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atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 40
atom chem shift.comp id: GLY
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: 6.226
atom chem shift.val err: 0.009

1,51729,406
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 406
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA2
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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: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 4.321
atom chem shift.val err: 0.005

1,51729,407
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 407
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HA3
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atom chem shift.comp id: GLY
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: 3.760
atom chem shift.val err: 0.004

1,51729,408
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 408
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
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atom chem shift.comp id: GLY
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: 171.8
atom chem shift.val err: 0.000

1,51729,409
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 409
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
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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: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 41
atom chem shift.val: 45.95
atom chem shift.val err: 0.013

1,51729,410
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 410
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 40
atom chem shift.comp id: GLY
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: 104.5
atom chem shift.val err: 0.056

1,51729,411
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 411
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: CYS
atom chem shift.auth seq id: 41
atom chem shift.comp id: CYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 42
atom chem shift.val: 8.694
atom chem shift.val err: 0.005

1,51729,412
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 412
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: CYS
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: 5.320
atom chem shift.val err: 0.010

1,51729,413
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 413
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 42
atom chem shift.val: 3.255
atom chem shift.val err: 0.007

1,51729,414
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 414
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: 2.946
atom chem shift.val err: 0.007

1,51729,415
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 415
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 42
atom chem shift.val: 175.4
atom chem shift.val err: 0.000

1,51729,416
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 416
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: CYS
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: 57.89
atom chem shift.val err: 0.036

1,51729,417
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 417
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: CYS
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: 45.93
atom chem shift.val err: 0.088

1,51729,418
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 418
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 41
atom chem shift.comp id: CYS
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: 119.2
atom chem shift.val err: 0.043

1,51729,419
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 419
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 9.362
atom chem shift.val err: 0.006

1,51729,420
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 420
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atom chem shift.comp id: GLY
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.360
atom chem shift.val err: 0.000

1,51729,421
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 421
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLY
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: 3.789
atom chem shift.val err: 0.000

1,51729,422
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 422
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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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: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 171.1
atom chem shift.val err: 0.000

1,51729,423
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 423
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 43
atom chem shift.val: 43.81
atom chem shift.val err: 0.041

1,51729,424
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 424
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 42
atom chem shift.comp id: GLY
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: 111.6
atom chem shift.val err: 0.040

1,51729,425
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 425
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 43
atom chem shift.comp id: CYS
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 8.137
atom chem shift.val err: 0.006

1,51729,426
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 426
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 43
atom chem shift.comp id: CYS
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: 4.980
atom chem shift.val err: 0.000

1,51729,427
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 427
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: CYS
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: 2.839
atom chem shift.val err: 0.000

1,51729,428
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 428
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 44
atom chem shift.val: 2.622
atom chem shift.val err: 0.000

1,51729,429
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 429
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 44
atom chem shift.val: 53.41
atom chem shift.val err: 0.000

1,51729,430
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 430
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: 43
atom chem shift.comp id: CYS
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: 38.12
atom chem shift.val err: 0.000

1,51729,431
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 431
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 43
atom chem shift.comp id: CYS
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: 112.2
atom chem shift.val err: 0.045

1,51729,432
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 432
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 4.307
atom chem shift.val err: 0.000

1,51729,433
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 433
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 1.980
atom chem shift.val err: 0.007

1,51729,434
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 434
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 1.611
atom chem shift.val err: 0.002

1,51729,435
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 435
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 0.994
atom chem shift.val err: 0.008

1,51729,436
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 436
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG3
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 0.994
atom chem shift.val err: 0.008

1,51729,437
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 437
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 175.1
atom chem shift.val err: 0.000

1,51729,438
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 438
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 62.34
atom chem shift.val err: 0.057

1,51729,439
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 439
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 32.06
atom chem shift.val err: 0.006

1,51729,440
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 440
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: 44
atom chem shift.comp id: PRO
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: 50.39
atom chem shift.val err: 0.000

1,51729,441
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 441
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 44
atom chem shift.comp id: PRO
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: 113.8
atom chem shift.val err: 0.000

1,51729,442
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 442
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 45
atom chem shift.comp id: SER
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: 7.986
atom chem shift.val err: 0.005

1,51729,443
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 443
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: 45
atom chem shift.comp id: SER
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: 4.369
atom chem shift.val err: 0.009

1,51729,444
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 444
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: 45
atom chem shift.comp id: SER
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: 3.778
atom chem shift.val err: 0.008

1,51729,445
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 445
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: 45
atom chem shift.comp id: SER
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: 3.778
atom chem shift.val err: 0.008

1,51729,446
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 446
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: 45
atom chem shift.comp id: SER
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: 174.8
atom chem shift.val err: 0.000

1,51729,447
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 447
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: 45
atom chem shift.comp id: SER
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: 58.16
atom chem shift.val err: 0.031

1,51729,448
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 448
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: 45
atom chem shift.comp id: SER
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: 63.48
atom chem shift.val err: 0.196

1,51729,449
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 449
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 45
atom chem shift.comp id: SER
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: 113.7
atom chem shift.val err: 0.036

1,51729,450
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 450
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 8.286
atom chem shift.val err: 0.006

1,51729,451
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 451
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 4.379
atom chem shift.val err: 0.011

1,51729,452
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 452
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 2.064
atom chem shift.val err: 0.006

1,51729,453
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 453
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: MG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 0.781
atom chem shift.val err: 0.009

1,51729,454
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 454
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: MG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 0.781
atom chem shift.val err: 0.009

1,51729,455
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 455
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: MG1
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 0.781
atom chem shift.val err: 0.009

1,51729,456
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 456
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: MG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 0.850
atom chem shift.val err: 0.004

1,51729,457
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 457
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: MG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 0.850
atom chem shift.val err: 0.004

1,51729,458
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 458
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: MG2
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 0.850
atom chem shift.val err: 0.004

1,51729,459
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 459
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 175.5
atom chem shift.val err: 0.000

1,51729,460
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 460
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 60.17
atom chem shift.val err: 0.004

1,51729,461
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 461
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 34.85
atom chem shift.val err: 0.057

1,51729,462
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 462
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 22.13
atom chem shift.val err: 0.026

1,51729,463
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 463
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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 19.25
atom chem shift.val err: 0.041

1,51729,464
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 464
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 46
atom chem shift.comp id: VAL
atom chem shift.comp index id: 47
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 47
atom chem shift.val: 117.9
atom chem shift.val err: 0.042

1,51729,465
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 465
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 7.723
atom chem shift.val err: 0.006

1,51729,466
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 466
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 4.400
atom chem shift.val err: 0.008

1,51729,467
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 467
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 1.864
atom chem shift.val err: 0.000

1,51729,468
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 468
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 1.641
atom chem shift.val err: 0.010

1,51729,469
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 469
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 1.391
atom chem shift.val err: 0.000

1,51729,470
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 470
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 1.391
atom chem shift.val err: 0.000

1,51729,471
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 471
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 1.397
atom chem shift.val err: 0.002

1,51729,472
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 472
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 1.397
atom chem shift.val err: 0.002

1,51729,473
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 473
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 175.4
atom chem shift.val err: 0.000

1,51729,474
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 474
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 55.22
atom chem shift.val err: 0.061

1,51729,475
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 475
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 34.25
atom chem shift.val err: 0.059

1,51729,476
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 476
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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 24.62
atom chem shift.val err: 0.074

1,51729,477
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 477
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 47
atom chem shift.comp id: LYS
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 121.5
atom chem shift.val err: 0.064

1,51729,478
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 478
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 8.368
atom chem shift.val err: 0.006

1,51729,479
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 479
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: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 4.633
atom chem shift.val err: 0.153

1,51729,480
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 480
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: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 2.800
atom chem shift.val err: 0.007

1,51729,481
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 481
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: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 2.800
atom chem shift.val err: 0.007

1,51729,482
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 482
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
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 7.682
atom chem shift.val err: 0.000

1,51729,483
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 483
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
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atom chem shift.auth seq id: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 6.997
atom chem shift.val err: 0.000

1,51729,484
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 484
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth comp id: ASN
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 176.1
atom chem shift.val err: 0.000

1,51729,485
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 485
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
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atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 55.04
atom chem shift.val err: 0.011

1,51729,486
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 486
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.atom type: C
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 38.43
atom chem shift.val err: 0.035

1,51729,487
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 487
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 117.2
atom chem shift.val err: 0.053

1,51729,488
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 488
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: 48
atom chem shift.comp id: ASN
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 49
atom chem shift.val: 113.0
atom chem shift.val err: 0.004

1,51729,489
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 489
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: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 8.798
atom chem shift.val err: 0.007

1,51729,490
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 490
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: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 4.302
atom chem shift.val err: 0.007

1,51729,491
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 491
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA3
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atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 3.651
atom chem shift.val err: 0.007

1,51729,492
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 492
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: 49
atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 174.0
atom chem shift.val err: 0.000

1,51729,493
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 493
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 49
atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 45.33
atom chem shift.val err: 0.069

1,51729,494
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 494
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 49
atom chem shift.comp id: GLY
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 50
atom chem shift.val: 111.3
atom chem shift.val err: 0.044

1,51729,495
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 495
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 7.657
atom chem shift.val err: 0.005

1,51729,496
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 496
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 4.512
atom chem shift.val err: 0.008

1,51729,497
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 497
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.915
atom chem shift.val err: 0.010

1,51729,498
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 498
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG12
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.389
atom chem shift.val err: 0.011

1,51729,499
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 499
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 1.378
atom chem shift.val err: 0.013

1,51729,500
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 500
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
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atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.858
atom chem shift.val err: 0.006

1,51729,501
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 501
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.atom type: H
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atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.858
atom chem shift.val err: 0.006

1,51729,502
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 502
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: MG
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.858
atom chem shift.val err: 0.006

1,51729,503
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 503
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: MD
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.563
atom chem shift.val err: 0.006

1,51729,504
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 504
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD12
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: MD
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.563
atom chem shift.val err: 0.006

1,51729,505
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 505
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD13
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: MD
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 0.563
atom chem shift.val err: 0.006

1,51729,506
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 506
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 175.0
atom chem shift.val err: 0.000

1,51729,507
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 507
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 60.70
atom chem shift.val err: 0.036

1,51729,508
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 508
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 38.82
atom chem shift.val err: 0.027

1,51729,509
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 509
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 27.43
atom chem shift.val err: 0.000

1,51729,510
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 510
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 18.22
atom chem shift.val err: 0.155

1,51729,511
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 511
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 12.92
atom chem shift.val err: 0.043

1,51729,512
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 512
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 50
atom chem shift.comp id: ILE
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 51
atom chem shift.val: 121.1
atom chem shift.val err: 0.032

1,51729,513
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 513
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 8.683
atom chem shift.val err: 0.006

1,51729,514
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 514
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: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 4.644
atom chem shift.val err: 0.010

1,51729,515
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 515
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: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 2.397
atom chem shift.val err: 0.011

1,51729,516
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 516
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.atom type: H
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 2.221
atom chem shift.val err: 0.010

1,51729,517
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 517
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 2.389
atom chem shift.val err: 0.013

1,51729,518
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 518
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 2.389
atom chem shift.val err: 0.013

1,51729,519
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 519
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 13
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 175.2
atom chem shift.val err: 0.000

1,51729,520
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 520
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 52
atom chem shift.val: 55.62
atom chem shift.val err: 0.049

1,51729,521
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 521
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 31.57
atom chem shift.val err: 0.045

1,51729,522
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 522
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 36.33
atom chem shift.val err: 0.062

1,51729,523
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 523
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: N
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atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 51
atom chem shift.comp id: GLU
atom chem shift.comp index id: 52
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 126.7
atom chem shift.val err: 0.036

1,51729,524
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 524
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 8.758
atom chem shift.val err: 0.006

1,51729,525
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 525
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 5.353
atom chem shift.val err: 0.000

1,51729,526
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 526
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 1.666
atom chem shift.val err: 0.003

1,51729,527
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 527
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 1.494
atom chem shift.val err: 0.007

1,51729,528
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 528
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: ILE
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 53
atom chem shift.val: 1.239
atom chem shift.val err: 0.006

1,51729,529
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 529
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG21
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 0.962
atom chem shift.val err: 0.003

1,51729,530
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 530
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 0.962
atom chem shift.val err: 0.003

1,51729,531
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 531
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 1
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 0.962
atom chem shift.val err: 0.003

1,51729,532
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 532
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD11
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atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 0.735
atom chem shift.val err: 0.004

1,51729,533
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 533
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 0.735
atom chem shift.val err: 0.004

1,51729,534
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 534
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 0.735
atom chem shift.val err: 0.004

1,51729,535
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 535
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 173.2
atom chem shift.val err: 0.000

1,51729,536
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 536
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 58.87
atom chem shift.val err: 0.035

1,51729,537
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 537
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 42.26
atom chem shift.val err: 0.083

1,51729,538
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 538
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: CG1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 29.17
atom chem shift.val err: 0.010

1,51729,539
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 539
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 16.85
atom chem shift.val err: 0.063

1,51729,540
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 540
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CD1
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CD1
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 14.73
atom chem shift.val err: 0.034

1,51729,541
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 541
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 52
atom chem shift.comp id: ILE
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 53
atom chem shift.val: 124.6
atom chem shift.val err: 0.029

1,51729,542
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 542
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 8.600
atom chem shift.val err: 0.005

1,51729,543
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 543
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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 5.118
atom chem shift.val err: 0.009

1,51729,544
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 544
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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 2.708
atom chem shift.val err: 0.009

1,51729,545
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 545
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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 2.708
atom chem shift.val err: 0.009

1,51729,546
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 546
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 7.036
atom chem shift.val err: 0.000

1,51729,547
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 547
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
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 7.036
atom chem shift.val err: 0.000

1,51729,548
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 548
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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 174.1
atom chem shift.val err: 0.000

1,51729,549
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 549
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
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 52.69
atom chem shift.val err: 0.054

1,51729,550
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 550
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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 42.47
atom chem shift.val err: 0.015

1,51729,551
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 551
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 124.6
atom chem shift.val err: 0.029

1,51729,552
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 552
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: 53
atom chem shift.comp id: ASN
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 54
atom chem shift.val: 112.4
atom chem shift.val err: 0.000

1,51729,553
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 553
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 9.229
atom chem shift.val err: 0.007

1,51729,554
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 554
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 5.939
atom chem shift.val err: 0.010

1,51729,555
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 555
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
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atom chem shift.auth seq id: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 3.531
atom chem shift.val err: 0.004

1,51729,556
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 556
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 3.196
atom chem shift.val err: 0.005

1,51729,557
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 557
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 172.4
atom chem shift.val err: 0.000

1,51729,558
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 558
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: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 53.66
atom chem shift.val err: 0.060

1,51729,559
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 559
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 43.70
atom chem shift.val err: 0.096

1,51729,560
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
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: CYS
atom chem shift.auth seq id: 54
atom chem shift.comp id: CYS
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 123.2
atom chem shift.val err: 0.062

1,51729,561
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 561
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: CYS
atom chem shift.auth seq id: 55
atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 9.419
atom chem shift.val err: 0.006

1,51729,562
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 562
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: 55
atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 5.362
atom chem shift.val err: 0.010

1,51729,563
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 563
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 3.704
atom chem shift.val err: 0.006

1,51729,564
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 564
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 56
atom chem shift.val: 3.359
atom chem shift.val err: 0.011

1,51729,565
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 565
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 174.9
atom chem shift.val err: 0.000

1,51729,566
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 566
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 55
atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 54.44
atom chem shift.val err: 0.008

1,51729,567
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 567
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: CYS
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atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 45.52
atom chem shift.val err: 0.009

1,51729,568
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 568
atom chem shift.ambiguity code: 1
atom chem 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: CYS
atom chem shift.auth seq id: 55
atom chem shift.comp id: CYS
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 56
atom chem shift.val: 120.3
atom chem shift.val err: 0.043

1,51729,569
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 569
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 8.470
atom chem shift.val err: 0.005

1,51729,570
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 570
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 57
atom chem shift.val: 5.161
atom chem shift.val err: 0.007

1,51729,571
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 571
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atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.833
atom chem shift.val err: 0.022

1,51729,572
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 572
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atom chem shift.comp id: THR
atom chem shift.comp index id: 57
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atom chem shift.seq id: 57
atom chem shift.val: 1.229
atom chem shift.val err: 0.004

1,51729,573
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 573
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atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 57
atom chem shift.val: 1.229
atom chem shift.val err: 0.004

1,51729,574
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 574
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: MG
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 1.229
atom chem shift.val err: 0.004

1,51729,575
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 575
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: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 174.7
atom chem shift.val err: 0.000

1,51729,576
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 576
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: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 62.40
atom chem shift.val err: 0.026

1,51729,577
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 577
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 70.06
atom chem shift.val err: 0.144

1,51729,578
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 578
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: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 21.36
atom chem shift.val err: 0.000

1,51729,579
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 579
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 56
atom chem shift.comp id: THR
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 57
atom chem shift.val: 108.4
atom chem shift.val err: 0.049

1,51729,580
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 580
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 7.487
atom chem shift.val err: 0.006

1,51729,581
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 581
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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 4.807
atom chem shift.val err: 0.009

1,51729,582
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 582
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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 4.321
atom chem shift.val err: 0.004

1,51729,583
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 583
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: MG
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 1.210
atom chem shift.val err: 0.006

1,51729,584
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 584
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: MG
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 1.210
atom chem shift.val err: 0.006

1,51729,585
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 585
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: MG
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 1.210
atom chem shift.val err: 0.006

1,51729,586
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 586
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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 173.4
atom chem shift.val err: 0.000

1,51729,587
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 587
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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 59.85
atom chem shift.val err: 0.023

1,51729,588
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 588
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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 72.15
atom chem shift.val err: 0.098

1,51729,589
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 589
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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 22.29
atom chem shift.val err: 0.000

1,51729,590
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 590
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 57
atom chem shift.comp id: THR
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 112.2
atom chem shift.val err: 0.046

1,51729,591
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 591
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 8.231
atom chem shift.val err: 0.006

1,51729,592
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 592
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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 4.792
atom chem shift.val err: 0.009

1,51729,593
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 593
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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 2.490
atom chem shift.val err: 0.007

1,51729,594
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 594
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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 2.490
atom chem shift.val err: 0.007

1,51729,595
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 595
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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 177.8
atom chem shift.val err: 0.000

1,51729,596
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 596
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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 55.77
atom chem shift.val err: 0.014

1,51729,597
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 597
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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 41.52
atom chem shift.val err: 0.042

1,51729,598
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 598
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 58
atom chem shift.comp id: ASP
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 59
atom chem shift.val: 119.0
atom chem shift.val err: 0.035

1,51729,599
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 599
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 9.531
atom chem shift.val err: 0.006

1,51729,600
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 600
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 3.417
atom chem shift.val err: 0.008

1,51729,601
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 601
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 2.296
atom chem shift.val err: 0.008

1,51729,602
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 602
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 1.967
atom chem shift.val err: 0.031

1,51729,603
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 603
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 0.587
atom chem shift.val err: 0.004

1,51729,604
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 604
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 1.289
atom chem shift.val err: 0.005

1,51729,605
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 605
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 2.975
atom chem shift.val err: 0.004

1,51729,606
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 606
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 3.181
atom chem shift.val err: 0.004

1,51729,607
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 607
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 175.7
atom chem shift.val err: 0.000

1,51729,608
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 608
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 58.32
atom chem shift.val err: 0.016

1,51729,609
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 609
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 26.40
atom chem shift.val err: 0.038

1,51729,610
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 610
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 28.37
atom chem shift.val err: 0.143

1,51729,611
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 611
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: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 42.96
atom chem shift.val err: 0.134

1,51729,612
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 612
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 59
atom chem shift.comp id: ARG
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 60
atom chem shift.val: 113.0
atom chem shift.val err: 0.037

1,51729,613
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 613
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 7.940
atom chem shift.val err: 0.006

1,51729,614
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 614
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 4.542
atom chem shift.val err: 0.011

1,51729,615
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 615
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: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 3.866
atom chem shift.val err: 0.006

1,51729,616
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 616
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: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 3.407
atom chem shift.val err: 0.008

1,51729,617
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 617
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: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 174.2
atom chem shift.val err: 0.000

1,51729,618
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 618
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 57.29
atom chem shift.val err: 0.034

1,51729,619
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 619
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 45.07
atom chem shift.val err: 0.058

1,51729,620
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 620
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 60
atom chem shift.comp id: CYS
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 61
atom chem shift.val: 113.7
atom chem shift.val err: 0.033

1,51729,621
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 621
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 9.174
atom chem shift.val err: 0.006

1,51729,622
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 622
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 4.770
atom chem shift.val err: 0.013

1,51729,623
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 623
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 2.873
atom chem shift.val err: 0.011

1,51729,624
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 624
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 2.207
atom chem shift.val err: 0.004

1,51729,625
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 625
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 8.169
atom chem shift.val err: 0.009

1,51729,626
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 626
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 7.951
atom chem shift.val err: 0.007

1,51729,627
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 627
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 173.5
atom chem shift.val err: 0.000

1,51729,628
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 628
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 53.01
atom chem shift.val err: 0.072

1,51729,629
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 629
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 36.99
atom chem shift.val err: 0.029

1,51729,630
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 630
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 122.0
atom chem shift.val err: 0.047

1,51729,631
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 631
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: 61
atom chem shift.comp id: ASN
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 117.2
atom chem shift.val err: 0.082

1,51729,632
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 632
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem 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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 7.514
atom chem shift.val err: 0.005

1,51729,633
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 633
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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 3.880
atom chem shift.val err: 0.009

1,51729,634
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 634
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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 2.593
atom chem shift.val err: 0.002

1,51729,635
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 635
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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 2.429
atom chem shift.val err: 0.013

1,51729,636
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 636
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD21
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD21
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 7.284
atom chem shift.val err: 0.011

1,51729,637
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 637
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HD22
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HD22
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 6.315
atom chem shift.val err: 0.014

1,51729,638
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 638
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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 56.64
atom chem shift.val err: 0.000

1,51729,639
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 639
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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 38.63
atom chem shift.val err: 0.001

1,51729,640
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 640
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem 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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 121.1
atom chem shift.val err: 0.036

1,51729,641
type: atom chem shift
of datablock: info:bmrb/51729
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 51729
atom chem shift.id: 641
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: 62
atom chem shift.comp id: ASN
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 63
atom chem shift.val: 111.1
atom chem shift.val err: 0.064

1,51729,1
type: bond
of datablock: info:bmrb/51729
bond.assembly id: 1
bond.entry id: 51729
bond.id: 1
bond.atom id 1: SG
bond.atom id 2: SG
bond.auth atom id 1: SG
bond.auth atom id 2: SG
bond.auth comp id 1: CYS
bond.auth comp id 2: CYS
bond.auth seq id 1: 3
bond.auth seq id 2: 24
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 4
bond.comp index id 2: 25
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 4
bond.seq id 2: 25
bond.type: disulfide
bond.value order: sing

1,51729,2
type: bond
of datablock: info:bmrb/51729
bond.assembly id: 1
bond.entry id: 51729
bond.id: 2
bond.atom id 1: SG
bond.atom id 2: SG
bond.auth atom id 1: SG
bond.auth atom id 2: SG
bond.auth comp id 1: CYS
bond.auth comp id 2: CYS
bond.auth seq id 1: 17
bond.auth seq id 2: 41
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 18
bond.comp index id 2: 42
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 18
bond.seq id 2: 42
bond.type: disulfide
bond.value order: sing

1,51729,3
type: bond
of datablock: info:bmrb/51729
bond.assembly id: 1
bond.entry id: 51729
bond.id: 3
bond.atom id 1: SG
bond.atom id 2: SG
bond.auth atom id 1: SG
bond.auth atom id 2: SG
bond.auth comp id 1: CYS
bond.auth comp id 2: CYS
bond.auth seq id 1: 43
bond.auth seq id 2: 54
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 44
bond.comp index id 2: 55
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 44
bond.seq id 2: 55
bond.type: disulfide
bond.value order: sing

1,51729,4
type: bond
of datablock: info:bmrb/51729
bond.assembly id: 1
bond.entry id: 51729
bond.id: 4
bond.atom id 1: SG
bond.atom id 2: SG
bond.auth atom id 1: SG
bond.auth atom id 2: SG
bond.auth comp id 1: CYS
bond.auth comp id 2: CYS
bond.auth seq id 1: 55
bond.auth seq id 2: 60
bond.comp id 1: CYS
bond.comp id 2: CYS
bond.comp index id 1: 56
bond.comp index id 2: 61
bond.entity assembly id 1: 1
bond.entity assembly id 2: 1
bond.entity id 1: 1
bond.entity id 2: 1
bond.seq id 1: 56
bond.seq id 2: 61
bond.type: disulfide
bond.value order: sing

1,51729,7
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chem shift experiment.experiment id: 7
chem shift experiment.experiment name: 3D HNCACB
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1,51729,8
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chem shift experiment.experiment id: 8
chem shift experiment.experiment name: 3D HN(CO)CACB
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1,51729,9
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13,C,1,51729,DSS
type: chem shift ref
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chem shift ref.atom isotope number: 13
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chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 0.2514495
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
chem shift ref.ref type: indirect

1,H,1,51729,DSS
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chem shift ref.atom type: H
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chem shift ref.entry id: 51729
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 1.000000
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

15,N,1,51729,DSS
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chem shift ref.atom isotope number: 15
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chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0.00
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 0.1013291
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
chem shift ref.ref type: indirect

51729,1
type: chem shift reference
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chem shift reference.id: 1
chem shift reference.name: NTX
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chem_shift_reference_1

1,51729,1
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51729,1
type: citation
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citation.entry id: 51729
citation.id: 1
citation.class: entry citation
citation.journal abbrev: Not known
citation.sf category: citations
citation.sf framecode: citations_1
citation.status: in preparation
citation.title: 1H, 13C, 15N NMR assignments of Naja atra short chain neurotoxin
citation.type: journal

1,51729,1
type: citation author
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citation author.ordinal: 1
citation author.family name: Lai
citation author.given name: Wen-Chian
citation author.pdbx name: Lai, W.

1,51729,2
type: citation author
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citation author.entry id: 51729
citation author.ordinal: 2
citation author.family name: Shu
citation author.given name: Chiao Hsuan
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1,51729,3
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citation author.family name: Wu
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1,51729,4
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citation author.ordinal: 4
citation author.family name: Sue
citation author.given name: Shih Che
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51729,assigned chemical shifts
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51729,13C chemical shifts
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51729,15N chemical shifts
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51729,1H chemical shifts
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datum.type: 1H chemical shifts
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51729,1
type: entity
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entity.entry id: 51729
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 7013.642
entity.name: entity 1
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 63
entity.paramagnetic: no
entity.parent entity id: 1
entity.polymer seq one letter code: GLECHNQQSSQTPTTTGCSGGETNCYKKRWRDHRGYRTERGCGCPSVKNGIEINCCTTDRCNN
entity.polymer seq one letter code can: GLECHNQQSSQTPTTTGCSGGETNCYKKRWRDHRGYRTERGCGCPSVKNGIEINCCTTDRCNN
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: entity_1
entity.thiol state: all disulfide bound
entity.type: polymer

1,51729,1
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entity assembly.id: 1
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Neurotoxin
entity assembly.entity id: 1
entity assembly.entity label: entity_1
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,51729,1
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1,51729,9
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1,51729,13
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1,51729,15
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1,51729,18
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1,51729,23
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1,51729,24
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1,51729,25
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1,51729,26
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1,51729,27
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1,51729,28
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1,51729,29
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1,51729,30
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1,51729,31
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1,51729,33
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1,51729,34
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1,51729,35
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1,51729,37
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1,51729,38
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1,51729,39
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1,51729,40
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1,51729,41
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1,51729,42
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1,51729,43
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1,51729,44
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1,51729,45
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1,51729,46
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1,51729,47
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1,51729,1
type: entity experimental src
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info:taxonomy/562

taxonomy:562

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entity natural src.kingdom: Not applicable
entity natural src.ncbi taxonomy id: 562
entity natural src.organism name common: E. coli
entity natural src.organism name scientific: Escherichia coli
entity natural src.species: coli
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51729,1
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sample component.concentration val units: % v/v
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: DSS

51729,2,1
type: sample component
of datablock: info:bmrb/51729
sample component.entry id: 51729
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 0.2
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: [U-99% 15N]
sample component.mol common name: Neurotoxin

51729,1
type: sample condition list
of datablock: info:bmrb/51729
reference to entry: entry
sample condition list.entry id: 51729
sample condition list.id: 1
sample condition list.details: liquid
sample condition list.name: 10mM phosphate pH6
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

51729,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/51729
sample condition variable.entry id: 51729
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 0
sample condition variable.val units: M

51729,1,pH
type: sample condition variable
of datablock: info:bmrb/51729
sample condition variable.entry id: 51729
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 6
sample condition variable.val units: pH

51729,1,pressure
type: sample condition variable
of datablock: info:bmrb/51729
sample condition variable.entry id: 51729
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

51729,1,temperature
type: sample condition variable
of datablock: info:bmrb/51729
sample condition variable.entry id: 51729
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

51729,1
type: software
of datablock: info:bmrb/51729
reference to entry: entry
software.entry id: 51729
software.id: 1
software.name: SPARKY
software.sf category: software
software.sf framecode: software_1

51729,1,chemical shift assignment
type: task
of datablock: info:bmrb/51729
task.entry id: 51729
task.software id: 1
task.task: chemical shift assignment