info:bmrb/52024
type: datablock
references: doi:10.13018/BMR52024
alternative label: bmr52024
title: Backbone 1H, 15N and 13C chemical shift assignments for the G-domain of human K-Ras4B(1-169) G12C mutant bound to GTP at physiological pH
datablock name: 52024
has assembly category: assemblyCategory
has assigned chem shift list category: assigned chem shift listCategory
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has chem comp category: chem compCategory
has chem comp atom category: chem comp atomCategory
has chem comp bond category: chem comp bondCategory
has chem comp descriptor category: chem comp descriptorCategory
has chem comp identifier category: chem comp identifierCategory
has chem shift experiment category: chem shift experimentCategory
has chem shift ref category: chem shift refCategory
has chem shift reference category: chem shift referenceCategory
has chem shift software category: chem shift softwareCategory
has citation category: citationCategory
has citation author category: citation authorCategory
has data set category: data setCategory
has datum category: datumCategory
has entity category: entityCategory
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has entry author category: entry authorCategory
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has experiment list category: experiment listCategory
has nmr spectrometer category: nmr spectrometerCategory
has related entries category: related entriesCategory
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

52024,1
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reference to entry: entry
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assembly.id: 1
assembly.ambiguous conformational states: no
assembly.metal ions: 1
assembly.molecules in chemical exchange: no
assembly.name: K-Ras mutant G12C-GTP complex
assembly.non standard bonds: no
assembly.number of components: 3
assembly.organic ligands: 1
assembly.paramagnetic: no
assembly.sf category: assembly
assembly.sf framecode: assembly_1

52024,1
type: assigned chem shift list
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1,52024,10
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1,52024,12
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1,52024,13
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1,52024,14
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atom chem shift.seq id: 8
atom chem shift.val: 55.3840
atom chem shift.val err: 0.0000

1,52024,32
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 32
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: 5
atom chem shift.comp id: LYS
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 61824
atom chem shift.seq id: 8
atom chem shift.val: 31.9321
atom chem shift.val err: 0.0000

1,52024,33
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 33
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: 5
atom chem shift.comp id: LYS
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 61810
atom chem shift.seq id: 8
atom chem shift.val: 123.6844
atom chem shift.val err: 0.0000

1,52024,34
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: LEU
atom chem shift.auth seq id: 6
atom chem shift.comp id: LEU
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26351
atom chem shift.seq id: 9
atom chem shift.val: 9.2579
atom chem shift.val err: 0.0000

1,52024,35
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 35
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 6
atom chem shift.comp id: LEU
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: 175.9744
atom chem shift.val err: 0.0000

1,52024,36
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 36
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 6
atom chem shift.comp id: LEU
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29316
atom chem shift.seq id: 9
atom chem shift.val: 53.1648
atom chem shift.val err: 0.0000

1,52024,37
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 37
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 6
atom chem shift.comp id: LEU
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48520
atom chem shift.seq id: 9
atom chem shift.val: 43.4759
atom chem shift.val err: 0.0000

1,52024,38
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 38
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 6
atom chem shift.comp id: LEU
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26353
atom chem shift.seq id: 9
atom chem shift.val: 125.8823
atom chem shift.val err: 0.0000

1,52024,39
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 39
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 7
atom chem shift.comp id: VAL
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27152
atom chem shift.seq id: 10
atom chem shift.val: 8.0919
atom chem shift.val err: 0.0000

1,52024,40
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 40
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 7
atom chem shift.comp id: VAL
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 173.9607
atom chem shift.val err: 0.0000

1,52024,41
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 41
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 7
atom chem shift.comp id: VAL
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29682
atom chem shift.seq id: 10
atom chem shift.val: 60.8308
atom chem shift.val err: 0.0000

1,52024,42
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 42
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 7
atom chem shift.comp id: VAL
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 64488
atom chem shift.seq id: 10
atom chem shift.val: 34.2807
atom chem shift.val err: 0.0000

1,52024,43
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 43
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 7
atom chem shift.comp id: VAL
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27154
atom chem shift.seq id: 10
atom chem shift.val: 122.1884
atom chem shift.val err: 0.0000

1,52024,44
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 44
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 8
atom chem shift.comp id: VAL
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31449
atom chem shift.seq id: 11
atom chem shift.val: 8.8519
atom chem shift.val err: 0.0000

1,52024,45
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 45
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: 8
atom chem shift.comp id: VAL
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: 175.2085
atom chem shift.val err: 0.0000

1,52024,46
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 46
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: 8
atom chem shift.comp id: VAL
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29022
atom chem shift.seq id: 11
atom chem shift.val: 61.9467
atom chem shift.val err: 0.0000

1,52024,47
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 47
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: 8
atom chem shift.comp id: VAL
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 40712
atom chem shift.seq id: 11
atom chem shift.val: 32.4442
atom chem shift.val err: 0.0000

1,52024,48
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 48
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 8
atom chem shift.comp id: VAL
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31450
atom chem shift.seq id: 11
atom chem shift.val: 129.4896
atom chem shift.val err: 0.0000

1,52024,49
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 49
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 9
atom chem shift.comp id: VAL
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31613
atom chem shift.seq id: 12
atom chem shift.val: 9.0753
atom chem shift.val err: 0.0000

1,52024,50
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 50
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 9
atom chem shift.comp id: VAL
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: 173.2342
atom chem shift.val err: 0.0000

1,52024,51
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 51
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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: 9
atom chem shift.comp id: VAL
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28326
atom chem shift.seq id: 12
atom chem shift.val: 58.9280
atom chem shift.val err: 0.0000

1,52024,52
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 52
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 9
atom chem shift.comp id: VAL
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: 35.3518
atom chem shift.val err: 0.0000

1,52024,53
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 53
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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: 9
atom chem shift.comp id: VAL
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31614
atom chem shift.seq id: 12
atom chem shift.val: 119.7660
atom chem shift.val err: 0.0000

1,52024,54
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 54
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 10
atom chem shift.comp id: GLY
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30767
atom chem shift.seq id: 13
atom chem shift.val: 7.6697
atom chem shift.val err: 0.0000

1,52024,55
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 55
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: 10
atom chem shift.comp id: GLY
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: 172.7019
atom chem shift.val err: 0.0000

1,52024,56
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 56
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: 10
atom chem shift.comp id: GLY
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28824
atom chem shift.seq id: 13
atom chem shift.val: 43.8279
atom chem shift.val err: 0.0000

1,52024,57
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 57
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: 10
atom chem shift.comp id: GLY
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30769
atom chem shift.seq id: 13
atom chem shift.val: 107.8454
atom chem shift.val err: 0.0000

1,52024,58
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 58
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 11
atom chem shift.comp id: ALA
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27317
atom chem shift.seq id: 14
atom chem shift.val: 9.0803
atom chem shift.val err: 0.0000

1,52024,59
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 59
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 11
atom chem shift.comp id: ALA
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 14
atom chem shift.val: 177.1932
atom chem shift.val err: 0.0000

1,52024,60
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 60
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 11
atom chem shift.comp id: ALA
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 71347
atom chem shift.seq id: 14
atom chem shift.val: 52.5028
atom chem shift.val err: 0.0000

1,52024,61
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 61
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 11
atom chem shift.comp id: ALA
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 71444
atom chem shift.seq id: 14
atom chem shift.val: 19.7987
atom chem shift.val err: 0.0000

1,52024,62
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 62
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 11
atom chem shift.comp id: ALA
atom chem shift.comp index id: 14
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27319
atom chem shift.seq id: 14
atom chem shift.val: 120.8607
atom chem shift.val err: 0.0000

1,52024,63
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 63
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 12
atom chem shift.comp id: CYS
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27218
atom chem shift.seq id: 15
atom chem shift.val: 8.5543
atom chem shift.val err: 0.0000

1,52024,64
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 64
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: 12
atom chem shift.comp id: CYS
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 15
atom chem shift.val: 177.4884
atom chem shift.val err: 0.0000

1,52024,65
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 65
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: 12
atom chem shift.comp id: CYS
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 86487
atom chem shift.seq id: 15
atom chem shift.val: 61.3868
atom chem shift.val err: 0.0000

1,52024,66
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 66
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: 12
atom chem shift.comp id: CYS
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30369
atom chem shift.seq id: 15
atom chem shift.val: 27.6597
atom chem shift.val err: 0.0000

1,52024,67
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 67
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: 12
atom chem shift.comp id: CYS
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27220
atom chem shift.seq id: 15
atom chem shift.val: 116.0304
atom chem shift.val err: 0.0000

1,52024,68
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 68
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 13
atom chem shift.comp id: GLY
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27875
atom chem shift.seq id: 16
atom chem shift.val: 8.0827
atom chem shift.val err: 0.0000

1,52024,69
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 69
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: 13
atom chem shift.comp id: GLY
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 16
atom chem shift.val: 173.5713
atom chem shift.val err: 0.0000

1,52024,70
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 70
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: 13
atom chem shift.comp id: GLY
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 155091
atom chem shift.seq id: 16
atom chem shift.val: 46.1200
atom chem shift.val err: 0.0000

1,52024,71
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 71
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: 13
atom chem shift.comp id: GLY
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27877
atom chem shift.seq id: 16
atom chem shift.val: 108.3139
atom chem shift.val err: 0.0000

1,52024,72
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 72
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: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30632
atom chem shift.seq id: 17
atom chem shift.val: 7.3959
atom chem shift.val err: 0.0000

1,52024,73
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 73
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: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 17
atom chem shift.val: 174.6680
atom chem shift.val err: 0.0000

1,52024,74
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 74
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: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28155
atom chem shift.seq id: 17
atom chem shift.val: 62.8789
atom chem shift.val err: 0.0000

1,52024,75
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 75
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: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30633
atom chem shift.seq id: 17
atom chem shift.val: 31.7903
atom chem shift.val err: 0.0000

1,52024,76
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 76
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 14
atom chem shift.comp id: VAL
atom chem shift.comp index id: 17
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30634
atom chem shift.seq id: 17
atom chem shift.val: 112.6189
atom chem shift.val err: 0.0000

1,52024,77
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 77
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 15
atom chem shift.comp id: GLY
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: 8.3761
atom chem shift.val err: 0.0000

1,52024,78
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 78
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: 15
atom chem shift.comp id: GLY
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: 173.8515
atom chem shift.val err: 0.0000

1,52024,79
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 79
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: 15
atom chem shift.comp id: GLY
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: 46.1007
atom chem shift.val err: 0.0000

1,52024,80
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 80
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 15
atom chem shift.comp id: GLY
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: 107.3692
atom chem shift.val err: 0.0000

1,52024,81
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 81
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 16
atom chem shift.comp id: LYS
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: 8.9273
atom chem shift.val err: 0.0000

1,52024,82
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 82
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: 16
atom chem shift.comp id: LYS
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: 178.9110
atom chem shift.val err: 0.0000

1,52024,83
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 83
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: 16
atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 63481
atom chem shift.seq id: 19
atom chem shift.val: 61.2422
atom chem shift.val err: 0.0000

1,52024,84
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 84
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: 16
atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 63591
atom chem shift.seq id: 19
atom chem shift.val: 29.9927
atom chem shift.val err: 0.0000

1,52024,85
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 85
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 16
atom chem shift.comp id: LYS
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: 122.8529
atom chem shift.val err: 0.0000

1,52024,86
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 86
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 17
atom chem shift.comp id: SER
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27773
atom chem shift.seq id: 20
atom chem shift.val: 9.1336
atom chem shift.val err: 0.0000

1,52024,87
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 87
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: 17
atom chem shift.comp id: SER
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 175.6312
atom chem shift.val err: 0.0000

1,52024,88
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 88
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: 17
atom chem shift.comp id: SER
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29874
atom chem shift.seq id: 20
atom chem shift.val: 61.1630
atom chem shift.val err: 0.0000

1,52024,89
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 89
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: 17
atom chem shift.comp id: SER
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27775
atom chem shift.seq id: 20
atom chem shift.val: 120.4444
atom chem shift.val err: 0.0000

1,52024,90
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ALA
atom chem shift.auth seq id: 18
atom chem shift.comp id: ALA
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31477
atom chem shift.seq id: 21
atom chem shift.val: 9.7572
atom chem shift.val err: 0.0000

1,52024,91
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 91
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 18
atom chem shift.comp id: ALA
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: 182.2859
atom chem shift.val err: 0.0000

1,52024,92
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 92
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 18
atom chem shift.comp id: ALA
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29322
atom chem shift.seq id: 21
atom chem shift.val: 54.3169
atom chem shift.val err: 0.0000

1,52024,93
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 93
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 18
atom chem shift.comp id: ALA
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29325
atom chem shift.seq id: 21
atom chem shift.val: 18.3532
atom chem shift.val err: 0.0000

1,52024,94
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 94
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 18
atom chem shift.comp id: ALA
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31478
atom chem shift.seq id: 21
atom chem shift.val: 125.8046
atom chem shift.val err: 0.0000

1,52024,95
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 95
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 19
atom chem shift.comp id: LEU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31597
atom chem shift.seq id: 22
atom chem shift.val: 8.9224
atom chem shift.val err: 0.0000

1,52024,96
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 96
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 19
atom chem shift.comp id: LEU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 177.4952
atom chem shift.val err: 0.0000

1,52024,97
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 97
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 19
atom chem shift.comp id: LEU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28344
atom chem shift.seq id: 22
atom chem shift.val: 58.7628
atom chem shift.val err: 0.0000

1,52024,98
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 98
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 19
atom chem shift.comp id: LEU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29973
atom chem shift.seq id: 22
atom chem shift.val: 43.1534
atom chem shift.val err: 0.0000

1,52024,99
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 99
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 19
atom chem shift.comp id: LEU
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31598
atom chem shift.seq id: 22
atom chem shift.val: 120.2021
atom chem shift.val err: 0.0000

1,52024,100
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 100
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: 20
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.resonance id: 30269
atom chem shift.seq id: 23
atom chem shift.val: 7.6541
atom chem shift.val err: 0.0000

1,52024,101
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 101
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: 20
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: 175.7612
atom chem shift.val err: 0.0000

1,52024,102
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 102
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: 20
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.resonance id: 82022
atom chem shift.seq id: 23
atom chem shift.val: 68.0607
atom chem shift.val err: 0.0000

1,52024,103
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 103
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: 20
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.resonance id: 30271
atom chem shift.seq id: 23
atom chem shift.val: 117.3973
atom chem shift.val err: 0.0000

1,52024,104
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 104
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: 21
atom chem shift.comp id: ILE
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31563
atom chem shift.seq id: 24
atom chem shift.val: 9.2923
atom chem shift.val err: 0.0000

1,52024,105
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 105
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 21
atom chem shift.comp id: ILE
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 24
atom chem shift.val: 179.5073
atom chem shift.val err: 0.0000

1,52024,106
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 106
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 21
atom chem shift.comp id: ILE
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28119
atom chem shift.seq id: 24
atom chem shift.val: 64.5231
atom chem shift.val err: 0.0000

1,52024,107
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 107
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 21
atom chem shift.comp id: ILE
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 68271
atom chem shift.seq id: 24
atom chem shift.val: 35.9613
atom chem shift.val err: 0.0000

1,52024,108
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 108
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 21
atom chem shift.comp id: ILE
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31564
atom chem shift.seq id: 24
atom chem shift.val: 121.3967
atom chem shift.val err: 0.0000

1,52024,109
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 109
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 22
atom chem shift.comp id: GLN
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29831
atom chem shift.seq id: 25
atom chem shift.val: 7.7586
atom chem shift.val err: 0.0000

1,52024,110
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 110
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: 22
atom chem shift.comp id: GLN
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 25
atom chem shift.val: 179.3365
atom chem shift.val err: 0.0000

1,52024,111
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 111
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: 22
atom chem shift.comp id: GLN
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28275
atom chem shift.seq id: 25
atom chem shift.val: 59.4958
atom chem shift.val err: 0.0000

1,52024,112
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 112
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: 22
atom chem shift.comp id: GLN
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29817
atom chem shift.seq id: 25
atom chem shift.val: 29.2447
atom chem shift.val err: 0.0000

1,52024,113
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 113
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: 22
atom chem shift.comp id: GLN
atom chem shift.comp index id: 25
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29833
atom chem shift.seq id: 25
atom chem shift.val: 120.9576
atom chem shift.val err: 0.0000

1,52024,114
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 114
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: 23
atom chem shift.comp id: LEU
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29855
atom chem shift.seq id: 26
atom chem shift.val: 7.6083
atom chem shift.val err: 0.0000

1,52024,115
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 115
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 23
atom chem shift.comp id: LEU
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: 178.3466
atom chem shift.val err: 0.0000

1,52024,116
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 116
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 23
atom chem shift.comp id: LEU
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28380
atom chem shift.seq id: 26
atom chem shift.val: 58.2587
atom chem shift.val err: 0.0000

1,52024,117
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 117
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 23
atom chem shift.comp id: LEU
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: 40.8340
atom chem shift.val err: 0.0000

1,52024,118
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 118
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 23
atom chem shift.comp id: LEU
atom chem shift.comp index id: 26
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29857
atom chem shift.seq id: 26
atom chem shift.val: 120.7612
atom chem shift.val err: 0.0000

1,52024,119
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 119
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 24
atom chem shift.comp id: ILE
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26201
atom chem shift.seq id: 27
atom chem shift.val: 8.1458
atom chem shift.val err: 0.0000

1,52024,120
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 120
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: 24
atom chem shift.comp id: ILE
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 27
atom chem shift.val: 177.6139
atom chem shift.val err: 0.0000

1,52024,121
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 121
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: 24
atom chem shift.comp id: ILE
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30450
atom chem shift.seq id: 27
atom chem shift.val: 61.9355
atom chem shift.val err: 0.0000

1,52024,122
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 122
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: 24
atom chem shift.comp id: ILE
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 89642
atom chem shift.seq id: 27
atom chem shift.val: 37.3792
atom chem shift.val err: 0.0000

1,52024,123
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 123
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: 24
atom chem shift.comp id: ILE
atom chem shift.comp index id: 27
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26203
atom chem shift.seq id: 27
atom chem shift.val: 113.9697
atom chem shift.val err: 0.0000

1,52024,124
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 124
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: 25
atom chem shift.comp id: GLN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30344
atom chem shift.seq id: 28
atom chem shift.val: 8.9527
atom chem shift.val err: 0.0000

1,52024,125
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 125
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: 25
atom chem shift.comp id: GLN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 28
atom chem shift.val: 176.1704
atom chem shift.val err: 0.0000

1,52024,126
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 126
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: 25
atom chem shift.comp id: GLN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28581
atom chem shift.seq id: 28
atom chem shift.val: 55.1392
atom chem shift.val err: 0.0000

1,52024,127
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 127
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: 25
atom chem shift.comp id: GLN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30342
atom chem shift.seq id: 28
atom chem shift.val: 30.6669
atom chem shift.val err: 0.0000

1,52024,128
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 128
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 25
atom chem shift.comp id: GLN
atom chem shift.comp index id: 28
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30346
atom chem shift.seq id: 28
atom chem shift.val: 116.2634
atom chem shift.val err: 0.0000

1,52024,129
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 129
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 26
atom chem shift.comp id: ASN
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26375
atom chem shift.seq id: 29
atom chem shift.val: 8.0255
atom chem shift.val err: 0.0000

1,52024,130
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 130
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
atom chem shift.auth seq id: 26
atom chem shift.comp id: ASN
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: 173.9538
atom chem shift.val err: 0.0000

1,52024,131
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 131
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: 26
atom chem shift.comp id: ASN
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 83363
atom chem shift.seq id: 29
atom chem shift.val: 54.4851
atom chem shift.val err: 0.0000

1,52024,132
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 132
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: 26
atom chem shift.comp id: ASN
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30297
atom chem shift.seq id: 29
atom chem shift.val: 37.2206
atom chem shift.val err: 0.0000

1,52024,133
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 133
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: 26
atom chem shift.comp id: ASN
atom chem shift.comp index id: 29
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26377
atom chem shift.seq id: 29
atom chem shift.val: 116.9296
atom chem shift.val err: 0.0000

1,52024,134
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 134
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: 27
atom chem shift.comp id: HIS
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26402
atom chem shift.seq id: 30
atom chem shift.val: 6.6329
atom chem shift.val err: 0.0000

1,52024,135
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 135
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: 27
atom chem shift.comp id: HIS
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31398
atom chem shift.seq id: 30
atom chem shift.val: 172.4868
atom chem shift.val err: 0.0000

1,52024,136
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 136
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: 27
atom chem shift.comp id: HIS
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26400
atom chem shift.seq id: 30
atom chem shift.val: 54.5240
atom chem shift.val err: 0.0000

1,52024,137
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 137
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: 27
atom chem shift.comp id: HIS
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27690
atom chem shift.seq id: 30
atom chem shift.val: 32.5497
atom chem shift.val err: 0.0000

1,52024,138
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 138
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 27
atom chem shift.comp id: HIS
atom chem shift.comp index id: 30
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26404
atom chem shift.seq id: 30
atom chem shift.val: 111.8868
atom chem shift.val err: 0.0000

1,52024,139
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 139
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 28
atom chem shift.comp id: PHE
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31527
atom chem shift.seq id: 31
atom chem shift.val: 8.4560
atom chem shift.val err: 0.0000

1,52024,140
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 140
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: PHE
atom chem shift.auth seq id: 28
atom chem shift.comp id: PHE
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: 174.0657
atom chem shift.val err: 0.0000

1,52024,141
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 141
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: PHE
atom chem shift.auth seq id: 28
atom chem shift.comp id: PHE
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28584
atom chem shift.seq id: 31
atom chem shift.val: 55.0302
atom chem shift.val err: 0.0000

1,52024,142
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 142
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: PHE
atom chem shift.auth seq id: 28
atom chem shift.comp id: PHE
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29589
atom chem shift.seq id: 31
atom chem shift.val: 39.9986
atom chem shift.val err: 0.0000

1,52024,143
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 143
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 28
atom chem shift.comp id: PHE
atom chem shift.comp index id: 31
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31528
atom chem shift.seq id: 31
atom chem shift.val: 122.7996
atom chem shift.val err: 0.0000

1,52024,144
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 144
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: 29
atom chem shift.comp id: VAL
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 43345
atom chem shift.seq id: 32
atom chem shift.val: 7.6864
atom chem shift.val err: 0.0000

1,52024,145
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 145
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: 29
atom chem shift.comp id: VAL
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 32
atom chem shift.val: 173.0445
atom chem shift.val err: 0.0000

1,52024,146
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 146
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: 29
atom chem shift.comp id: VAL
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 43352
atom chem shift.seq id: 32
atom chem shift.val: 60.8394
atom chem shift.val err: 0.0000

1,52024,147
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 147
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: 29
atom chem shift.comp id: VAL
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 120531
atom chem shift.seq id: 32
atom chem shift.val: 32.3156
atom chem shift.val err: 0.0000

1,52024,148
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 148
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 29
atom chem shift.comp id: VAL
atom chem shift.comp index id: 32
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 43347
atom chem shift.seq id: 32
atom chem shift.val: 128.8236
atom chem shift.val err: 0.0000

1,52024,149
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 149
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 30
atom chem shift.comp id: ASP
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26783
atom chem shift.seq id: 33
atom chem shift.val: 7.9436
atom chem shift.val err: 0.0000

1,52024,150
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 150
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: 30
atom chem shift.comp id: ASP
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: 176.8921
atom chem shift.val err: 0.0000

1,52024,151
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 151
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: 30
atom chem shift.comp id: ASP
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 57428
atom chem shift.seq id: 33
atom chem shift.val: 54.9031
atom chem shift.val err: 0.0000

1,52024,152
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 152
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: 30
atom chem shift.comp id: ASP
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 57638
atom chem shift.seq id: 33
atom chem shift.val: 42.1904
atom chem shift.val err: 0.0000

1,52024,153
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 153
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: 30
atom chem shift.comp id: ASP
atom chem shift.comp index id: 33
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26785
atom chem shift.seq id: 33
atom chem shift.val: 124.9338
atom chem shift.val err: 0.0000

1,52024,154
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 154
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: 31
atom chem shift.comp id: GLU
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26384
atom chem shift.seq id: 34
atom chem shift.val: 7.8564
atom chem shift.val err: 0.0000

1,52024,155
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 155
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 31
atom chem shift.comp id: GLU
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 34
atom chem shift.val: 174.8891
atom chem shift.val err: 0.0000

1,52024,156
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 156
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 31
atom chem shift.comp id: GLU
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29865
atom chem shift.seq id: 34
atom chem shift.val: 56.1787
atom chem shift.val err: 0.0000

1,52024,157
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 157
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 31
atom chem shift.comp id: GLU
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29868
atom chem shift.seq id: 34
atom chem shift.val: 30.3517
atom chem shift.val err: 0.0000

1,52024,158
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 158
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 31
atom chem shift.comp id: GLU
atom chem shift.comp index id: 34
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26386
atom chem shift.seq id: 34
atom chem shift.val: 120.5912
atom chem shift.val err: 0.0000

1,52024,159
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 159
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 32
atom chem shift.comp id: TYR
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29792
atom chem shift.seq id: 35
atom chem shift.val: 8.8135
atom chem shift.val err: 0.0000

1,52024,160
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 160
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 32
atom chem shift.comp id: TYR
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 35
atom chem shift.val: 173.5263
atom chem shift.val err: 0.0000

1,52024,161
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 161
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 32
atom chem shift.comp id: TYR
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28656
atom chem shift.seq id: 35
atom chem shift.val: 54.1821
atom chem shift.val err: 0.0000

1,52024,162
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 162
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 32
atom chem shift.comp id: TYR
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 66032
atom chem shift.seq id: 35
atom chem shift.val: 37.3907
atom chem shift.val err: 0.0000

1,52024,163
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 163
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: 32
atom chem shift.comp id: TYR
atom chem shift.comp index id: 35
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29794
atom chem shift.seq id: 35
atom chem shift.val: 121.3923
atom chem shift.val err: 0.0000

1,52024,164
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 164
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: 33
atom chem shift.comp id: ASP
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28850
atom chem shift.seq id: 36
atom chem shift.val: 8.9941
atom chem shift.val err: 0.0000

1,52024,165
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 165
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: 33
atom chem shift.comp id: ASP
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28848
atom chem shift.seq id: 36
atom chem shift.val: 50.4070
atom chem shift.val err: 0.0000

1,52024,166
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 166
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: 33
atom chem shift.comp id: ASP
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 117761
atom chem shift.seq id: 36
atom chem shift.val: 41.5928
atom chem shift.val err: 0.0000

1,52024,167
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 167
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: 33
atom chem shift.comp id: ASP
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28852
atom chem shift.seq id: 36
atom chem shift.val: 132.7536
atom chem shift.val err: 0.0000

1,52024,168
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 168
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: 34
atom chem shift.comp id: PRO
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31113
atom chem shift.seq id: 37
atom chem shift.val: 176.8315
atom chem shift.val err: 0.0000

1,52024,169
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 169
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: 34
atom chem shift.comp id: PRO
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26712
atom chem shift.seq id: 37
atom chem shift.val: 63.1876
atom chem shift.val err: 0.0000

1,52024,170
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 170
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: 34
atom chem shift.comp id: PRO
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 55250
atom chem shift.seq id: 37
atom chem shift.val: 32.2252
atom chem shift.val err: 0.0000

1,52024,171
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 171
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: THR
atom chem shift.auth seq id: 35
atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26711
atom chem shift.seq id: 38
atom chem shift.val: 9.3046
atom chem shift.val err: 0.0000

1,52024,172
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 172
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: 35
atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 173.4179
atom chem shift.val err: 0.0000

1,52024,173
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 173
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: 35
atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 55681
atom chem shift.seq id: 38
atom chem shift.val: 63.7093
atom chem shift.val err: 0.0000

1,52024,174
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 174
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: 35
atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 55828
atom chem shift.seq id: 38
atom chem shift.val: 69.9424
atom chem shift.val err: 0.0000

1,52024,175
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 175
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: 35
atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26713
atom chem shift.seq id: 38
atom chem shift.val: 125.1135
atom chem shift.val err: 0.0000

1,52024,176
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 176
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: 36
atom chem shift.comp id: ILE
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31483
atom chem shift.seq id: 39
atom chem shift.val: 8.5624
atom chem shift.val err: 0.0000

1,52024,177
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 177
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: 36
atom chem shift.comp id: ILE
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31272
atom chem shift.seq id: 39
atom chem shift.val: 174.7239
atom chem shift.val err: 0.0000

1,52024,178
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 178
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: 36
atom chem shift.comp id: ILE
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25995
atom chem shift.seq id: 39
atom chem shift.val: 64.2519
atom chem shift.val err: 0.0000

1,52024,179
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 179
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: 36
atom chem shift.comp id: ILE
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 37.2548
atom chem shift.val err: 0.0000

1,52024,180
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 180
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 36
atom chem shift.comp id: ILE
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31484
atom chem shift.seq id: 39
atom chem shift.val: 125.3279
atom chem shift.val err: 0.0000

1,52024,181
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 181
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLU
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25994
atom chem shift.seq id: 40
atom chem shift.val: 7.2789
atom chem shift.val err: 0.0000

1,52024,182
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 182
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLU
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: 173.7977
atom chem shift.val err: 0.0000

1,52024,183
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 183
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLU
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30402
atom chem shift.seq id: 40
atom chem shift.val: 57.9861
atom chem shift.val err: 0.0000

1,52024,184
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 184
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLU
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 179400
atom chem shift.seq id: 40
atom chem shift.val: 31.8661
atom chem shift.val err: 0.0000

1,52024,185
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: GLU
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLU
atom chem shift.comp index id: 40
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25996
atom chem shift.seq id: 40
atom chem shift.val: 115.1715
atom chem shift.val err: 0.0000

1,52024,186
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ASP
atom chem shift.auth seq id: 38
atom chem shift.comp id: ASP
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26213
atom chem shift.seq id: 41
atom chem shift.val: 8.5429
atom chem shift.val err: 0.0000

1,52024,187
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 187
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: 38
atom chem shift.comp id: ASP
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: 173.0465
atom chem shift.val err: 0.0000

1,52024,188
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 188
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: 38
atom chem shift.comp id: ASP
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 51902
atom chem shift.seq id: 41
atom chem shift.val: 54.2784
atom chem shift.val err: 0.0000

1,52024,189
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 189
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: 38
atom chem shift.comp id: ASP
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 179412
atom chem shift.seq id: 41
atom chem shift.val: 46.9103
atom chem shift.val err: 0.0000

1,52024,190
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 190
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 38
atom chem shift.comp id: ASP
atom chem shift.comp index id: 41
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26215
atom chem shift.seq id: 41
atom chem shift.val: 125.0359
atom chem shift.val err: 0.0000

1,52024,191
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 191
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 39
atom chem shift.comp id: SER
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27086
atom chem shift.seq id: 42
atom chem shift.val: 8.1863
atom chem shift.val err: 0.0000

1,52024,192
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 192
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: 39
atom chem shift.comp id: SER
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31359
atom chem shift.seq id: 42
atom chem shift.val: 173.0993
atom chem shift.val err: 0.0000

1,52024,193
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 193
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: SER
atom chem shift.auth seq id: 39
atom chem shift.comp id: SER
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26253
atom chem shift.seq id: 42
atom chem shift.val: 56.8941
atom chem shift.val err: 0.0000

1,52024,194
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 194
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: 39
atom chem shift.comp id: SER
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 179420
atom chem shift.seq id: 42
atom chem shift.val: 65.6249
atom chem shift.val err: 0.0000

1,52024,195
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 195
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: 39
atom chem shift.comp id: SER
atom chem shift.comp index id: 42
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27088
atom chem shift.seq id: 42
atom chem shift.val: 114.5039
atom chem shift.val err: 0.0000

1,52024,196
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 196
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 40
atom chem shift.comp id: TYR
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26684
atom chem shift.seq id: 43
atom chem shift.val: 9.0625
atom chem shift.val err: 0.0000

1,52024,197
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 197
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 40
atom chem shift.comp id: TYR
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: 174.2483
atom chem shift.val err: 0.0000

1,52024,198
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 198
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 40
atom chem shift.comp id: TYR
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 179440
atom chem shift.seq id: 43
atom chem shift.val: 56.8148
atom chem shift.val err: 0.0000

1,52024,199
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 199
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 40
atom chem shift.comp id: TYR
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 179444
atom chem shift.seq id: 43
atom chem shift.val: 44.1230
atom chem shift.val err: 0.0000

1,52024,200
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 200
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 40
atom chem shift.comp id: TYR
atom chem shift.comp index id: 43
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26686
atom chem shift.seq id: 43
atom chem shift.val: 121.5025
atom chem shift.val err: 0.0000

1,52024,201
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 201
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 41
atom chem shift.comp id: ARG
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31587
atom chem shift.seq id: 44
atom chem shift.val: 8.6037
atom chem shift.val err: 0.0000

1,52024,202
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 202
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: 41
atom chem shift.comp id: ARG
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 44
atom chem shift.val: 175.8125
atom chem shift.val err: 0.0000

1,52024,203
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 203
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: 41
atom chem shift.comp id: ARG
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28629
atom chem shift.seq id: 44
atom chem shift.val: 54.4720
atom chem shift.val err: 0.0000

1,52024,204
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 204
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: 41
atom chem shift.comp id: ARG
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29883
atom chem shift.seq id: 44
atom chem shift.val: 34.4062
atom chem shift.val err: 0.0000

1,52024,205
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 41
atom chem shift.comp id: ARG
atom chem shift.comp index id: 44
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31588
atom chem shift.seq id: 44
atom chem shift.val: 120.4359
atom chem shift.val err: 0.0000

1,52024,206
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 206
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: 42
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27641
atom chem shift.seq id: 45
atom chem shift.val: 8.6820
atom chem shift.val err: 0.0000

1,52024,207
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 207
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: 42
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 45
atom chem shift.val: 173.5645
atom chem shift.val err: 0.0000

1,52024,208
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 208
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 42
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28542
atom chem shift.seq id: 45
atom chem shift.val: 55.6254
atom chem shift.val err: 0.0000

1,52024,209
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 209
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 42
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29598
atom chem shift.seq id: 45
atom chem shift.val: 37.9452
atom chem shift.val err: 0.0000

1,52024,210
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 210
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 42
atom chem shift.comp id: LYS
atom chem shift.comp index id: 45
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27643
atom chem shift.seq id: 45
atom chem shift.val: 122.6980
atom chem shift.val err: 0.0000

1,52024,211
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 211
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 43
atom chem shift.comp id: GLN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27002
atom chem shift.seq id: 46
atom chem shift.val: 8.9019
atom chem shift.val err: 0.0000

1,52024,212
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 212
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 43
atom chem shift.comp id: GLN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 46
atom chem shift.val: 175.2283
atom chem shift.val err: 0.0000

1,52024,213
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 213
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 43
atom chem shift.comp id: GLN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29037
atom chem shift.seq id: 46
atom chem shift.val: 55.2927
atom chem shift.val err: 0.0000

1,52024,214
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 214
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 43
atom chem shift.comp id: GLN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29040
atom chem shift.seq id: 46
atom chem shift.val: 29.7455
atom chem shift.val err: 0.0000

1,52024,215
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 215
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: 43
atom chem shift.comp id: GLN
atom chem shift.comp index id: 46
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27004
atom chem shift.seq id: 46
atom chem shift.val: 129.2590
atom chem shift.val err: 0.0000

1,52024,216
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 216
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: 44
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.resonance id: 27014
atom chem shift.seq id: 47
atom chem shift.val: 9.0572
atom chem shift.val err: 0.0000

1,52024,217
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 217
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: 44
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: 173.0192
atom chem shift.val err: 0.0000

1,52024,218
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 218
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: 44
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.resonance id: 29727
atom chem shift.seq id: 47
atom chem shift.val: 59.5929
atom chem shift.val err: 0.0000

1,52024,219
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 219
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: 44
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.resonance id: 29730
atom chem shift.seq id: 47
atom chem shift.val: 36.1235
atom chem shift.val err: 0.0000

1,52024,220
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 220
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 44
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.resonance id: 27016
atom chem shift.seq id: 47
atom chem shift.val: 121.8136
atom chem shift.val err: 0.0000

1,52024,221
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 221
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 45
atom chem shift.comp id: VAL
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26807
atom chem shift.seq id: 48
atom chem shift.val: 8.1318
atom chem shift.val err: 0.0000

1,52024,222
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 222
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 45
atom chem shift.comp id: VAL
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 48
atom chem shift.val: 175.6505
atom chem shift.val err: 0.0000

1,52024,223
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 223
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 45
atom chem shift.comp id: VAL
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28182
atom chem shift.seq id: 48
atom chem shift.val: 61.6131
atom chem shift.val err: 0.0000

1,52024,224
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 224
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 45
atom chem shift.comp id: VAL
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29676
atom chem shift.seq id: 48
atom chem shift.val: 32.2211
atom chem shift.val err: 0.0000

1,52024,225
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 225
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 45
atom chem shift.comp id: VAL
atom chem shift.comp index id: 48
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26809
atom chem shift.seq id: 48
atom chem shift.val: 122.1839
atom chem shift.val err: 0.0000

1,52024,226
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 226
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: 46
atom chem shift.comp id: ILE
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27698
atom chem shift.seq id: 49
atom chem shift.val: 8.3219
atom chem shift.val err: 0.0000

1,52024,227
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 227
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: 46
atom chem shift.comp id: ILE
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: 176.5382
atom chem shift.val err: 0.0000

1,52024,228
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 228
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: 46
atom chem shift.comp id: ILE
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28233
atom chem shift.seq id: 49
atom chem shift.val: 60.3388
atom chem shift.val err: 0.0000

1,52024,229
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 229
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: 46
atom chem shift.comp id: ILE
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29310
atom chem shift.seq id: 49
atom chem shift.val: 39.9795
atom chem shift.val err: 0.0000

1,52024,230
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 230
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 46
atom chem shift.comp id: ILE
atom chem shift.comp index id: 49
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27700
atom chem shift.seq id: 49
atom chem shift.val: 125.9300
atom chem shift.val err: 0.0000

1,52024,231
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 231
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 47
atom chem shift.comp id: ASP
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31445
atom chem shift.seq id: 50
atom chem shift.val: 9.5715
atom chem shift.val err: 0.0000

1,52024,232
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 232
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: 47
atom chem shift.comp id: ASP
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: 176.1778
atom chem shift.val err: 0.0000

1,52024,233
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 233
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: 47
atom chem shift.comp id: ASP
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 118599
atom chem shift.seq id: 50
atom chem shift.val: 55.2293
atom chem shift.val err: 0.0000

1,52024,234
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 234
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: 47
atom chem shift.comp id: ASP
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 118522
atom chem shift.seq id: 50
atom chem shift.val: 39.4044
atom chem shift.val err: 0.0000

1,52024,235
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 235
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: 47
atom chem shift.comp id: ASP
atom chem shift.comp index id: 50
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31446
atom chem shift.seq id: 50
atom chem shift.val: 130.3254
atom chem shift.val err: 0.0000

1,52024,236
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 236
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 48
atom chem shift.comp id: GLY
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30860
atom chem shift.seq id: 51
atom chem shift.val: 8.3209
atom chem shift.val err: 0.0000

1,52024,237
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 237
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: 48
atom chem shift.comp id: GLY
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: 173.0665
atom chem shift.val err: 0.0000

1,52024,238
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 238
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: 48
atom chem shift.comp id: GLY
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30858
atom chem shift.seq id: 51
atom chem shift.val: 45.2104
atom chem shift.val err: 0.0000

1,52024,239
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 239
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: 48
atom chem shift.comp id: GLY
atom chem shift.comp index id: 51
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30862
atom chem shift.seq id: 51
atom chem shift.val: 103.4203
atom chem shift.val err: 0.0000

1,52024,240
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 240
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: 49
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.resonance id: 27305
atom chem shift.seq id: 52
atom chem shift.val: 7.6871
atom chem shift.val err: 0.0000

1,52024,241
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 241
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
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: 175.5479
atom chem shift.val err: 0.0000

1,52024,242
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 242
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
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.resonance id: 28614
atom chem shift.seq id: 52
atom chem shift.val: 54.6029
atom chem shift.val err: 0.0000

1,52024,243
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 243
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
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.resonance id: 29607
atom chem shift.seq id: 52
atom chem shift.val: 31.7909
atom chem shift.val err: 0.0000

1,52024,244
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 244
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 49
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.resonance id: 27307
atom chem shift.seq id: 52
atom chem shift.val: 122.7538
atom chem shift.val err: 0.0000

1,52024,245
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 245
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: 50
atom chem shift.comp id: THR
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48025
atom chem shift.seq id: 53
atom chem shift.val: 9.0670
atom chem shift.val err: 0.0000

1,52024,246
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 246
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: 50
atom chem shift.comp id: THR
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: 173.4559
atom chem shift.val err: 0.0000

1,52024,247
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 247
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: 50
atom chem shift.comp id: THR
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48046
atom chem shift.seq id: 53
atom chem shift.val: 63.9652
atom chem shift.val err: 0.0000

1,52024,248
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 248
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: 50
atom chem shift.comp id: THR
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48052
atom chem shift.seq id: 53
atom chem shift.val: 68.1753
atom chem shift.val err: 0.0000

1,52024,249
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 249
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: 50
atom chem shift.comp id: THR
atom chem shift.comp index id: 53
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48026
atom chem shift.seq id: 53
atom chem shift.val: 125.9700
atom chem shift.val err: 0.0000

1,52024,250
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 250
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 51
atom chem shift.comp id: CYS
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26645
atom chem shift.seq id: 54
atom chem shift.val: 9.3632
atom chem shift.val err: 0.0000

1,52024,251
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 251
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: 51
atom chem shift.comp id: CYS
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: 171.3647
atom chem shift.val err: 0.0000

1,52024,252
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 252
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 51
atom chem shift.comp id: CYS
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29358
atom chem shift.seq id: 54
atom chem shift.val: 56.5756
atom chem shift.val err: 0.0000

1,52024,253
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 253
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 51
atom chem shift.comp id: CYS
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29349
atom chem shift.seq id: 54
atom chem shift.val: 31.2656
atom chem shift.val err: 0.0000

1,52024,254
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 254
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: 51
atom chem shift.comp id: CYS
atom chem shift.comp index id: 54
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26647
atom chem shift.seq id: 54
atom chem shift.val: 125.1358
atom chem shift.val err: 0.0000

1,52024,255
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 255
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: 52
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26273
atom chem shift.seq id: 55
atom chem shift.val: 8.8082
atom chem shift.val err: 0.0000

1,52024,256
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 256
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 52
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 55
atom chem shift.val: 174.9792
atom chem shift.val err: 0.0000

1,52024,257
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 257
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 52
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28695
atom chem shift.seq id: 55
atom chem shift.val: 53.2130
atom chem shift.val err: 0.0000

1,52024,258
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 258
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 52
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29613
atom chem shift.seq id: 55
atom chem shift.val: 43.8078
atom chem shift.val err: 0.0000

1,52024,259
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 259
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 52
atom chem shift.comp id: LEU
atom chem shift.comp index id: 55
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26275
atom chem shift.seq id: 55
atom chem shift.val: 122.6346
atom chem shift.val err: 0.0000

1,52024,260
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 260
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 53
atom chem shift.comp id: LEU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 61837
atom chem shift.seq id: 56
atom chem shift.val: 9.1367
atom chem shift.val err: 0.0000

1,52024,261
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 261
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 53
atom chem shift.comp id: LEU
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: 174.0822
atom chem shift.val err: 0.0000

1,52024,262
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 262
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 53
atom chem shift.comp id: LEU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 61858
atom chem shift.seq id: 56
atom chem shift.val: 53.6643
atom chem shift.val err: 0.0000

1,52024,263
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 263
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 53
atom chem shift.comp id: LEU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 61861
atom chem shift.seq id: 56
atom chem shift.val: 41.3277
atom chem shift.val err: 0.0000

1,52024,264
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 264
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 53
atom chem shift.comp id: LEU
atom chem shift.comp index id: 56
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 61838
atom chem shift.seq id: 56
atom chem shift.val: 123.5995
atom chem shift.val err: 0.0000

1,52024,265
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 265
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 54
atom chem shift.comp id: ASP
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28685
atom chem shift.seq id: 57
atom chem shift.val: 8.8512
atom chem shift.val err: 0.0000

1,52024,266
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 266
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: 54
atom chem shift.comp id: ASP
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: 174.8949
atom chem shift.val err: 0.0000

1,52024,267
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 267
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: 54
atom chem shift.comp id: ASP
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28698
atom chem shift.seq id: 57
atom chem shift.val: 53.0989
atom chem shift.val err: 0.0000

1,52024,268
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 268
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: 54
atom chem shift.comp id: ASP
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46595
atom chem shift.seq id: 57
atom chem shift.val: 42.3437
atom chem shift.val err: 0.0000

1,52024,269
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 269
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 54
atom chem shift.comp id: ASP
atom chem shift.comp index id: 57
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28687
atom chem shift.seq id: 57
atom chem shift.val: 126.9476
atom chem shift.val err: 0.0000

1,52024,270
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 270
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: 55
atom chem shift.comp id: ILE
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58758
atom chem shift.seq id: 58
atom chem shift.val: 9.2255
atom chem shift.val err: 0.0000

1,52024,271
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 271
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: 55
atom chem shift.comp id: ILE
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 58
atom chem shift.val: 174.1084
atom chem shift.val err: 0.0000

1,52024,272
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 272
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: 55
atom chem shift.comp id: ILE
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58774
atom chem shift.seq id: 58
atom chem shift.val: 60.4768
atom chem shift.val err: 0.0000

1,52024,273
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 273
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: 55
atom chem shift.comp id: ILE
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58771
atom chem shift.seq id: 58
atom chem shift.val: 41.1658
atom chem shift.val err: 0.0000

1,52024,274
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 274
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: 55
atom chem shift.comp id: ILE
atom chem shift.comp index id: 58
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58760
atom chem shift.seq id: 58
atom chem shift.val: 124.2697
atom chem shift.val err: 0.0000

1,52024,275
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 275
atom chem shift.ambiguity code: 1
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atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 56
atom chem shift.comp id: LEU
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31443
atom chem shift.seq id: 59
atom chem shift.val: 8.8316
atom chem shift.val err: 0.0000

1,52024,276
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 276
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 56
atom chem shift.comp id: LEU
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: 173.2883
atom chem shift.val err: 0.0000

1,52024,277
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 277
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: 56
atom chem shift.comp id: LEU
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 34316
atom chem shift.seq id: 59
atom chem shift.val: 53.9397
atom chem shift.val err: 0.0000

1,52024,278
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 278
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 56
atom chem shift.comp id: LEU
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 118445
atom chem shift.seq id: 59
atom chem shift.val: 43.9724
atom chem shift.val err: 0.0000

1,52024,279
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 279
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 56
atom chem shift.comp id: LEU
atom chem shift.comp index id: 59
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31444
atom chem shift.seq id: 59
atom chem shift.val: 130.4721
atom chem shift.val err: 0.0000

1,52024,280
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 280
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
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atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASP
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31457
atom chem shift.seq id: 60
atom chem shift.val: 9.2450
atom chem shift.val err: 0.0000

1,52024,281
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 281
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
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: 175.9672
atom chem shift.val err: 0.0000

1,52024,282
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 282
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
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 43869
atom chem shift.seq id: 60
atom chem shift.val: 53.5091
atom chem shift.val err: 0.0000

1,52024,283
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 283
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
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atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
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atom chem shift.comp id: ASP
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 120698
atom chem shift.seq id: 60
atom chem shift.val: 42.4465
atom chem shift.val err: 0.0000

1,52024,284
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 284
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 57
atom chem shift.comp id: ASP
atom chem shift.comp index id: 60
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31458
atom chem shift.seq id: 60
atom chem shift.val: 128.6780
atom chem shift.val err: 0.0000

1,52024,285
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 285
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: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30662
atom chem shift.seq id: 61
atom chem shift.val: 6.6646
atom chem shift.val err: 0.0000

1,52024,286
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 286
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
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atom chem shift.auth comp id: THR
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atom chem shift.comp id: THR
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: 173.0662
atom chem shift.val err: 0.0000

1,52024,287
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 287
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
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atom chem shift.auth comp id: THR
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atom chem shift.comp id: THR
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 178270
atom chem shift.seq id: 61
atom chem shift.val: 60.5896
atom chem shift.val err: 0.0000

1,52024,288
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 288
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: THR
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atom chem shift.comp id: THR
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 179087
atom chem shift.seq id: 61
atom chem shift.val: 72.6404
atom chem shift.val err: 0.0000

1,52024,289
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 289
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: 58
atom chem shift.comp id: THR
atom chem shift.comp index id: 61
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30664
atom chem shift.seq id: 61
atom chem shift.val: 111.5220
atom chem shift.val err: 0.0000

1,52024,290
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 290
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26096
atom chem shift.seq id: 62
atom chem shift.val: 7.5838
atom chem shift.val err: 0.0000

1,52024,291
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 291
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: ALA
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 62
atom chem shift.val: 180.2089
atom chem shift.val err: 0.0000

1,52024,292
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 292
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.comp id: ALA
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28734
atom chem shift.seq id: 62
atom chem shift.val: 52.2340
atom chem shift.val err: 0.0000

1,52024,293
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 293
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: ALA
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: 21.1720
atom chem shift.val err: 0.0000

1,52024,294
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 294
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
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atom chem shift.comp id: ALA
atom chem shift.comp index id: 62
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26098
atom chem shift.seq id: 62
atom chem shift.val: 120.0719
atom chem shift.val err: 0.0000

1,52024,295
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 295
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31733
atom chem shift.seq id: 63
atom chem shift.val: 9.2611
atom chem shift.val err: 0.0000

1,52024,296
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 296
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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: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 175.9776
atom chem shift.val err: 0.0000

1,52024,297
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 94262
atom chem shift.seq id: 63
atom chem shift.val: 46.5363
atom chem shift.val err: 0.0000

1,52024,298
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 298
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: GLY
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atom chem shift.comp id: GLY
atom chem shift.comp index id: 63
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31734
atom chem shift.seq id: 63
atom chem shift.val: 112.9218
atom chem shift.val err: 0.0000

1,52024,299
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 299
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173449
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atom chem shift.val: 7.8800
atom chem shift.val err: 0.0000

1,52024,300
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 300
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atom chem shift.assembly atom id: 0
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 64
atom chem shift.val: 176.8892
atom chem shift.val err: 0.0000

1,52024,301
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173456
atom chem shift.seq id: 64
atom chem shift.val: 56.5359
atom chem shift.val err: 0.0000

1,52024,302
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 302
atom chem shift.ambiguity code: 1
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173464
atom chem shift.seq id: 64
atom chem shift.val: 30.0594
atom chem shift.val err: 0.0000

1,52024,303
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 303
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atom chem shift.assembly atom id: 0
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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
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 64
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173451
atom chem shift.seq id: 64
atom chem shift.val: 120.8325
atom chem shift.val err: 0.0000

1,52024,304
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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atom chem shift.comp id: GLU
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31479
atom chem shift.seq id: 65
atom chem shift.val: 8.9364
atom chem shift.val err: 0.0000

1,52024,305
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 305
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atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 49940
atom chem shift.seq id: 65
atom chem shift.val: 58.2255
atom chem shift.val err: 0.0000

1,52024,306
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 306
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 62
atom chem shift.comp id: GLU
atom chem shift.comp index id: 65
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31480
atom chem shift.seq id: 65
atom chem shift.val: 125.6813
atom chem shift.val err: 0.0000

1,52024,307
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 307
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: TYR
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31116
atom chem shift.seq id: 67
atom chem shift.val: 176.7003
atom chem shift.val err: 0.0000

1,52024,308
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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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: TYR
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atom chem shift.comp id: TYR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26217
atom chem shift.seq id: 67
atom chem shift.val: 57.8794
atom chem shift.val err: 0.0000

1,52024,309
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 309
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 64
atom chem shift.comp id: TYR
atom chem shift.comp index id: 67
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 138065
atom chem shift.seq id: 67
atom chem shift.val: 37.7512
atom chem shift.val err: 0.0000

1,52024,310
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 310
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: 65
atom chem shift.comp id: SER
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26216
atom chem shift.seq id: 68
atom chem shift.val: 7.9972
atom chem shift.val err: 0.0000

1,52024,311
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 311
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: 65
atom chem shift.comp id: SER
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 130053
atom chem shift.seq id: 68
atom chem shift.val: 175.7332
atom chem shift.val err: 0.0000

1,52024,312
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 312
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: 65
atom chem shift.comp id: SER
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 130047
atom chem shift.seq id: 68
atom chem shift.val: 60.3553
atom chem shift.val err: 0.0000

1,52024,313
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 313
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: 65
atom chem shift.comp id: SER
atom chem shift.comp index id: 68
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26218
atom chem shift.seq id: 68
atom chem shift.val: 118.5786
atom chem shift.val err: 0.0000

1,52024,314
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 314
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 66
atom chem shift.comp id: ALA
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 130043
atom chem shift.seq id: 69
atom chem shift.val: 8.7805
atom chem shift.val err: 0.0000

1,52024,315
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 315
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 66
atom chem shift.comp id: ALA
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 179.2986
atom chem shift.val err: 0.0000

1,52024,316
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 66
atom chem shift.comp id: ALA
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 130044
atom chem shift.seq id: 69
atom chem shift.val: 54.4025
atom chem shift.val err: 0.0000

1,52024,317
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 317
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 66
atom chem shift.comp id: ALA
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 69
atom chem shift.val: 18.2509
atom chem shift.val err: 0.0000

1,52024,318
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ALA
atom chem shift.auth seq id: 66
atom chem shift.comp id: ALA
atom chem shift.comp index id: 69
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 130045
atom chem shift.seq id: 69
atom chem shift.val: 125.5769
atom chem shift.val err: 0.0000

1,52024,319
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 319
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 67
atom chem shift.comp id: MET
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27995
atom chem shift.seq id: 70
atom chem shift.val: 7.8921
atom chem shift.val err: 0.0000

1,52024,320
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 320
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 67
atom chem shift.comp id: MET
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 70
atom chem shift.val: 177.2046
atom chem shift.val err: 0.0000

1,52024,321
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 321
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 67
atom chem shift.comp id: MET
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 83683
atom chem shift.seq id: 70
atom chem shift.val: 57.2246
atom chem shift.val err: 0.0000

1,52024,322
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 322
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 67
atom chem shift.comp id: MET
atom chem shift.comp index id: 70
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27997
atom chem shift.seq id: 70
atom chem shift.val: 116.5923
atom chem shift.val err: 0.0000

1,52024,323
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 323
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: 68
atom chem shift.comp id: ARG
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30101
atom chem shift.seq id: 71
atom chem shift.val: 7.6859
atom chem shift.val err: 0.0000

1,52024,324
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 324
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: 68
atom chem shift.comp id: ARG
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 71
atom chem shift.val: 177.0134
atom chem shift.val err: 0.0000

1,52024,325
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 325
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: 68
atom chem shift.comp id: ARG
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 78101
atom chem shift.seq id: 71
atom chem shift.val: 58.2017
atom chem shift.val err: 0.0000

1,52024,326
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 326
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: 68
atom chem shift.comp id: ARG
atom chem shift.comp index id: 71
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30103
atom chem shift.seq id: 71
atom chem shift.val: 119.2710
atom chem shift.val err: 0.0000

1,52024,327
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 327
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: 69
atom chem shift.comp id: ASP
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 121755
atom chem shift.seq id: 72
atom chem shift.val: 7.9058
atom chem shift.val err: 0.0000

1,52024,328
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 328
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: 69
atom chem shift.comp id: ASP
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 72
atom chem shift.val: 177.7631
atom chem shift.val err: 0.0000

1,52024,329
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 329
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: 69
atom chem shift.comp id: ASP
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 122454
atom chem shift.seq id: 72
atom chem shift.val: 57.5523
atom chem shift.val err: 0.0000

1,52024,330
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 330
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: 69
atom chem shift.comp id: ASP
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 123023
atom chem shift.seq id: 72
atom chem shift.val: 40.2232
atom chem shift.val err: 0.0000

1,52024,331
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 331
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: 69
atom chem shift.comp id: ASP
atom chem shift.comp index id: 72
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 121756
atom chem shift.seq id: 72
atom chem shift.val: 117.9469
atom chem shift.val err: 0.0000

1,52024,332
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 332
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: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26891
atom chem shift.seq id: 73
atom chem shift.val: 7.7523
atom chem shift.val err: 0.0000

1,52024,333
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 333
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: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 178.4207
atom chem shift.val err: 0.0000

1,52024,334
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 334
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: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 184271
atom chem shift.seq id: 73
atom chem shift.val: 58.9598
atom chem shift.val err: 0.0000

1,52024,335
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 335
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: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 28.1562
atom chem shift.val err: 0.0000

1,52024,336
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 336
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: 70
atom chem shift.comp id: GLN
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26893
atom chem shift.seq id: 73
atom chem shift.val: 115.9447
atom chem shift.val err: 0.0000

1,52024,337
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 337
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 71
atom chem shift.comp id: TYR
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27866
atom chem shift.seq id: 74
atom chem shift.val: 7.5225
atom chem shift.val err: 0.0000

1,52024,338
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 338
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 71
atom chem shift.comp id: TYR
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 179.0282
atom chem shift.val err: 0.0000

1,52024,339
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 339
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 71
atom chem shift.comp id: TYR
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 184265
atom chem shift.seq id: 74
atom chem shift.val: 58.7121
atom chem shift.val err: 0.0000

1,52024,340
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 340
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 71
atom chem shift.comp id: TYR
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 74
atom chem shift.val: 36.9995
atom chem shift.val err: 0.0000

1,52024,341
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 341
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: 71
atom chem shift.comp id: TYR
atom chem shift.comp index id: 74
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27868
atom chem shift.seq id: 74
atom chem shift.val: 116.1521
atom chem shift.val err: 0.0000

1,52024,342
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 342
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 72
atom chem shift.comp id: MET
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31543
atom chem shift.seq id: 75
atom chem shift.val: 8.2635
atom chem shift.val err: 0.0000

1,52024,343
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 343
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 72
atom chem shift.comp id: MET
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 176.4763
atom chem shift.val err: 0.0000

1,52024,344
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 344
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 72
atom chem shift.comp id: MET
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 187008
atom chem shift.seq id: 75
atom chem shift.val: 59.0892
atom chem shift.val err: 0.0000

1,52024,345
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 345
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 72
atom chem shift.comp id: MET
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 75
atom chem shift.val: 32.1036
atom chem shift.val err: 0.0000

1,52024,346
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 346
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 72
atom chem shift.comp id: MET
atom chem shift.comp index id: 75
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31544
atom chem shift.seq id: 75
atom chem shift.val: 122.1436
atom chem shift.val err: 0.0000

1,52024,347
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 347
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ARG
atom chem shift.auth seq id: 73
atom chem shift.comp id: ARG
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30242
atom chem shift.seq id: 76
atom chem shift.val: 7.8276
atom chem shift.val err: 0.0000

1,52024,348
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 348
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: 73
atom chem shift.comp id: ARG
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 76
atom chem shift.val: 178.4409
atom chem shift.val err: 0.0000

1,52024,349
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 349
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: 73
atom chem shift.comp id: ARG
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30240
atom chem shift.seq id: 76
atom chem shift.val: 59.5964
atom chem shift.val err: 0.0000

1,52024,350
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 350
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: 73
atom chem shift.comp id: ARG
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30243
atom chem shift.seq id: 76
atom chem shift.val: 30.4430
atom chem shift.val err: 0.0000

1,52024,351
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 351
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: 73
atom chem shift.comp id: ARG
atom chem shift.comp index id: 76
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30244
atom chem shift.seq id: 76
atom chem shift.val: 117.4302
atom chem shift.val err: 0.0000

1,52024,352
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 352
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: 74
atom chem shift.comp id: THR
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26609
atom chem shift.seq id: 77
atom chem shift.val: 7.6015
atom chem shift.val err: 0.0000

1,52024,353
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 353
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: 74
atom chem shift.comp id: THR
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 77
atom chem shift.val: 176.0579
atom chem shift.val err: 0.0000

1,52024,354
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 354
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: 74
atom chem shift.comp id: THR
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28149
atom chem shift.seq id: 77
atom chem shift.val: 63.1778
atom chem shift.val err: 0.0000

1,52024,355
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 355
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: 74
atom chem shift.comp id: THR
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30762
atom chem shift.seq id: 77
atom chem shift.val: 69.5789
atom chem shift.val err: 0.0000

1,52024,356
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 356
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: 74
atom chem shift.comp id: THR
atom chem shift.comp index id: 77
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26611
atom chem shift.seq id: 77
atom chem shift.val: 108.4500
atom chem shift.val err: 0.0000

1,52024,357
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 357
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 75
atom chem shift.comp id: GLY
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26624
atom chem shift.seq id: 78
atom chem shift.val: 7.8463
atom chem shift.val err: 0.0000

1,52024,358
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 358
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: 75
atom chem shift.comp id: GLY
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 78
atom chem shift.val: 172.2849
atom chem shift.val err: 0.0000

1,52024,359
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 359
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: 75
atom chem shift.comp id: GLY
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30765
atom chem shift.seq id: 78
atom chem shift.val: 46.5801
atom chem shift.val err: 0.0000

1,52024,360
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 360
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: 75
atom chem shift.comp id: GLY
atom chem shift.comp index id: 78
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26626
atom chem shift.seq id: 78
atom chem shift.val: 108.0877
atom chem shift.val err: 0.0000

1,52024,361
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 361
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: 76
atom chem shift.comp id: GLU
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 216504
atom chem shift.seq id: 79
atom chem shift.val: 8.5749
atom chem shift.val err: 0.0000

1,52024,362
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 362
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 76
atom chem shift.comp id: GLU
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31119
atom chem shift.seq id: 79
atom chem shift.val: 176.6672
atom chem shift.val err: 0.0000

1,52024,363
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 363
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 76
atom chem shift.comp id: GLU
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26970
atom chem shift.seq id: 79
atom chem shift.val: 56.6765
atom chem shift.val err: 0.0000

1,52024,364
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 364
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 76
atom chem shift.comp id: GLU
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 217597
atom chem shift.seq id: 79
atom chem shift.val: 32.1479
atom chem shift.val err: 0.0000

1,52024,365
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 365
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 76
atom chem shift.comp id: GLU
atom chem shift.comp index id: 79
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 216505
atom chem shift.seq id: 79
atom chem shift.val: 120.6234
atom chem shift.val err: 0.0000

1,52024,366
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 366
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 77
atom chem shift.comp id: GLY
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26969
atom chem shift.seq id: 80
atom chem shift.val: 7.1787
atom chem shift.val err: 0.0000

1,52024,367
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 367
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: 77
atom chem shift.comp id: GLY
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 80
atom chem shift.val: 170.7342
atom chem shift.val err: 0.0000

1,52024,368
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 368
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: 77
atom chem shift.comp id: GLY
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30894
atom chem shift.seq id: 80
atom chem shift.val: 45.4042
atom chem shift.val err: 0.0000

1,52024,369
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 369
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 77
atom chem shift.comp id: GLY
atom chem shift.comp index id: 80
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26971
atom chem shift.seq id: 80
atom chem shift.val: 101.0790
atom chem shift.val err: 0.0000

1,52024,370
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 370
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 78
atom chem shift.comp id: PHE
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31433
atom chem shift.seq id: 81
atom chem shift.val: 8.1352
atom chem shift.val err: 0.0000

1,52024,371
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 371
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: PHE
atom chem shift.auth seq id: 78
atom chem shift.comp id: PHE
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 81
atom chem shift.val: 173.4991
atom chem shift.val err: 0.0000

1,52024,372
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 372
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: PHE
atom chem shift.auth seq id: 78
atom chem shift.comp id: PHE
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 70487
atom chem shift.seq id: 81
atom chem shift.val: 56.8768
atom chem shift.val err: 0.0000

1,52024,373
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 373
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: PHE
atom chem shift.auth seq id: 78
atom chem shift.comp id: PHE
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 70585
atom chem shift.seq id: 81
atom chem shift.val: 42.5442
atom chem shift.val err: 0.0000

1,52024,374
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 374
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 78
atom chem shift.comp id: PHE
atom chem shift.comp index id: 81
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31435
atom chem shift.seq id: 81
atom chem shift.val: 121.0411
atom chem shift.val err: 0.0000

1,52024,375
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 375
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: 79
atom chem shift.comp id: LEU
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26921
atom chem shift.seq id: 82
atom chem shift.val: 9.2724
atom chem shift.val err: 0.0000

1,52024,376
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 376
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 79
atom chem shift.comp id: LEU
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 82
atom chem shift.val: 174.5577
atom chem shift.val err: 0.0000

1,52024,377
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 377
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 79
atom chem shift.comp id: LEU
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46067
atom chem shift.seq id: 82
atom chem shift.val: 53.7927
atom chem shift.val err: 0.0000

1,52024,378
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 378
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 79
atom chem shift.comp id: LEU
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46154
atom chem shift.seq id: 82
atom chem shift.val: 42.9474
atom chem shift.val err: 0.0000

1,52024,379
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 379
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 79
atom chem shift.comp id: LEU
atom chem shift.comp index id: 82
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26923
atom chem shift.seq id: 82
atom chem shift.val: 127.7941
atom chem shift.val err: 0.0000

1,52024,380
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 380
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: CYS
atom chem shift.auth seq id: 80
atom chem shift.comp id: CYS
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26435
atom chem shift.seq id: 83
atom chem shift.val: 8.7692
atom chem shift.val err: 0.0000

1,52024,381
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 381
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: 80
atom chem shift.comp id: CYS
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 83
atom chem shift.val: 172.7700
atom chem shift.val err: 0.0000

1,52024,382
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 382
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: 80
atom chem shift.comp id: CYS
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29373
atom chem shift.seq id: 83
atom chem shift.val: 57.7423
atom chem shift.val err: 0.0000

1,52024,383
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 383
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: 80
atom chem shift.comp id: CYS
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29370
atom chem shift.seq id: 83
atom chem shift.val: 27.5371
atom chem shift.val err: 0.0000

1,52024,384
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 384
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: 80
atom chem shift.comp id: CYS
atom chem shift.comp index id: 83
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26437
atom chem shift.seq id: 83
atom chem shift.val: 124.9497
atom chem shift.val err: 0.0000

1,52024,385
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 385
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: 81
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 47996
atom chem shift.seq id: 84
atom chem shift.val: 9.0683
atom chem shift.val err: 0.0000

1,52024,386
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 386
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 81
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 84
atom chem shift.val: 174.9264
atom chem shift.val err: 0.0000

1,52024,387
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 387
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 81
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48009
atom chem shift.seq id: 84
atom chem shift.val: 61.2887
atom chem shift.val err: 0.0000

1,52024,388
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 388
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 81
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 48015
atom chem shift.seq id: 84
atom chem shift.val: 33.4439
atom chem shift.val err: 0.0000

1,52024,389
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 389
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: 81
atom chem shift.comp id: VAL
atom chem shift.comp index id: 84
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 47998
atom chem shift.seq id: 84
atom chem shift.val: 126.0835
atom chem shift.val err: 0.0000

1,52024,390
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 390
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 82
atom chem shift.comp id: PHE
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29525
atom chem shift.seq id: 85
atom chem shift.val: 9.2643
atom chem shift.val err: 0.0000

1,52024,391
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 391
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 82
atom chem shift.comp id: PHE
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 85
atom chem shift.val: 171.1813
atom chem shift.val err: 0.0000

1,52024,392
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 392
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 82
atom chem shift.comp id: PHE
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29523
atom chem shift.seq id: 85
atom chem shift.val: 55.2511
atom chem shift.val err: 0.0000

1,52024,393
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 393
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 82
atom chem shift.comp id: PHE
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29526
atom chem shift.seq id: 85
atom chem shift.val: 40.6371
atom chem shift.val err: 0.0000

1,52024,394
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 394
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 82
atom chem shift.comp id: PHE
atom chem shift.comp index id: 85
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29527
atom chem shift.seq id: 85
atom chem shift.val: 123.6263
atom chem shift.val err: 0.0000

1,52024,395
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 395
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26363
atom chem shift.seq id: 86
atom chem shift.val: 8.6915
atom chem shift.val err: 0.0000

1,52024,396
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 396
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 86
atom chem shift.val: 179.2453
atom chem shift.val err: 0.0000

1,52024,397
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 397
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28758
atom chem shift.seq id: 86
atom chem shift.val: 49.7188
atom chem shift.val err: 0.0000

1,52024,398
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 398
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29796
atom chem shift.seq id: 86
atom chem shift.val: 21.6651
atom chem shift.val err: 0.0000

1,52024,399
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 399
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 83
atom chem shift.comp id: ALA
atom chem shift.comp index id: 86
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26365
atom chem shift.seq id: 86
atom chem shift.val: 121.3476
atom chem shift.val err: 0.0000

1,52024,400
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 400
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: 84
atom chem shift.comp id: ILE
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30479
atom chem shift.seq id: 87
atom chem shift.val: 8.5271
atom chem shift.val err: 0.0000

1,52024,401
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 401
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: 84
atom chem shift.comp id: ILE
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 87
atom chem shift.val: 174.0306
atom chem shift.val err: 0.0000

1,52024,402
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 402
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: 84
atom chem shift.comp id: ILE
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30474
atom chem shift.seq id: 87
atom chem shift.val: 63.2265
atom chem shift.val err: 0.0000

1,52024,403
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 403
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: 84
atom chem shift.comp id: ILE
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 90075
atom chem shift.seq id: 87
atom chem shift.val: 38.1788
atom chem shift.val err: 0.0000

1,52024,404
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ILE
atom chem shift.auth seq id: 84
atom chem shift.comp id: ILE
atom chem shift.comp index id: 87
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30481
atom chem shift.seq id: 87
atom chem shift.val: 113.4496
atom chem shift.val err: 0.0000

1,52024,405
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 405
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: 85
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 139438
atom chem shift.seq id: 88
atom chem shift.val: 7.8431
atom chem shift.val err: 0.0000

1,52024,406
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 406
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: 85
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 88
atom chem shift.val: 174.6532
atom chem shift.val err: 0.0000

1,52024,407
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 407
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 85
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 141370
atom chem shift.seq id: 88
atom chem shift.val: 52.0536
atom chem shift.val err: 0.0000

1,52024,408
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 408
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 85
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 141198
atom chem shift.seq id: 88
atom chem shift.val: 37.8831
atom chem shift.val err: 0.0000

1,52024,409
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 409
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: 85
atom chem shift.comp id: ASN
atom chem shift.comp index id: 88
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 139439
atom chem shift.seq id: 88
atom chem shift.val: 116.8612
atom chem shift.val err: 0.0000

1,52024,410
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 410
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27245
atom chem shift.seq id: 89
atom chem shift.val: 7.8400
atom chem shift.val err: 0.0000

1,52024,411
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 411
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 8.0611
atom chem shift.val err: 0.0000

1,52024,412
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 412
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 7.1117
atom chem shift.val err: 0.0000

1,52024,413
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 413
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 175.1440
atom chem shift.val err: 0.0000

1,52024,414
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 414
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30135
atom chem shift.seq id: 89
atom chem shift.val: 51.8314
atom chem shift.val err: 0.0000

1,52024,415
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 415
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30132
atom chem shift.seq id: 89
atom chem shift.val: 39.1066
atom chem shift.val err: 0.0000

1,52024,416
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 416
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27247
atom chem shift.seq id: 89
atom chem shift.val: 119.0379
atom chem shift.val err: 0.0000

1,52024,417
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 417
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: 86
atom chem shift.comp id: ASN
atom chem shift.comp index id: 89
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 89
atom chem shift.val: 112.6261
atom chem shift.val err: 0.0000

1,52024,418
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 418
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: 87
atom chem shift.comp id: THR
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58784
atom chem shift.seq id: 90
atom chem shift.val: 9.2503
atom chem shift.val err: 0.0000

1,52024,419
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 419
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: 87
atom chem shift.comp id: THR
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31161
atom chem shift.seq id: 90
atom chem shift.val: 176.0748
atom chem shift.val err: 0.0000

1,52024,420
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 420
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: 87
atom chem shift.comp id: THR
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 59308
atom chem shift.seq id: 90
atom chem shift.val: 66.8567
atom chem shift.val err: 0.0000

1,52024,421
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 421
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: 87
atom chem shift.comp id: THR
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58796
atom chem shift.seq id: 90
atom chem shift.val: 68.3875
atom chem shift.val err: 0.0000

1,52024,422
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 422
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: 87
atom chem shift.comp id: THR
atom chem shift.comp index id: 90
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 58785
atom chem shift.seq id: 90
atom chem shift.val: 124.3889
atom chem shift.val err: 0.0000

1,52024,423
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 423
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: 88
atom chem shift.comp id: LYS
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25961
atom chem shift.seq id: 91
atom chem shift.val: 8.4727
atom chem shift.val err: 0.0000

1,52024,424
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 424
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: 88
atom chem shift.comp id: LYS
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 91
atom chem shift.val: 178.0562
atom chem shift.val err: 0.0000

1,52024,425
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 425
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: 88
atom chem shift.comp id: LYS
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28278
atom chem shift.seq id: 91
atom chem shift.val: 59.4633
atom chem shift.val err: 0.0000

1,52024,426
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 426
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: 88
atom chem shift.comp id: LYS
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29487
atom chem shift.seq id: 91
atom chem shift.val: 31.3611
atom chem shift.val err: 0.0000

1,52024,427
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 427
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: 88
atom chem shift.comp id: LYS
atom chem shift.comp index id: 91
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25963
atom chem shift.seq id: 91
atom chem shift.val: 124.1986
atom chem shift.val err: 0.0000

1,52024,428
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 428
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: 89
atom chem shift.comp id: SER
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31028
atom chem shift.seq id: 92
atom chem shift.val: 7.9182
atom chem shift.val err: 0.0000

1,52024,429
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 429
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: 89
atom chem shift.comp id: SER
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 92
atom chem shift.val: 175.9200
atom chem shift.val err: 0.0000

1,52024,430
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 430
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: 89
atom chem shift.comp id: SER
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28185
atom chem shift.seq id: 92
atom chem shift.val: 61.6075
atom chem shift.val err: 0.0000

1,52024,431
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 431
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: 89
atom chem shift.comp id: SER
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30432
atom chem shift.seq id: 92
atom chem shift.val: 63.8689
atom chem shift.val err: 0.0000

1,52024,432
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 432
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: 89
atom chem shift.comp id: SER
atom chem shift.comp index id: 92
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31030
atom chem shift.seq id: 92
atom chem shift.val: 114.5200
atom chem shift.val err: 0.0000

1,52024,433
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 433
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 90
atom chem shift.comp id: PHE
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29366
atom chem shift.seq id: 93
atom chem shift.val: 7.4212
atom chem shift.val err: 0.0000

1,52024,434
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 434
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: PHE
atom chem shift.auth seq id: 90
atom chem shift.comp id: PHE
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 93
atom chem shift.val: 177.2124
atom chem shift.val err: 0.0000

1,52024,435
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 435
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: PHE
atom chem shift.auth seq id: 90
atom chem shift.comp id: PHE
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28251
atom chem shift.seq id: 93
atom chem shift.val: 59.8813
atom chem shift.val err: 0.0000

1,52024,436
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 436
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: PHE
atom chem shift.auth seq id: 90
atom chem shift.comp id: PHE
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29367
atom chem shift.seq id: 93
atom chem shift.val: 40.0466
atom chem shift.val err: 0.0000

1,52024,437
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 437
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 90
atom chem shift.comp id: PHE
atom chem shift.comp index id: 93
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29368
atom chem shift.seq id: 93
atom chem shift.val: 125.0225
atom chem shift.val err: 0.0000

1,52024,438
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 438
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: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31553
atom chem shift.seq id: 94
atom chem shift.val: 8.3209
atom chem shift.val err: 0.0000

1,52024,439
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 439
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 94
atom chem shift.val: 179.5690
atom chem shift.val err: 0.0000

1,52024,440
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 440
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29745
atom chem shift.seq id: 94
atom chem shift.val: 59.0671
atom chem shift.val err: 0.0000

1,52024,441
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 441
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29748
atom chem shift.seq id: 94
atom chem shift.val: 29.1864
atom chem shift.val err: 0.0000

1,52024,442
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 442
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 91
atom chem shift.comp id: GLU
atom chem shift.comp index id: 94
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31554
atom chem shift.seq id: 94
atom chem shift.val: 121.6186
atom chem shift.val err: 0.0000

1,52024,443
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 443
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 92
atom chem shift.comp id: ASP
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30278
atom chem shift.seq id: 95
atom chem shift.val: 8.6079
atom chem shift.val err: 0.0000

1,52024,444
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 444
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 92
atom chem shift.comp id: ASP
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 95
atom chem shift.val: 178.0739
atom chem shift.val err: 0.0000

1,52024,445
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 445
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 92
atom chem shift.comp id: ASP
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30276
atom chem shift.seq id: 95
atom chem shift.val: 56.3996
atom chem shift.val err: 0.0000

1,52024,446
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 446
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 92
atom chem shift.comp id: ASP
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30279
atom chem shift.seq id: 95
atom chem shift.val: 41.0941
atom chem shift.val err: 0.0000

1,52024,447
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 447
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ASP
atom chem shift.auth seq id: 92
atom chem shift.comp id: ASP
atom chem shift.comp index id: 95
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30280
atom chem shift.seq id: 95
atom chem shift.val: 117.3014
atom chem shift.val err: 0.0000

1,52024,448
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 448
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: 93
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26324
atom chem shift.seq id: 96
atom chem shift.val: 7.5140
atom chem shift.val err: 0.0000

1,52024,449
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 449
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: 93
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 96
atom chem shift.val: 177.3760
atom chem shift.val err: 0.0000

1,52024,450
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 450
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 93
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30003
atom chem shift.seq id: 96
atom chem shift.val: 62.0855
atom chem shift.val err: 0.0000

1,52024,451
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 451
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 93
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 183758
atom chem shift.seq id: 96
atom chem shift.val: 34.5907
atom chem shift.val err: 0.0000

1,52024,452
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 452
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 93
atom chem shift.comp id: ILE
atom chem shift.comp index id: 96
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26326
atom chem shift.seq id: 96
atom chem shift.val: 120.1372
atom chem shift.val err: 0.0000

1,52024,453
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 453
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: HIS
atom chem shift.auth seq id: 94
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31677
atom chem shift.seq id: 97
atom chem shift.val: 7.7527
atom chem shift.val err: 0.0000

1,52024,454
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 454
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: 94
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 97
atom chem shift.val: 176.9843
atom chem shift.val err: 0.0000

1,52024,455
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 455
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: 94
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28254
atom chem shift.seq id: 97
atom chem shift.val: 59.7481
atom chem shift.val err: 0.0000

1,52024,456
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 456
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: 94
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 212547
atom chem shift.seq id: 97
atom chem shift.val: 30.2930
atom chem shift.val err: 0.0000

1,52024,457
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 457
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: 94
atom chem shift.comp id: HIS
atom chem shift.comp index id: 97
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31678
atom chem shift.seq id: 97
atom chem shift.val: 117.1400
atom chem shift.val err: 0.0000

1,52024,458
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 458
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: 95
atom chem shift.comp id: HIS
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31693
atom chem shift.seq id: 98
atom chem shift.val: 7.1563
atom chem shift.val err: 0.0000

1,52024,459
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: HIS
atom chem shift.auth seq id: 95
atom chem shift.comp id: HIS
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 98
atom chem shift.val: 178.7324
atom chem shift.val err: 0.0000

1,52024,460
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: HIS
atom chem shift.auth seq id: 95
atom chem shift.comp id: HIS
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30327
atom chem shift.seq id: 98
atom chem shift.val: 58.4566
atom chem shift.val err: 0.0000

1,52024,461
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: HIS
atom chem shift.auth seq id: 95
atom chem shift.comp id: HIS
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30333
atom chem shift.seq id: 98
atom chem shift.val: 29.1834
atom chem shift.val err: 0.0000

1,52024,462
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 462
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: 95
atom chem shift.comp id: HIS
atom chem shift.comp index id: 98
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31694
atom chem shift.seq id: 98
atom chem shift.val: 116.4587
atom chem shift.val err: 0.0000

1,52024,463
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 463
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 96
atom chem shift.comp id: TYR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30161
atom chem shift.seq id: 99
atom chem shift.val: 7.6291
atom chem shift.val err: 0.0000

1,52024,464
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 464
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 96
atom chem shift.comp id: TYR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 99
atom chem shift.val: 177.4630
atom chem shift.val err: 0.0000

1,52024,465
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 465
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 96
atom chem shift.comp id: TYR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28146
atom chem shift.seq id: 99
atom chem shift.val: 63.2297
atom chem shift.val err: 0.0000

1,52024,466
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 466
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 96
atom chem shift.comp id: TYR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30165
atom chem shift.seq id: 99
atom chem shift.val: 38.1898
atom chem shift.val err: 0.0000

1,52024,467
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 467
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
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: 96
atom chem shift.comp id: TYR
atom chem shift.comp index id: 99
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30163
atom chem shift.seq id: 99
atom chem shift.val: 118.8648
atom chem shift.val err: 0.0000

1,52024,468
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 468
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: 97
atom chem shift.comp id: ARG
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30224
atom chem shift.seq id: 100
atom chem shift.val: 8.3529
atom chem shift.val err: 0.0000

1,52024,469
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 469
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: 97
atom chem shift.comp id: ARG
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 100
atom chem shift.val: 177.3731
atom chem shift.val err: 0.0000

1,52024,470
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 470
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: 97
atom chem shift.comp id: ARG
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28248
atom chem shift.seq id: 100
atom chem shift.val: 60.0173
atom chem shift.val err: 0.0000

1,52024,471
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 471
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: 97
atom chem shift.comp id: ARG
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 80994
atom chem shift.seq id: 100
atom chem shift.val: 28.7281
atom chem shift.val err: 0.0000

1,52024,472
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 472
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: 97
atom chem shift.comp id: ARG
atom chem shift.comp index id: 100
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30226
atom chem shift.seq id: 100
atom chem shift.val: 117.9954
atom chem shift.val err: 0.0000

1,52024,473
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 473
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: 98
atom chem shift.comp id: GLU
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26792
atom chem shift.seq id: 101
atom chem shift.val: 8.0023
atom chem shift.val err: 0.0000

1,52024,474
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 474
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLU
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30981
atom chem shift.seq id: 101
atom chem shift.val: 178.9588
atom chem shift.val err: 0.0000

1,52024,475
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 475
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLU
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 84367
atom chem shift.seq id: 101
atom chem shift.val: 59.1757
atom chem shift.val err: 0.0000

1,52024,476
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 476
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLU
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 84525
atom chem shift.seq id: 101
atom chem shift.val: 29.2241
atom chem shift.val err: 0.0000

1,52024,477
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: GLU
atom chem shift.auth seq id: 98
atom chem shift.comp id: GLU
atom chem shift.comp index id: 101
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26794
atom chem shift.seq id: 101
atom chem shift.val: 116.5262
atom chem shift.val err: 0.0000

1,52024,478
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: GLN
atom chem shift.auth seq id: 99
atom chem shift.comp id: GLN
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27827
atom chem shift.seq id: 102
atom chem shift.val: 7.7588
atom chem shift.val err: 0.0000

1,52024,479
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 479
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 99
atom chem shift.comp id: GLN
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31065
atom chem shift.seq id: 102
atom chem shift.val: 177.2505
atom chem shift.val err: 0.0000

1,52024,480
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 480
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 99
atom chem shift.comp id: GLN
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26829
atom chem shift.seq id: 102
atom chem shift.val: 59.2323
atom chem shift.val err: 0.0000

1,52024,481
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 481
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 99
atom chem shift.comp id: GLN
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 74558
atom chem shift.seq id: 102
atom chem shift.val: 27.9800
atom chem shift.val err: 0.0000

1,52024,482
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 482
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: 99
atom chem shift.comp id: GLN
atom chem shift.comp index id: 102
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27829
atom chem shift.seq id: 102
atom chem shift.val: 120.0015
atom chem shift.val err: 0.0000

1,52024,483
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 483
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: 100
atom chem shift.comp id: ILE
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30014
atom chem shift.seq id: 103
atom chem shift.val: 8.0257
atom chem shift.val err: 0.0000

1,52024,484
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 100
atom chem shift.comp id: ILE
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 157656
atom chem shift.seq id: 103
atom chem shift.val: 177.3885
atom chem shift.val err: 0.0000

1,52024,485
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ILE
atom chem shift.auth seq id: 100
atom chem shift.comp id: ILE
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 157948
atom chem shift.seq id: 103
atom chem shift.val: 65.8823
atom chem shift.val err: 0.0000

1,52024,486
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 486
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: 100
atom chem shift.comp id: ILE
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 103
atom chem shift.val: 38.1686
atom chem shift.val err: 0.0000

1,52024,487
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ILE
atom chem shift.auth seq id: 100
atom chem shift.comp id: ILE
atom chem shift.comp index id: 103
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30016
atom chem shift.seq id: 103
atom chem shift.val: 119.9894
atom chem shift.val err: 0.0000

1,52024,488
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 488
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: 101
atom chem shift.comp id: LYS
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 139440
atom chem shift.seq id: 104
atom chem shift.val: 7.7948
atom chem shift.val err: 0.0000

1,52024,489
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 489
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: 101
atom chem shift.comp id: LYS
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30966
atom chem shift.seq id: 104
atom chem shift.val: 179.3447
atom chem shift.val err: 0.0000

1,52024,490
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 490
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: 101
atom chem shift.comp id: LYS
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26115
atom chem shift.seq id: 104
atom chem shift.val: 59.7479
atom chem shift.val err: 0.0000

1,52024,491
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 491
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: 101
atom chem shift.comp id: LYS
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27702
atom chem shift.seq id: 104
atom chem shift.val: 32.2435
atom chem shift.val err: 0.0000

1,52024,492
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 492
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: 101
atom chem shift.comp id: LYS
atom chem shift.comp index id: 104
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 139441
atom chem shift.seq id: 104
atom chem shift.val: 116.7541
atom chem shift.val err: 0.0000

1,52024,493
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 493
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: 102
atom chem shift.comp id: ARG
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27164
atom chem shift.seq id: 105
atom chem shift.val: 7.6635
atom chem shift.val err: 0.0000

1,52024,494
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 494
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: 102
atom chem shift.comp id: ARG
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 105
atom chem shift.val: 179.5811
atom chem shift.val err: 0.0000

1,52024,495
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 495
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: 102
atom chem shift.comp id: ARG
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30189
atom chem shift.seq id: 105
atom chem shift.val: 59.0029
atom chem shift.val err: 0.0000

1,52024,496
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 496
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: 102
atom chem shift.comp id: ARG
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30186
atom chem shift.seq id: 105
atom chem shift.val: 29.8941
atom chem shift.val err: 0.0000

1,52024,497
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 497
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: 102
atom chem shift.comp id: ARG
atom chem shift.comp index id: 105
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27166
atom chem shift.seq id: 105
atom chem shift.val: 118.3431
atom chem shift.val err: 0.0000

1,52024,498
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 498
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: 103
atom chem shift.comp id: VAL
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30089
atom chem shift.seq id: 106
atom chem shift.val: 8.3454
atom chem shift.val err: 0.0000

1,52024,499
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 499
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: 103
atom chem shift.comp id: VAL
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31017
atom chem shift.seq id: 106
atom chem shift.val: 178.2105
atom chem shift.val err: 0.0000

1,52024,500
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 500
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: 103
atom chem shift.comp id: VAL
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25968
atom chem shift.seq id: 106
atom chem shift.val: 65.8239
atom chem shift.val err: 0.0000

1,52024,501
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 501
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: 103
atom chem shift.comp id: VAL
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 31.9810
atom chem shift.val err: 0.0000

1,52024,502
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 502
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: 103
atom chem shift.comp id: VAL
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30091
atom chem shift.seq id: 106
atom chem shift.val: 119.3927
atom chem shift.val err: 0.0000

1,52024,503
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 503
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: 104
atom chem shift.comp id: LYS
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30374
atom chem shift.seq id: 107
atom chem shift.val: 8.1428
atom chem shift.val err: 0.0000

1,52024,504
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 504
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 104
atom chem shift.comp id: LYS
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 175.8378
atom chem shift.val err: 0.0000

1,52024,505
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 505
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: 104
atom chem shift.comp id: LYS
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28539
atom chem shift.seq id: 107
atom chem shift.val: 55.7176
atom chem shift.val err: 0.0000

1,52024,506
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 506
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: 104
atom chem shift.comp id: LYS
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30372
atom chem shift.seq id: 107
atom chem shift.val: 31.3813
atom chem shift.val err: 0.0000

1,52024,507
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 507
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 104
atom chem shift.comp id: LYS
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30376
atom chem shift.seq id: 107
atom chem shift.val: 115.9484
atom chem shift.val err: 0.0000

1,52024,508
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 508
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: 105
atom chem shift.comp id: ASP
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173420
atom chem shift.seq id: 108
atom chem shift.val: 7.8872
atom chem shift.val err: 0.0000

1,52024,509
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 509
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: 105
atom chem shift.comp id: ASP
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 174.4820
atom chem shift.val err: 0.0000

1,52024,510
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 510
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: 105
atom chem shift.comp id: ASP
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173439
atom chem shift.seq id: 108
atom chem shift.val: 54.4419
atom chem shift.val err: 0.0000

1,52024,511
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 511
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: 105
atom chem shift.comp id: ASP
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173436
atom chem shift.seq id: 108
atom chem shift.val: 39.7030
atom chem shift.val err: 0.0000

1,52024,512
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ASP
atom chem shift.auth seq id: 105
atom chem shift.comp id: ASP
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 173422
atom chem shift.seq id: 108
atom chem shift.val: 120.8286
atom chem shift.val err: 0.0000

1,52024,513
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: SER
atom chem shift.auth seq id: 106
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30725
atom chem shift.seq id: 109
atom chem shift.val: 7.5594
atom chem shift.val err: 0.0000

1,52024,514
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 514
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: 106
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 173.2668
atom chem shift.val err: 0.0000

1,52024,515
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 515
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: 106
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30720
atom chem shift.seq id: 109
atom chem shift.val: 56.9433
atom chem shift.val err: 0.0000

1,52024,516
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 516
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: 106
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30723
atom chem shift.seq id: 109
atom chem shift.val: 65.1582
atom chem shift.val err: 0.0000

1,52024,517
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 517
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: 106
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30727
atom chem shift.seq id: 109
atom chem shift.val: 109.1264
atom chem shift.val err: 0.0000

1,52024,518
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 518
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: 107
atom chem shift.comp id: GLU
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31569
atom chem shift.seq id: 110
atom chem shift.val: 8.4407
atom chem shift.val err: 0.0000

1,52024,519
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 519
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 107
atom chem shift.comp id: GLU
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 110
atom chem shift.val: 176.1086
atom chem shift.val err: 0.0000

1,52024,520
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 520
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 107
atom chem shift.comp id: GLU
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29805
atom chem shift.seq id: 110
atom chem shift.val: 56.3388
atom chem shift.val err: 0.0000

1,52024,521
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 521
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 107
atom chem shift.comp id: GLU
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29802
atom chem shift.seq id: 110
atom chem shift.val: 30.4490
atom chem shift.val err: 0.0000

1,52024,522
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 522
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 107
atom chem shift.comp id: GLU
atom chem shift.comp index id: 110
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31570
atom chem shift.seq id: 110
atom chem shift.val: 121.2169
atom chem shift.val err: 0.0000

1,52024,523
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 523
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: 108
atom chem shift.comp id: ASP
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26981
atom chem shift.seq id: 111
atom chem shift.val: 8.4212
atom chem shift.val err: 0.0000

1,52024,524
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 524
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: 108
atom chem shift.comp id: ASP
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 111
atom chem shift.val: 174.0782
atom chem shift.val err: 0.0000

1,52024,525
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 525
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: 108
atom chem shift.comp id: ASP
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28719
atom chem shift.seq id: 111
atom chem shift.val: 52.9718
atom chem shift.val err: 0.0000

1,52024,526
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 526
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: 108
atom chem shift.comp id: ASP
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29826
atom chem shift.seq id: 111
atom chem shift.val: 41.1422
atom chem shift.val err: 0.0000

1,52024,527
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 527
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: 108
atom chem shift.comp id: ASP
atom chem shift.comp index id: 111
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26983
atom chem shift.seq id: 111
atom chem shift.val: 120.9145
atom chem shift.val err: 0.0000

1,52024,528
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 528
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: 109
atom chem shift.comp id: VAL
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25997
atom chem shift.seq id: 112
atom chem shift.val: 7.6264
atom chem shift.val err: 0.0000

1,52024,529
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 529
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: 109
atom chem shift.comp id: VAL
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 112
atom chem shift.val: 173.9281
atom chem shift.val err: 0.0000

1,52024,530
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 530
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: 109
atom chem shift.comp id: VAL
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29703
atom chem shift.seq id: 112
atom chem shift.val: 58.9248
atom chem shift.val err: 0.0000

1,52024,531
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 531
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: 109
atom chem shift.comp id: VAL
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29709
atom chem shift.seq id: 112
atom chem shift.val: 35.0337
atom chem shift.val err: 0.0000

1,52024,532
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 532
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: 109
atom chem shift.comp id: VAL
atom chem shift.comp index id: 112
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25999
atom chem shift.seq id: 112
atom chem shift.val: 122.1113
atom chem shift.val err: 0.0000

1,52024,533
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 533
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: 110
atom chem shift.comp id: PRO
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31167
atom chem shift.seq id: 113
atom chem shift.val: 176.0179
atom chem shift.val err: 0.0000

1,52024,534
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 534
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: 110
atom chem shift.comp id: PRO
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26703
atom chem shift.seq id: 113
atom chem shift.val: 63.6855
atom chem shift.val err: 0.0000

1,52024,535
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 535
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: 110
atom chem shift.comp id: PRO
atom chem shift.comp index id: 113
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27708
atom chem shift.seq id: 113
atom chem shift.val: 32.0694
atom chem shift.val err: 0.0000

1,52024,536
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 536
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 111
atom chem shift.comp id: MET
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31519
atom chem shift.seq id: 114
atom chem shift.val: 8.3227
atom chem shift.val err: 0.0000

1,52024,537
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 537
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 111
atom chem shift.comp id: MET
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 114
atom chem shift.val: 173.6200
atom chem shift.val err: 0.0000

1,52024,538
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 538
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 111
atom chem shift.comp id: MET
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29559
atom chem shift.seq id: 114
atom chem shift.val: 55.1983
atom chem shift.val err: 0.0000

1,52024,539
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 539
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 111
atom chem shift.comp id: MET
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29562
atom chem shift.seq id: 114
atom chem shift.val: 37.9971
atom chem shift.val err: 0.0000

1,52024,540
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 540
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: MET
atom chem shift.auth seq id: 111
atom chem shift.comp id: MET
atom chem shift.comp index id: 114
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31520
atom chem shift.seq id: 114
atom chem shift.val: 123.2384
atom chem shift.val err: 0.0000

1,52024,541
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 541
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: 112
atom chem shift.comp id: VAL
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30182
atom chem shift.seq id: 115
atom chem shift.val: 8.0688
atom chem shift.val err: 0.0000

1,52024,542
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 542
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: 112
atom chem shift.comp id: VAL
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 115
atom chem shift.val: 173.2018
atom chem shift.val err: 0.0000

1,52024,543
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 543
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: 112
atom chem shift.comp id: VAL
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28215
atom chem shift.seq id: 115
atom chem shift.val: 61.0906
atom chem shift.val err: 0.0000

1,52024,544
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 544
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: 112
atom chem shift.comp id: VAL
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 79953
atom chem shift.seq id: 115
atom chem shift.val: 37.3925
atom chem shift.val err: 0.0000

1,52024,545
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 545
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: 112
atom chem shift.comp id: VAL
atom chem shift.comp index id: 115
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30184
atom chem shift.seq id: 115
atom chem shift.val: 118.3634
atom chem shift.val err: 0.0000

1,52024,546
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 546
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: 113
atom chem shift.comp id: LEU
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26087
atom chem shift.seq id: 116
atom chem shift.val: 8.9572
atom chem shift.val err: 0.0000

1,52024,547
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 547
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 113
atom chem shift.comp id: LEU
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31338
atom chem shift.seq id: 116
atom chem shift.val: 173.5640
atom chem shift.val err: 0.0000

1,52024,548
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 548
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 113
atom chem shift.comp id: LEU
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27102
atom chem shift.seq id: 116
atom chem shift.val: 53.8239
atom chem shift.val err: 0.0000

1,52024,549
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 549
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 113
atom chem shift.comp id: LEU
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27312
atom chem shift.seq id: 116
atom chem shift.val: 43.9583
atom chem shift.val err: 0.0000

1,52024,550
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 550
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 113
atom chem shift.comp id: LEU
atom chem shift.comp index id: 116
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26089
atom chem shift.seq id: 116
atom chem shift.val: 128.9880
atom chem shift.val err: 0.0000

1,52024,551
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 551
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27311
atom chem shift.seq id: 117
atom chem shift.val: 9.2180
atom chem shift.val err: 0.0000

1,52024,552
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 552
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: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 117
atom chem shift.val: 173.7940
atom chem shift.val err: 0.0000

1,52024,553
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 553
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: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28242
atom chem shift.seq id: 117
atom chem shift.val: 60.1996
atom chem shift.val err: 0.0000

1,52024,554
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 554
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: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29100
atom chem shift.seq id: 117
atom chem shift.val: 35.0323
atom chem shift.val err: 0.0000

1,52024,555
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 555
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: VAL
atom chem shift.auth seq id: 114
atom chem shift.comp id: VAL
atom chem shift.comp index id: 117
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27313
atom chem shift.seq id: 117
atom chem shift.val: 128.1987
atom chem shift.val err: 0.0000

1,52024,556
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 556
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 115
atom chem shift.comp id: GLY
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27629
atom chem shift.seq id: 118
atom chem shift.val: 8.1883
atom chem shift.val err: 0.0000

1,52024,557
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 115
atom chem shift.comp id: GLY
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 118
atom chem shift.val: 170.9200
atom chem shift.val err: 0.0000

1,52024,558
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 558
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: 115
atom chem shift.comp id: GLY
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30498
atom chem shift.seq id: 118
atom chem shift.val: 45.7093
atom chem shift.val err: 0.0000

1,52024,559
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 559
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: 115
atom chem shift.comp id: GLY
atom chem shift.comp index id: 118
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27631
atom chem shift.seq id: 118
atom chem shift.val: 113.3423
atom chem shift.val err: 0.0000

1,52024,560
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 560
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: 116
atom chem shift.comp id: ASN
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67284
atom chem shift.seq id: 119
atom chem shift.val: 8.7686
atom chem shift.val err: 0.0000

1,52024,561
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 561
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: 116
atom chem shift.comp id: ASN
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 119
atom chem shift.val: 174.5278
atom chem shift.val err: 0.0000

1,52024,562
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 562
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
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: 116
atom chem shift.comp id: ASN
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67302
atom chem shift.seq id: 119
atom chem shift.val: 51.5719
atom chem shift.val err: 0.0000

1,52024,563
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 563
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ASN
atom chem shift.auth seq id: 116
atom chem shift.comp id: ASN
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67305
atom chem shift.seq id: 119
atom chem shift.val: 41.3336
atom chem shift.val err: 0.0000

1,52024,564
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 564
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: 116
atom chem shift.comp id: ASN
atom chem shift.comp index id: 119
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67285
atom chem shift.seq id: 119
atom chem shift.val: 121.4436
atom chem shift.val err: 0.0000

1,52024,565
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 565
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: 117
atom chem shift.comp id: LYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 147797
atom chem shift.seq id: 120
atom chem shift.val: 7.2648
atom chem shift.val err: 0.0000

1,52024,566
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 566
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: 117
atom chem shift.comp id: LYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 120
atom chem shift.val: 177.3374
atom chem shift.val err: 0.0000

1,52024,567
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 567
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: 117
atom chem shift.comp id: LYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 147819
atom chem shift.seq id: 120
atom chem shift.val: 57.3897
atom chem shift.val err: 0.0000

1,52024,568
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 568
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: 117
atom chem shift.comp id: LYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 147813
atom chem shift.seq id: 120
atom chem shift.val: 29.6189
atom chem shift.val err: 0.0000

1,52024,569
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 569
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: 117
atom chem shift.comp id: LYS
atom chem shift.comp index id: 120
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 147799
atom chem shift.seq id: 120
atom chem shift.val: 111.7750
atom chem shift.val err: 0.0000

1,52024,570
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 570
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: 118
atom chem shift.comp id: CYS
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26237
atom chem shift.seq id: 121
atom chem shift.val: 8.5755
atom chem shift.val err: 0.0000

1,52024,571
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 571
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: 118
atom chem shift.comp id: CYS
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 121
atom chem shift.val: 173.2914
atom chem shift.val err: 0.0000

1,52024,572
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 572
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: 118
atom chem shift.comp id: CYS
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30456
atom chem shift.seq id: 121
atom chem shift.val: 61.3468
atom chem shift.val err: 0.0000

1,52024,573
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 573
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: 118
atom chem shift.comp id: CYS
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30453
atom chem shift.seq id: 121
atom chem shift.val: 26.4011
atom chem shift.val err: 0.0000

1,52024,574
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 574
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: 118
atom chem shift.comp id: CYS
atom chem shift.comp index id: 121
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26239
atom chem shift.seq id: 121
atom chem shift.val: 113.7986
atom chem shift.val err: 0.0000

1,52024,575
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 575
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: 119
atom chem shift.comp id: ASP
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27884
atom chem shift.seq id: 122
atom chem shift.val: 8.5360
atom chem shift.val err: 0.0000

1,52024,576
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 576
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: 119
atom chem shift.comp id: ASP
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 122
atom chem shift.val: 175.5408
atom chem shift.val err: 0.0000

1,52024,577
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 577
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: 119
atom chem shift.comp id: ASP
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30321
atom chem shift.seq id: 122
atom chem shift.val: 53.9391
atom chem shift.val err: 0.0000

1,52024,578
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 578
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: 119
atom chem shift.comp id: ASP
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30324
atom chem shift.seq id: 122
atom chem shift.val: 41.4074
atom chem shift.val err: 0.0000

1,52024,579
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ASP
atom chem shift.auth seq id: 119
atom chem shift.comp id: ASP
atom chem shift.comp index id: 122
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27886
atom chem shift.seq id: 122
atom chem shift.val: 116.5223
atom chem shift.val err: 0.0000

1,52024,580
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: LEU
atom chem shift.auth seq id: 120
atom chem shift.comp id: LEU
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27098
atom chem shift.seq id: 123
atom chem shift.val: 7.7752
atom chem shift.val err: 0.0000

1,52024,581
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 581
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 120
atom chem shift.comp id: LEU
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 123
atom chem shift.val: 176.1555
atom chem shift.val err: 0.0000

1,52024,582
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 582
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 120
atom chem shift.comp id: LEU
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28716
atom chem shift.seq id: 123
atom chem shift.val: 53.0340
atom chem shift.val err: 0.0000

1,52024,583
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 583
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 120
atom chem shift.comp id: LEU
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29766
atom chem shift.seq id: 123
atom chem shift.val: 41.4648
atom chem shift.val err: 0.0000

1,52024,584
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 584
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 120
atom chem shift.comp id: LEU
atom chem shift.comp index id: 123
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27100
atom chem shift.seq id: 123
atom chem shift.val: 121.4601
atom chem shift.val err: 0.0000

1,52024,585
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 585
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: 121
atom chem shift.comp id: PRO
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31107
atom chem shift.seq id: 124
atom chem shift.val: 176.9159
atom chem shift.val err: 0.0000

1,52024,586
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 586
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 121
atom chem shift.comp id: PRO
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26721
atom chem shift.seq id: 124
atom chem shift.val: 63.2319
atom chem shift.val err: 0.0000

1,52024,587
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 587
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: PRO
atom chem shift.auth seq id: 121
atom chem shift.comp id: PRO
atom chem shift.comp index id: 124
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30558
atom chem shift.seq id: 124
atom chem shift.val: 31.7108
atom chem shift.val err: 0.0000

1,52024,588
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 588
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: 122
atom chem shift.comp id: SER
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30560
atom chem shift.seq id: 125
atom chem shift.val: 7.3236
atom chem shift.val err: 0.0000

1,52024,589
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 589
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: 122
atom chem shift.comp id: SER
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 125
atom chem shift.val: 172.7118
atom chem shift.val err: 0.0000

1,52024,590
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 590
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: 122
atom chem shift.comp id: SER
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30555
atom chem shift.seq id: 125
atom chem shift.val: 56.4484
atom chem shift.val err: 0.0000

1,52024,591
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 591
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: 122
atom chem shift.comp id: SER
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30552
atom chem shift.seq id: 125
atom chem shift.val: 62.3375
atom chem shift.val err: 0.0000

1,52024,592
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 592
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: 122
atom chem shift.comp id: SER
atom chem shift.comp index id: 125
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30562
atom chem shift.seq id: 125
atom chem shift.val: 113.0694
atom chem shift.val err: 0.0000

1,52024,593
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 593
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: 123
atom chem shift.comp id: ARG
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26732
atom chem shift.seq id: 126
atom chem shift.val: 7.8431
atom chem shift.val err: 0.0000

1,52024,594
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 594
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: 123
atom chem shift.comp id: ARG
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 126
atom chem shift.val: 176.0892
atom chem shift.val err: 0.0000

1,52024,595
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 595
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: 123
atom chem shift.comp id: ARG
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28524
atom chem shift.seq id: 126
atom chem shift.val: 56.0811
atom chem shift.val err: 0.0000

1,52024,596
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 596
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: 123
atom chem shift.comp id: ARG
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30000
atom chem shift.seq id: 126
atom chem shift.val: 32.3847
atom chem shift.val err: 0.0000

1,52024,597
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 597
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: 123
atom chem shift.comp id: ARG
atom chem shift.comp index id: 126
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26734
atom chem shift.seq id: 126
atom chem shift.val: 120.1510
atom chem shift.val err: 0.0000

1,52024,598
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 598
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: 124
atom chem shift.comp id: THR
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27692
atom chem shift.seq id: 127
atom chem shift.val: 9.1102
atom chem shift.val err: 0.0000

1,52024,599
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 599
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: 124
atom chem shift.comp id: THR
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 127
atom chem shift.val: 174.3761
atom chem shift.val err: 0.0000

1,52024,600
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 600
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: 124
atom chem shift.comp id: THR
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30417
atom chem shift.seq id: 127
atom chem shift.val: 61.7478
atom chem shift.val err: 0.0000

1,52024,601
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 601
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: 124
atom chem shift.comp id: THR
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 88561
atom chem shift.seq id: 127
atom chem shift.val: 69.1490
atom chem shift.val err: 0.0000

1,52024,602
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 602
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: 124
atom chem shift.comp id: THR
atom chem shift.comp index id: 127
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27694
atom chem shift.seq id: 127
atom chem shift.val: 114.6311
atom chem shift.val err: 0.0000

1,52024,603
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 603
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: 125
atom chem shift.comp id: VAL
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26744
atom chem shift.seq id: 128
atom chem shift.val: 7.5518
atom chem shift.val err: 0.0000

1,52024,604
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 604
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: 125
atom chem shift.comp id: VAL
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31257
atom chem shift.seq id: 128
atom chem shift.val: 175.1283
atom chem shift.val err: 0.0000

1,52024,605
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 605
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: 125
atom chem shift.comp id: VAL
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28194
atom chem shift.seq id: 128
atom chem shift.val: 61.3461
atom chem shift.val err: 0.0000

1,52024,606
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 606
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: 125
atom chem shift.comp id: VAL
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29481
atom chem shift.seq id: 128
atom chem shift.val: 33.1287
atom chem shift.val err: 0.0000

1,52024,607
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 607
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: 125
atom chem shift.comp id: VAL
atom chem shift.comp index id: 128
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26746
atom chem shift.seq id: 128
atom chem shift.val: 124.2595
atom chem shift.val err: 0.0000

1,52024,608
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 608
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: 126
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29084
atom chem shift.seq id: 129
atom chem shift.val: 8.6294
atom chem shift.val err: 0.0000

1,52024,609
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 609
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: 126
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 129
atom chem shift.val: 176.4866
atom chem shift.val err: 0.0000

1,52024,610
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 610
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: 126
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29079
atom chem shift.seq id: 129
atom chem shift.val: 54.1740
atom chem shift.val err: 0.0000

1,52024,611
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 611
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: 126
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29082
atom chem shift.seq id: 129
atom chem shift.val: 42.0145
atom chem shift.val err: 0.0000

1,52024,612
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: ASP
atom chem shift.auth seq id: 126
atom chem shift.comp id: ASP
atom chem shift.comp index id: 129
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29086
atom chem shift.seq id: 129
atom chem shift.val: 128.4108
atom chem shift.val err: 0.0000

1,52024,613
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
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: THR
atom chem shift.auth seq id: 127
atom chem shift.comp id: THR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67252
atom chem shift.seq id: 130
atom chem shift.val: 8.7524
atom chem shift.val err: 0.0000

1,52024,614
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 614
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: 127
atom chem shift.comp id: THR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 130
atom chem shift.val: 175.6355
atom chem shift.val err: 0.0000

1,52024,615
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 615
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: 127
atom chem shift.comp id: THR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67265
atom chem shift.seq id: 130
atom chem shift.val: 67.3374
atom chem shift.val err: 0.0000

1,52024,616
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 616
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: 127
atom chem shift.comp id: THR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67268
atom chem shift.seq id: 130
atom chem shift.val: 69.1117
atom chem shift.val err: 0.0000

1,52024,617
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 617
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: 127
atom chem shift.comp id: THR
atom chem shift.comp index id: 130
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 67254
atom chem shift.seq id: 130
atom chem shift.val: 121.4302
atom chem shift.val err: 0.0000

1,52024,618
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 618
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: 128
atom chem shift.comp id: LYS
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26633
atom chem shift.seq id: 131
atom chem shift.val: 8.3951
atom chem shift.val err: 0.0000

1,52024,619
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 619
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: 128
atom chem shift.comp id: LYS
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 131
atom chem shift.val: 178.1686
atom chem shift.val err: 0.0000

1,52024,620
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 620
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: 128
atom chem shift.comp id: LYS
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28287
atom chem shift.seq id: 131
atom chem shift.val: 59.3950
atom chem shift.val err: 0.0000

1,52024,621
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 621
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: 128
atom chem shift.comp id: LYS
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29907
atom chem shift.seq id: 131
atom chem shift.val: 31.9743
atom chem shift.val err: 0.0000

1,52024,622
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 622
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: 128
atom chem shift.comp id: LYS
atom chem shift.comp index id: 131
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26635
atom chem shift.seq id: 131
atom chem shift.val: 120.3193
atom chem shift.val err: 0.0000

1,52024,623
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 623
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: 129
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27713
atom chem shift.seq id: 132
atom chem shift.val: 7.3178
atom chem shift.val err: 0.0000

1,52024,624
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 624
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: 129
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 132
atom chem shift.val: 179.3395
atom chem shift.val err: 0.0000

1,52024,625
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 625
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: 129
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28359
atom chem shift.seq id: 132
atom chem shift.val: 58.6026
atom chem shift.val err: 0.0000

1,52024,626
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 626
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: 129
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30267
atom chem shift.seq id: 132
atom chem shift.val: 28.7305
atom chem shift.val err: 0.0000

1,52024,627
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 627
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 129
atom chem shift.comp id: GLN
atom chem shift.comp index id: 132
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27715
atom chem shift.seq id: 132
atom chem shift.val: 117.4304
atom chem shift.val err: 0.0000

1,52024,628
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 628
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 130
atom chem shift.comp id: ALA
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29627
atom chem shift.seq id: 133
atom chem shift.val: 7.0659
atom chem shift.val err: 0.0000

1,52024,629
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 629
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 130
atom chem shift.comp id: ALA
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 133
atom chem shift.val: 177.9301
atom chem shift.val err: 0.0000

1,52024,630
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 630
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 130
atom chem shift.comp id: ALA
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29625
atom chem shift.seq id: 133
atom chem shift.val: 54.8826
atom chem shift.val err: 0.0000

1,52024,631
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 631
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 130
atom chem shift.comp id: ALA
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29631
atom chem shift.seq id: 133
atom chem shift.val: 18.8736
atom chem shift.val err: 0.0000

1,52024,632
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 632
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 130
atom chem shift.comp id: ALA
atom chem shift.comp index id: 133
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29629
atom chem shift.seq id: 133
atom chem shift.val: 122.4696
atom chem shift.val err: 0.0000

1,52024,633
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 633
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27038
atom chem shift.seq id: 134
atom chem shift.val: 8.4319
atom chem shift.val err: 0.0000

1,52024,634
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 634
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: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 134
atom chem shift.val: 179.5553
atom chem shift.val err: 0.0000

1,52024,635
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 635
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: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28332
atom chem shift.seq id: 134
atom chem shift.val: 58.9422
atom chem shift.val err: 0.0000

1,52024,636
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 636
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: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30219
atom chem shift.seq id: 134
atom chem shift.val: 28.5250
atom chem shift.val err: 0.0000

1,52024,637
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 637
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLN
atom chem shift.auth seq id: 131
atom chem shift.comp id: GLN
atom chem shift.comp index id: 134
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27040
atom chem shift.seq id: 134
atom chem shift.val: 117.9462
atom chem shift.val err: 0.0000

1,52024,638
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 638
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: 132
atom chem shift.comp id: ASP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26165
atom chem shift.seq id: 135
atom chem shift.val: 8.5537
atom chem shift.val err: 0.0000

1,52024,639
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 639
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: 132
atom chem shift.comp id: ASP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 135
atom chem shift.val: 178.8876
atom chem shift.val err: 0.0000

1,52024,640
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 640
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: 132
atom chem shift.comp id: ASP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28449
atom chem shift.seq id: 135
atom chem shift.val: 57.1385
atom chem shift.val err: 0.0000

1,52024,641
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 641
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: 132
atom chem shift.comp id: ASP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29895
atom chem shift.seq id: 135
atom chem shift.val: 39.5901
atom chem shift.val err: 0.0000

1,52024,642
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 642
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: 132
atom chem shift.comp id: ASP
atom chem shift.comp index id: 135
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26167
atom chem shift.seq id: 135
atom chem shift.val: 120.3946
atom chem shift.val err: 0.0000

1,52024,643
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 643
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: 133
atom chem shift.comp id: LEU
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26246
atom chem shift.seq id: 136
atom chem shift.val: 7.5011
atom chem shift.val err: 0.0000

1,52024,644
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 644
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 133
atom chem shift.comp id: LEU
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 136
atom chem shift.val: 178.9472
atom chem shift.val err: 0.0000

1,52024,645
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 645
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 133
atom chem shift.comp id: LEU
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29541
atom chem shift.seq id: 136
atom chem shift.val: 57.7390
atom chem shift.val err: 0.0000

1,52024,646
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 646
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 133
atom chem shift.comp id: LEU
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29544
atom chem shift.seq id: 136
atom chem shift.val: 41.6084
atom chem shift.val err: 0.0000

1,52024,647
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 647
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 133
atom chem shift.comp id: LEU
atom chem shift.comp index id: 136
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26248
atom chem shift.seq id: 136
atom chem shift.val: 123.6348
atom chem shift.val err: 0.0000

1,52024,648
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 648
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 134
atom chem shift.comp id: ALA
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27941
atom chem shift.seq id: 137
atom chem shift.val: 8.2321
atom chem shift.val err: 0.0000

1,52024,649
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 649
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 134
atom chem shift.comp id: ALA
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 137
atom chem shift.val: 179.7577
atom chem shift.val err: 0.0000

1,52024,650
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 650
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 134
atom chem shift.comp id: ALA
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29757
atom chem shift.seq id: 137
atom chem shift.val: 55.8354
atom chem shift.val err: 0.0000

1,52024,651
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 651
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 134
atom chem shift.comp id: ALA
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29760
atom chem shift.seq id: 137
atom chem shift.val: 18.2664
atom chem shift.val err: 0.0000

1,52024,652
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 652
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 134
atom chem shift.comp id: ALA
atom chem shift.comp index id: 137
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27943
atom chem shift.seq id: 137
atom chem shift.val: 121.4499
atom chem shift.val err: 0.0000

1,52024,653
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 653
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: 135
atom chem shift.comp id: ARG
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31657
atom chem shift.seq id: 138
atom chem shift.val: 8.4156
atom chem shift.val err: 0.0000

1,52024,654
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 654
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: 135
atom chem shift.comp id: ARG
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 138
atom chem shift.val: 179.9978
atom chem shift.val err: 0.0000

1,52024,655
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 655
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: 135
atom chem shift.comp id: ARG
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28290
atom chem shift.seq id: 138
atom chem shift.val: 59.3748
atom chem shift.val err: 0.0000

1,52024,656
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 656
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: 135
atom chem shift.comp id: ARG
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30201
atom chem shift.seq id: 138
atom chem shift.val: 29.6880
atom chem shift.val err: 0.0000

1,52024,657
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 657
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: 135
atom chem shift.comp id: ARG
atom chem shift.comp index id: 138
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31658
atom chem shift.seq id: 138
atom chem shift.val: 118.1958
atom chem shift.val err: 0.0000

1,52024,658
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 658
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: 136
atom chem shift.comp id: SER
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26207
atom chem shift.seq id: 139
atom chem shift.val: 7.9260
atom chem shift.val err: 0.0000

1,52024,659
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 659
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: 136
atom chem shift.comp id: SER
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 139
atom chem shift.val: 176.1567
atom chem shift.val err: 0.0000

1,52024,660
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 660
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: 136
atom chem shift.comp id: SER
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30231
atom chem shift.seq id: 139
atom chem shift.val: 61.5133
atom chem shift.val err: 0.0000

1,52024,661
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 661
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: 136
atom chem shift.comp id: SER
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30228
atom chem shift.seq id: 139
atom chem shift.val: 62.4913
atom chem shift.val err: 0.0000

1,52024,662
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 662
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: 136
atom chem shift.comp id: SER
atom chem shift.comp index id: 139
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26209
atom chem shift.seq id: 139
atom chem shift.val: 117.7422
atom chem shift.val err: 0.0000

1,52024,663
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 663
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 137
atom chem shift.comp id: TYR
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30038
atom chem shift.seq id: 140
atom chem shift.val: 7.6345
atom chem shift.val err: 0.0000

1,52024,664
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 664
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 137
atom chem shift.comp id: TYR
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 140
atom chem shift.val: 176.2010
atom chem shift.val err: 0.0000

1,52024,665
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 665
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 137
atom chem shift.comp id: TYR
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28617
atom chem shift.seq id: 140
atom chem shift.val: 54.6072
atom chem shift.val err: 0.0000

1,52024,666
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 666
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 137
atom chem shift.comp id: TYR
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30024
atom chem shift.seq id: 140
atom chem shift.val: 38.6268
atom chem shift.val err: 0.0000

1,52024,667
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 667
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: 137
atom chem shift.comp id: TYR
atom chem shift.comp index id: 140
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30040
atom chem shift.seq id: 140
atom chem shift.val: 119.9847
atom chem shift.val err: 0.0000

1,52024,668
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 668
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 138
atom chem shift.comp id: GLY
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30686
atom chem shift.seq id: 141
atom chem shift.val: 8.2654
atom chem shift.val err: 0.0000

1,52024,669
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 669
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: 138
atom chem shift.comp id: GLY
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 141
atom chem shift.val: 175.2013
atom chem shift.val err: 0.0000

1,52024,670
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 670
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: 138
atom chem shift.comp id: GLY
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28785
atom chem shift.seq id: 141
atom chem shift.val: 46.3791
atom chem shift.val err: 0.0000

1,52024,671
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 671
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: 138
atom chem shift.comp id: GLY
atom chem shift.comp index id: 141
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30688
atom chem shift.seq id: 141
atom chem shift.val: 110.7383
atom chem shift.val err: 0.0000

1,52024,672
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 672
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: 139
atom chem shift.comp id: ILE
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26564
atom chem shift.seq id: 142
atom chem shift.val: 8.0090
atom chem shift.val err: 0.0000

1,52024,673
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 673
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: 139
atom chem shift.comp id: ILE
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 142
atom chem shift.val: 172.8541
atom chem shift.val err: 0.0000

1,52024,674
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 674
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: 139
atom chem shift.comp id: ILE
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28365
atom chem shift.seq id: 142
atom chem shift.val: 58.5339
atom chem shift.val err: 0.0000

1,52024,675
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 675
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: 139
atom chem shift.comp id: ILE
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30591
atom chem shift.seq id: 142
atom chem shift.val: 38.3461
atom chem shift.val err: 0.0000

1,52024,676
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 676
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: 139
atom chem shift.comp id: ILE
atom chem shift.comp index id: 142
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26566
atom chem shift.seq id: 142
atom chem shift.val: 112.7525
atom chem shift.val err: 0.0000

1,52024,677
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 677
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: 140
atom chem shift.comp id: PRO
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31293
atom chem shift.seq id: 143
atom chem shift.val: 174.5166
atom chem shift.val err: 0.0000

1,52024,678
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 678
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: 140
atom chem shift.comp id: PRO
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26736
atom chem shift.seq id: 143
atom chem shift.val: 62.3002
atom chem shift.val err: 0.0000

1,52024,679
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 679
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: 140
atom chem shift.comp id: PRO
atom chem shift.comp index id: 143
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27678
atom chem shift.seq id: 143
atom chem shift.val: 33.0837
atom chem shift.val err: 0.0000

1,52024,680
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 680
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 141
atom chem shift.comp id: PHE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27938
atom chem shift.seq id: 144
atom chem shift.val: 8.3183
atom chem shift.val err: 0.0000

1,52024,681
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 681
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: PHE
atom chem shift.auth seq id: 141
atom chem shift.comp id: PHE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 144
atom chem shift.val: 173.7805
atom chem shift.val err: 0.0000

1,52024,682
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 682
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: PHE
atom chem shift.auth seq id: 141
atom chem shift.comp id: PHE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29979
atom chem shift.seq id: 144
atom chem shift.val: 54.7244
atom chem shift.val err: 0.0000

1,52024,683
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 683
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: PHE
atom chem shift.auth seq id: 141
atom chem shift.comp id: PHE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29982
atom chem shift.seq id: 144
atom chem shift.val: 42.3039
atom chem shift.val err: 0.0000

1,52024,684
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 684
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 141
atom chem shift.comp id: PHE
atom chem shift.comp index id: 144
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27940
atom chem shift.seq id: 144
atom chem shift.val: 120.1685
atom chem shift.val err: 0.0000

1,52024,685
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 685
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: 142
atom chem shift.comp id: ILE
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28982
atom chem shift.seq id: 145
atom chem shift.val: 8.3670
atom chem shift.val err: 0.0000

1,52024,686
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 686
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: 142
atom chem shift.comp id: ILE
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 145
atom chem shift.val: 172.6524
atom chem shift.val err: 0.0000

1,52024,687
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 687
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: 142
atom chem shift.comp id: ILE
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28299
atom chem shift.seq id: 145
atom chem shift.val: 59.1871
atom chem shift.val err: 0.0000

1,52024,688
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 688
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: 142
atom chem shift.comp id: ILE
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28980
atom chem shift.seq id: 145
atom chem shift.val: 42.3459
atom chem shift.val err: 0.0000

1,52024,689
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 689
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: 142
atom chem shift.comp id: ILE
atom chem shift.comp index id: 145
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28984
atom chem shift.seq id: 145
atom chem shift.val: 129.8622
atom chem shift.val err: 0.0000

1,52024,690
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 690
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: 143
atom chem shift.comp id: GLU
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27338
atom chem shift.seq id: 146
atom chem shift.val: 7.8165
atom chem shift.val err: 0.0000

1,52024,691
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 691
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 143
atom chem shift.comp id: GLU
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31134
atom chem shift.seq id: 146
atom chem shift.val: 176.2116
atom chem shift.val err: 0.0000

1,52024,692
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 692
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 143
atom chem shift.comp id: GLU
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27018
atom chem shift.seq id: 146
atom chem shift.val: 55.3634
atom chem shift.val err: 0.0000

1,52024,693
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 693
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 143
atom chem shift.comp id: GLU
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27747
atom chem shift.seq id: 146
atom chem shift.val: 30.7028
atom chem shift.val err: 0.0000

1,52024,694
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 694
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 143
atom chem shift.comp id: GLU
atom chem shift.comp index id: 146
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27340
atom chem shift.seq id: 146
atom chem shift.val: 125.1389
atom chem shift.val err: 0.0000

1,52024,695
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 695
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: 144
atom chem shift.comp id: THR
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27746
atom chem shift.seq id: 147
atom chem shift.val: 8.7718
atom chem shift.val err: 0.0000

1,52024,696
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 696
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: 144
atom chem shift.comp id: THR
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 147
atom chem shift.val: 176.1371
atom chem shift.val err: 0.0000

1,52024,697
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 697
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: 144
atom chem shift.comp id: THR
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28260
atom chem shift.seq id: 147
atom chem shift.val: 59.6531
atom chem shift.val err: 0.0000

1,52024,698
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 698
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: 144
atom chem shift.comp id: THR
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30636
atom chem shift.seq id: 147
atom chem shift.val: 73.8171
atom chem shift.val err: 0.0000

1,52024,699
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 699
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: 144
atom chem shift.comp id: THR
atom chem shift.comp index id: 147
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27748
atom chem shift.seq id: 147
atom chem shift.val: 112.4913
atom chem shift.val err: 0.0000

1,52024,700
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 700
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: 145
atom chem shift.comp id: SER
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31769
atom chem shift.seq id: 148
atom chem shift.val: 8.6878
atom chem shift.val err: 0.0000

1,52024,701
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 701
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: 145
atom chem shift.comp id: SER
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 148
atom chem shift.val: 175.6303
atom chem shift.val err: 0.0000

1,52024,702
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 702
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: 145
atom chem shift.comp id: SER
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28419
atom chem shift.seq id: 148
atom chem shift.val: 57.4787
atom chem shift.val err: 0.0000

1,52024,703
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 703
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: 145
atom chem shift.comp id: SER
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30651
atom chem shift.seq id: 148
atom chem shift.val: 64.7272
atom chem shift.val err: 0.0000

1,52024,704
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 704
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: 145
atom chem shift.comp id: SER
atom chem shift.comp index id: 148
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31770
atom chem shift.seq id: 148
atom chem shift.val: 112.1843
atom chem shift.val err: 0.0000

1,52024,705
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 705
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 146
atom chem shift.comp id: ALA
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31441
atom chem shift.seq id: 149
atom chem shift.val: 9.1248
atom chem shift.val err: 0.0000

1,52024,706
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 706
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 146
atom chem shift.comp id: ALA
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 149
atom chem shift.val: 175.5116
atom chem shift.val err: 0.0000

1,52024,707
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 707
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 146
atom chem shift.comp id: ALA
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28635
atom chem shift.seq id: 149
atom chem shift.val: 54.4754
atom chem shift.val err: 0.0000

1,52024,708
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 708
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 146
atom chem shift.comp id: ALA
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28920
atom chem shift.seq id: 149
atom chem shift.val: 18.4958
atom chem shift.val err: 0.0000

1,52024,709
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 709
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 146
atom chem shift.comp id: ALA
atom chem shift.comp index id: 149
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31442
atom chem shift.seq id: 149
atom chem shift.val: 132.1839
atom chem shift.val err: 0.0000

1,52024,710
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 710
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: 147
atom chem shift.comp id: LYS
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30335
atom chem shift.seq id: 150
atom chem shift.val: 6.9466
atom chem shift.val err: 0.0000

1,52024,711
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 711
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: 147
atom chem shift.comp id: LYS
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 150
atom chem shift.val: 176.9463
atom chem shift.val err: 0.0000

1,52024,712
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 712
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: 147
atom chem shift.comp id: LYS
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28377
atom chem shift.seq id: 150
atom chem shift.val: 58.3173
atom chem shift.val err: 0.0000

1,52024,713
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 713
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: 147
atom chem shift.comp id: LYS
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30351
atom chem shift.seq id: 150
atom chem shift.val: 33.6266
atom chem shift.val err: 0.0000

1,52024,714
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 714
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: 147
atom chem shift.comp id: LYS
atom chem shift.comp index id: 150
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30337
atom chem shift.seq id: 150
atom chem shift.val: 116.1813
atom chem shift.val err: 0.0000

1,52024,715
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 715
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: 148
atom chem shift.comp id: THR
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26870
atom chem shift.seq id: 151
atom chem shift.val: 7.5793
atom chem shift.val err: 0.0000

1,52024,716
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 716
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: 148
atom chem shift.comp id: THR
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 151
atom chem shift.val: 175.7527
atom chem shift.val err: 0.0000

1,52024,717
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 717
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: 148
atom chem shift.comp id: THR
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 110823
atom chem shift.seq id: 151
atom chem shift.val: 61.3342
atom chem shift.val err: 0.0000

1,52024,718
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 718
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: 148
atom chem shift.comp id: THR
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 111451
atom chem shift.seq id: 151
atom chem shift.val: 69.4943
atom chem shift.val err: 0.0000

1,52024,719
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 719
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: 148
atom chem shift.comp id: THR
atom chem shift.comp index id: 151
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26872
atom chem shift.seq id: 151
atom chem shift.val: 106.1051
atom chem shift.val err: 0.0000

1,52024,720
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 720
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: 149
atom chem shift.comp id: ARG
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26771
atom chem shift.seq id: 152
atom chem shift.val: 7.7059
atom chem shift.val err: 0.0000

1,52024,721
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 721
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: 149
atom chem shift.comp id: ARG
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 152
atom chem shift.val: 175.6289
atom chem shift.val err: 0.0000

1,52024,722
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 722
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: 149
atom chem shift.comp id: ARG
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 76522
atom chem shift.seq id: 152
atom chem shift.val: 58.7338
atom chem shift.val err: 0.0000

1,52024,723
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 723
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: 149
atom chem shift.comp id: ARG
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 76438
atom chem shift.seq id: 152
atom chem shift.val: 30.5763
atom chem shift.val err: 0.0000

1,52024,724
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 724
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: 149
atom chem shift.comp id: ARG
atom chem shift.comp index id: 152
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26773
atom chem shift.seq id: 152
atom chem shift.val: 119.6700
atom chem shift.val err: 0.0000

1,52024,725
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 725
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: 150
atom chem shift.comp id: GLN
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27755
atom chem shift.seq id: 153
atom chem shift.val: 7.7619
atom chem shift.val err: 0.0000

1,52024,726
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 726
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: 150
atom chem shift.comp id: GLN
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 153
atom chem shift.val: 177.0472
atom chem shift.val err: 0.0000

1,52024,727
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 727
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: 150
atom chem shift.comp id: GLN
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29490
atom chem shift.seq id: 153
atom chem shift.val: 57.2155
atom chem shift.val err: 0.0000

1,52024,728
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 728
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: 150
atom chem shift.comp id: GLN
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29493
atom chem shift.seq id: 153
atom chem shift.val: 28.6190
atom chem shift.val err: 0.0000

1,52024,729
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 729
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: 150
atom chem shift.comp id: GLN
atom chem shift.comp index id: 153
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27757
atom chem shift.seq id: 153
atom chem shift.val: 124.2280
atom chem shift.val err: 0.0000

1,52024,730
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 730
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: GLY
atom chem shift.auth seq id: 151
atom chem shift.comp id: GLY
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26903
atom chem shift.seq id: 154
atom chem shift.val: 8.9590
atom chem shift.val err: 0.0000

1,52024,731
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 731
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: 151
atom chem shift.comp id: GLY
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 154
atom chem shift.val: 173.3143
atom chem shift.val err: 0.0000

1,52024,732
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 732
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: 151
atom chem shift.comp id: GLY
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30390
atom chem shift.seq id: 154
atom chem shift.val: 46.7984
atom chem shift.val err: 0.0000

1,52024,733
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 733
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: 151
atom chem shift.comp id: GLY
atom chem shift.comp index id: 154
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26905
atom chem shift.seq id: 154
atom chem shift.val: 115.3790
atom chem shift.val err: 0.0000

1,52024,734
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 734
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: 152
atom chem shift.comp id: VAL
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30005
atom chem shift.seq id: 155
atom chem shift.val: 6.9433
atom chem shift.val err: 0.0000

1,52024,735
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 735
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: 152
atom chem shift.comp id: VAL
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 155
atom chem shift.val: 176.4550
atom chem shift.val err: 0.0000

1,52024,736
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 736
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: 152
atom chem shift.comp id: VAL
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28077
atom chem shift.seq id: 155
atom chem shift.val: 68.1794
atom chem shift.val err: 0.0000

1,52024,737
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 737
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: 152
atom chem shift.comp id: VAL
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 72903
atom chem shift.seq id: 155
atom chem shift.val: 31.7430
atom chem shift.val err: 0.0000

1,52024,738
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 738
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: 152
atom chem shift.comp id: VAL
atom chem shift.comp index id: 155
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30007
atom chem shift.seq id: 155
atom chem shift.val: 120.2984
atom chem shift.val err: 0.0000

1,52024,739
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 739
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: 153
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27722
atom chem shift.seq id: 156
atom chem shift.val: 7.8534
atom chem shift.val err: 0.0000

1,52024,740
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 740
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: 153
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 156
atom chem shift.val: 177.1565
atom chem shift.val err: 0.0000

1,52024,741
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 741
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: 153
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30285
atom chem shift.seq id: 156
atom chem shift.val: 57.4147
atom chem shift.val err: 0.0000

1,52024,742
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 742
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: 153
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30288
atom chem shift.seq id: 156
atom chem shift.val: 39.2640
atom chem shift.val err: 0.0000

1,52024,743
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 743
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: 153
atom chem shift.comp id: ASP
atom chem shift.comp index id: 156
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27724
atom chem shift.seq id: 156
atom chem shift.val: 117.0655
atom chem shift.val err: 0.0000

1,52024,744
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 744
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: 154
atom chem shift.comp id: ASP
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26231
atom chem shift.seq id: 157
atom chem shift.val: 8.0753
atom chem shift.val err: 0.0000

1,52024,745
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 745
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: 154
atom chem shift.comp id: ASP
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 157
atom chem shift.val: 179.3524
atom chem shift.val err: 0.0000

1,52024,746
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 746
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: 154
atom chem shift.comp id: ASP
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30363
atom chem shift.seq id: 157
atom chem shift.val: 57.1292
atom chem shift.val err: 0.0000

1,52024,747
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 747
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: 154
atom chem shift.comp id: ASP
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30366
atom chem shift.seq id: 157
atom chem shift.val: 40.1370
atom chem shift.val err: 0.0000

1,52024,748
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 748
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: 154
atom chem shift.comp id: ASP
atom chem shift.comp index id: 157
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26233
atom chem shift.seq id: 157
atom chem shift.val: 116.0861
atom chem shift.val err: 0.0000

1,52024,749
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 749
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 155
atom chem shift.comp id: ALA
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27386
atom chem shift.seq id: 158
atom chem shift.val: 8.6120
atom chem shift.val err: 0.0000

1,52024,750
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 750
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 155
atom chem shift.comp id: ALA
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 158
atom chem shift.val: 177.7293
atom chem shift.val err: 0.0000

1,52024,751
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 751
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 155
atom chem shift.comp id: ALA
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28500
atom chem shift.seq id: 158
atom chem shift.val: 56.3362
atom chem shift.val err: 0.0000

1,52024,752
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 752
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 155
atom chem shift.comp id: ALA
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29379
atom chem shift.seq id: 158
atom chem shift.val: 17.2299
atom chem shift.val err: 0.0000

1,52024,753
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 753
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: ALA
atom chem shift.auth seq id: 155
atom chem shift.comp id: ALA
atom chem shift.comp index id: 158
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 27388
atom chem shift.seq id: 158
atom chem shift.val: 124.8634
atom chem shift.val err: 0.0000

1,52024,754
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 754
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 156
atom chem shift.comp id: PHE
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31034
atom chem shift.seq id: 159
atom chem shift.val: 7.1714
atom chem shift.val err: 0.0000

1,52024,755
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 755
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: PHE
atom chem shift.auth seq id: 156
atom chem shift.comp id: PHE
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 159
atom chem shift.val: 178.1400
atom chem shift.val err: 0.0000

1,52024,756
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 756
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: PHE
atom chem shift.auth seq id: 156
atom chem shift.comp id: PHE
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30609
atom chem shift.seq id: 159
atom chem shift.val: 62.9742
atom chem shift.val err: 0.0000

1,52024,757
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 757
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: PHE
atom chem shift.auth seq id: 156
atom chem shift.comp id: PHE
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30585
atom chem shift.seq id: 159
atom chem shift.val: 39.3605
atom chem shift.val err: 0.0000

1,52024,758
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 758
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: PHE
atom chem shift.auth seq id: 156
atom chem shift.comp id: PHE
atom chem shift.comp index id: 159
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31036
atom chem shift.seq id: 159
atom chem shift.val: 112.8298
atom chem shift.val err: 0.0000

1,52024,759
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 759
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 157
atom chem shift.comp id: TYR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30098
atom chem shift.seq id: 160
atom chem shift.val: 9.4862
atom chem shift.val err: 0.0000

1,52024,760
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 760
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 157
atom chem shift.comp id: TYR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 160
atom chem shift.val: 178.9852
atom chem shift.val err: 0.0000

1,52024,761
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 761
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 157
atom chem shift.comp id: TYR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28356
atom chem shift.seq id: 160
atom chem shift.val: 58.5573
atom chem shift.val err: 0.0000

1,52024,762
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 762
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: TYR
atom chem shift.auth seq id: 157
atom chem shift.comp id: TYR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 77573
atom chem shift.seq id: 160
atom chem shift.val: 35.3189
atom chem shift.val err: 0.0000

1,52024,763
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 763
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: 157
atom chem shift.comp id: TYR
atom chem shift.comp index id: 160
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30100
atom chem shift.seq id: 160
atom chem shift.val: 119.3674
atom chem shift.val err: 0.0000

1,52024,764
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 764
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: 158
atom chem shift.comp id: THR
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28085
atom chem shift.seq id: 161
atom chem shift.val: 8.5816
atom chem shift.val err: 0.0000

1,52024,765
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 765
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: 158
atom chem shift.comp id: THR
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 161
atom chem shift.val: 175.6706
atom chem shift.val err: 0.0000

1,52024,766
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 766
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: 158
atom chem shift.comp id: THR
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28086
atom chem shift.seq id: 161
atom chem shift.val: 67.7859
atom chem shift.val err: 0.0000

1,52024,767
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 767
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: 158
atom chem shift.comp id: THR
atom chem shift.comp index id: 161
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28087
atom chem shift.seq id: 161
atom chem shift.val: 116.4354
atom chem shift.val err: 0.0000

1,52024,768
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 768
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: 159
atom chem shift.comp id: LEU
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25949
atom chem shift.seq id: 162
atom chem shift.val: 7.2650
atom chem shift.val err: 0.0000

1,52024,769
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 769
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 159
atom chem shift.comp id: LEU
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 162
atom chem shift.val: 177.6817
atom chem shift.val err: 0.0000

1,52024,770
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 770
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 159
atom chem shift.comp id: LEU
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29718
atom chem shift.seq id: 162
atom chem shift.val: 57.9757
atom chem shift.val err: 0.0000

1,52024,771
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 771
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 159
atom chem shift.comp id: LEU
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29721
atom chem shift.seq id: 162
atom chem shift.val: 40.0394
atom chem shift.val err: 0.0000

1,52024,772
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 772
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LEU
atom chem shift.auth seq id: 159
atom chem shift.comp id: LEU
atom chem shift.comp index id: 162
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 25951
atom chem shift.seq id: 162
atom chem shift.val: 121.9159
atom chem shift.val err: 0.0000

1,52024,773
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 773
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: 160
atom chem shift.comp id: VAL
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26678
atom chem shift.seq id: 163
atom chem shift.val: 7.6158
atom chem shift.val err: 0.0000

1,52024,774
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 774
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: 160
atom chem shift.comp id: VAL
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 163
atom chem shift.val: 177.4338
atom chem shift.val err: 0.0000

1,52024,775
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 775
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: 160
atom chem shift.comp id: VAL
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30072
atom chem shift.seq id: 163
atom chem shift.val: 67.5600
atom chem shift.val err: 0.0000

1,52024,776
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 776
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: 160
atom chem shift.comp id: VAL
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30057
atom chem shift.seq id: 163
atom chem shift.val: 30.7407
atom chem shift.val err: 0.0000

1,52024,777
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 777
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: 160
atom chem shift.comp id: VAL
atom chem shift.comp index id: 163
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26680
atom chem shift.seq id: 163
atom chem shift.val: 119.6677
atom chem shift.val err: 0.0000

1,52024,778
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 778
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: 161
atom chem shift.comp id: ARG
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31647
atom chem shift.seq id: 164
atom chem shift.val: 8.0728
atom chem shift.val err: 0.0000

1,52024,779
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 779
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: 161
atom chem shift.comp id: ARG
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 164
atom chem shift.val: 179.6382
atom chem shift.val err: 0.0000

1,52024,780
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 780
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: 161
atom chem shift.comp id: ARG
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30168
atom chem shift.seq id: 164
atom chem shift.val: 60.7796
atom chem shift.val err: 0.0000

1,52024,781
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 781
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: 161
atom chem shift.comp id: ARG
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30174
atom chem shift.seq id: 164
atom chem shift.val: 29.3606
atom chem shift.val err: 0.0000

1,52024,782
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 782
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: 161
atom chem shift.comp id: ARG
atom chem shift.comp index id: 164
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31648
atom chem shift.seq id: 164
atom chem shift.val: 118.5619
atom chem shift.val err: 0.0000

1,52024,783
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 783
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: 162
atom chem shift.comp id: GLU
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30938
atom chem shift.seq id: 165
atom chem shift.val: 8.2975
atom chem shift.val err: 0.0000

1,52024,784
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 784
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 162
atom chem shift.comp id: GLU
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 165
atom chem shift.val: 179.6815
atom chem shift.val err: 0.0000

1,52024,785
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 785
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 162
atom chem shift.comp id: GLU
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30108
atom chem shift.seq id: 165
atom chem shift.val: 58.8894
atom chem shift.val err: 0.0000

1,52024,786
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 786
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 162
atom chem shift.comp id: GLU
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30111
atom chem shift.seq id: 165
atom chem shift.val: 30.3053
atom chem shift.val err: 0.0000

1,52024,787
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 787
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 162
atom chem shift.comp id: GLU
atom chem shift.comp index id: 165
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30940
atom chem shift.seq id: 165
atom chem shift.val: 119.3471
atom chem shift.val err: 0.0000

1,52024,788
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 788
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: 163
atom chem shift.comp id: ILE
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26168
atom chem shift.seq id: 166
atom chem shift.val: 8.3644
atom chem shift.val err: 0.0000

1,52024,789
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 789
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: 163
atom chem shift.comp id: ILE
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 166
atom chem shift.val: 178.4754
atom chem shift.val err: 0.0000

1,52024,790
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 790
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: 163
atom chem shift.comp id: ILE
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29568
atom chem shift.seq id: 166
atom chem shift.val: 66.2050
atom chem shift.val err: 0.0000

1,52024,791
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 791
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: 163
atom chem shift.comp id: ILE
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 29571
atom chem shift.seq id: 166
atom chem shift.val: 38.0801
atom chem shift.val err: 0.0000

1,52024,792
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 792
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: 163
atom chem shift.comp id: ILE
atom chem shift.comp index id: 166
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 26170
atom chem shift.seq id: 166
atom chem shift.val: 123.1396
atom chem shift.val err: 0.0000

1,52024,793
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 793
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: 164
atom chem shift.comp id: ARG
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31615
atom chem shift.seq id: 167
atom chem shift.val: 8.6791
atom chem shift.val err: 0.0000

1,52024,794
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 794
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: 164
atom chem shift.comp id: ARG
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 167
atom chem shift.val: 178.9054
atom chem shift.val err: 0.0000

1,52024,795
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 795
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: 164
atom chem shift.comp id: ARG
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30033
atom chem shift.seq id: 167
atom chem shift.val: 60.2434
atom chem shift.val err: 0.0000

1,52024,796
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 796
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: 164
atom chem shift.comp id: ARG
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 75786
atom chem shift.seq id: 167
atom chem shift.val: 30.6718
atom chem shift.val err: 0.0000

1,52024,797
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 797
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: 164
atom chem shift.comp id: ARG
atom chem shift.comp index id: 167
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31616
atom chem shift.seq id: 167
atom chem shift.val: 119.7720
atom chem shift.val err: 0.0000

1,52024,798
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 798
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: 165
atom chem shift.comp id: LYS
atom chem shift.comp index id: 168
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31683
atom chem shift.seq id: 168
atom chem shift.val: 7.8022
atom chem shift.val err: 0.0000

1,52024,799
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 799
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: 165
atom chem shift.comp id: LYS
atom chem shift.comp index id: 168
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 168
atom chem shift.val: 178.4551
atom chem shift.val err: 0.0000

1,52024,800
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 800
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: 165
atom chem shift.comp id: LYS
atom chem shift.comp index id: 168
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30300
atom chem shift.seq id: 168
atom chem shift.val: 58.9940
atom chem shift.val err: 0.0000

1,52024,801
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 801
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: 165
atom chem shift.comp id: LYS
atom chem shift.comp index id: 168
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30303
atom chem shift.seq id: 168
atom chem shift.val: 32.6225
atom chem shift.val err: 0.0000

1,52024,802
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 802
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: 165
atom chem shift.comp id: LYS
atom chem shift.comp index id: 168
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31684
atom chem shift.seq id: 168
atom chem shift.val: 116.9655
atom chem shift.val err: 0.0000

1,52024,803
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 803
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: 166
atom chem shift.comp id: HIS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30254
atom chem shift.seq id: 169
atom chem shift.val: 7.7521
atom chem shift.val err: 0.0000

1,52024,804
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 804
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: 166
atom chem shift.comp id: HIS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 169
atom chem shift.val: 176.1915
atom chem shift.val err: 0.0000

1,52024,805
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 805
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: 166
atom chem shift.comp id: HIS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30249
atom chem shift.seq id: 169
atom chem shift.val: 58.2429
atom chem shift.val err: 0.0000

1,52024,806
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 806
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: 166
atom chem shift.comp id: HIS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30252
atom chem shift.seq id: 169
atom chem shift.val: 29.8886
atom chem shift.val err: 0.0000

1,52024,807
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 807
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: 166
atom chem shift.comp id: HIS
atom chem shift.comp index id: 169
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30256
atom chem shift.seq id: 169
atom chem shift.val: 117.7483
atom chem shift.val err: 0.0000

1,52024,808
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 808
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 170
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30122
atom chem shift.seq id: 170
atom chem shift.val: 8.0319
atom chem shift.val err: 0.0000

1,52024,809
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 809
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: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 170
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 170
atom chem shift.val: 177.1201
atom chem shift.val err: 0.0000

1,52024,810
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 810
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: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 170
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 28404
atom chem shift.seq id: 170
atom chem shift.val: 57.7081
atom chem shift.val err: 0.0000

1,52024,811
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 811
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: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 170
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30123
atom chem shift.seq id: 170
atom chem shift.val: 33.2202
atom chem shift.val err: 0.0000

1,52024,812
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 812
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 167
atom chem shift.comp id: LYS
atom chem shift.comp index id: 170
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30124
atom chem shift.seq id: 170
atom chem shift.val: 119.0550
atom chem shift.val err: 0.0000

1,52024,813
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 813
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: 168
atom chem shift.comp id: GLU
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31627
atom chem shift.seq id: 171
atom chem shift.val: 7.8276
atom chem shift.val err: 0.0000

1,52024,814
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 814
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 168
atom chem shift.comp id: GLU
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 171
atom chem shift.val: 175.6420
atom chem shift.val err: 0.0000

1,52024,815
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 815
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 168
atom chem shift.comp id: GLU
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30063
atom chem shift.seq id: 171
atom chem shift.val: 56.5592
atom chem shift.val err: 0.0000

1,52024,816
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 816
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 168
atom chem shift.comp id: GLU
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 30066
atom chem shift.seq id: 171
atom chem shift.val: 30.0379
atom chem shift.val err: 0.0000

1,52024,817
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 817
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: GLU
atom chem shift.auth seq id: 168
atom chem shift.comp id: GLU
atom chem shift.comp index id: 171
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 31628
atom chem shift.seq id: 171
atom chem shift.val: 119.4855
atom chem shift.val err: 0.0000

1,52024,818
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 818
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: H
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 172
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46883
atom chem shift.seq id: 172
atom chem shift.val: 7.5755
atom chem shift.val err: 0.0000

1,52024,819
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 819
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: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 172
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 172
atom chem shift.val: 181.4386
atom chem shift.val err: 0.0000

1,52024,820
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 820
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: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 172
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46902
atom chem shift.seq id: 172
atom chem shift.val: 58.1240
atom chem shift.val err: 0.0000

1,52024,821
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 821
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: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 172
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46914
atom chem shift.seq id: 172
atom chem shift.val: 33.4118
atom chem shift.val err: 0.0000

1,52024,822
type: atom chem shift
of datablock: info:bmrb/52024
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 52024
atom chem shift.id: 822
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: LYS
atom chem shift.auth seq id: 169
atom chem shift.comp id: LYS
atom chem shift.comp index id: 172
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.resonance id: 46885
atom chem shift.seq id: 172
atom chem shift.val: 126.4800
atom chem shift.val err: 0.0000

52024,GTP
type: chem comp
of datablock: info:bmrb/52024
reference to entry: entry
chem comp.entry id: 52024
chem comp.id: GTP
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: GTP
chem comp.formal charge: 0
chem comp.formula: C10 H16 N5 O14 P3
chem comp.formula weight: 523.180
chem comp.ideal coordinates details: Corina
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates db code: 1QRA
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.mon nstd parent comp id: G
chem comp.name: GUANOSINE-5'-TRIPHOSPHATE
chem comp.number atoms all: 48
chem comp.number atoms nh: 32
chem comp.one letter code: G
chem comp.pdb code: GTP
chem comp.processing site: EBI
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_GTP
chem comp.three letter code: GTP
chem comp.type: NON-POLYMER

info:pdb-ccd/GTP

pdb-ccd:GTP

info:pdb.ligand/GTP

pdb.ligand:GTP

52024,MG
type: chem comp
of datablock: info:bmrb/52024
reference to entry: entry
chem comp.entry id: 52024
chem comp.id: MG
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.bmrb code: MG
chem comp.formal charge: 2+
chem comp.formula: Mg
chem comp.formula weight: 24.305
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/Mg/q+2
chem comp.initial date: 2020-07-09Z
chem comp.model coordinates missing flag: no
chem comp.modified date: 2020-07-09Z
chem comp.mon nstd flag: no
chem comp.name: MAGNESIUM ION
chem comp.number atoms all: 1
chem comp.number atoms nh: 1
chem comp.pdb code: MG
chem comp.processing site: PDBJ
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_MG
chem comp.three letter code: MG
chem comp.type: NON-POLYMER

info:pdb-ccd/MG

pdb-ccd:MG

info:pdb.ligand/MG

pdb.ligand:MG

PG,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: PG
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: PG
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: PG
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.566
chem comp atom.model cartn x ideal: -6.030
chem comp atom.model cartn y: 31.391
chem comp atom.model cartn y ideal: -2.367
chem comp atom.model cartn z: 21.635
chem comp atom.model cartn z ideal: 0.637
chem comp atom.pdb atom id: PG
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1G,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O1G
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O1G
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1G
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.613
chem comp atom.model cartn x ideal: -7.326
chem comp atom.model cartn y: 31.907
chem comp atom.model cartn y ideal: -1.996
chem comp atom.model cartn z: 23.069
chem comp atom.model cartn z ideal: 0.026
chem comp atom.pdb atom id: O1G
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2G,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O2G
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O2G
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2G
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.892
chem comp atom.model cartn x ideal: -6.285
chem comp atom.model cartn y: 32.319
chem comp atom.model cartn y ideal: -2.982
chem comp atom.model cartn z: 20.631
chem comp atom.model cartn z ideal: 2.103
chem comp atom.pdb atom id: O2G
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3G,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O3G
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O3G
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3G
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 4.143
chem comp atom.model cartn x ideal: -5.296
chem comp atom.model cartn y: 30.012
chem comp atom.model cartn y ideal: -3.463
chem comp atom.model cartn z: 21.613
chem comp atom.model cartn z ideal: -0.286
chem comp atom.pdb atom id: O3G
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3B,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O3B
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O3B
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3B
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.160
chem comp atom.model cartn x ideal: -5.101
chem comp atom.model cartn y: 31.360
chem comp atom.model cartn y ideal: -1.058
chem comp atom.model cartn z: 21.228
chem comp atom.model cartn z ideal: 0.758
chem comp atom.pdb atom id: O3B
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: O

PB,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: PB
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: PB
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: PB
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.877
chem comp atom.model cartn x ideal: -4.818
chem comp atom.model cartn y: 31.202
chem comp atom.model cartn y ideal: 0.206
chem comp atom.model cartn z: 19.745
chem comp atom.model cartn z ideal: -0.199
chem comp atom.pdb atom id: PB
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1B,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O1B
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O1B
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1B
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.079
chem comp atom.model cartn x ideal: -4.732
chem comp atom.model cartn y: 29.709
chem comp atom.model cartn y ideal: -0.250
chem comp atom.model cartn z: 19.473
chem comp atom.model cartn z ideal: -1.605
chem comp atom.pdb atom id: O1B
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2B,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O2B
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O2B
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2B
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 6.125
chem comp atom.model cartn x ideal: -6.017
chem comp atom.model cartn y: 31.970
chem comp atom.model cartn y ideal: 1.269
chem comp atom.model cartn z: 18.749
chem comp atom.model cartn z ideal: -0.052
chem comp atom.pdb atom id: O2B
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O3A,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O3A
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O3A
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3A
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.251
chem comp atom.model cartn x ideal: -3.429
chem comp atom.model cartn y: 31.890
chem comp atom.model cartn y ideal: 0.900
chem comp atom.model cartn z: 20.003
chem comp atom.model cartn z ideal: 0.226
chem comp atom.pdb atom id: O3A
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: O

PA,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: PA
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: PA
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: PA
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.846
chem comp atom.model cartn x ideal: -2.449
chem comp atom.model cartn y: 33.261
chem comp atom.model cartn y ideal: 1.965
chem comp atom.model cartn z: 19.411
chem comp atom.model cartn z ideal: -0.479
chem comp atom.pdb atom id: PA
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: P

O1A,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O1A
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O1A
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O1A
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.888
chem comp atom.model cartn x ideal: -2.350
chem comp atom.model cartn y: 33.256
chem comp atom.model cartn y ideal: 1.662
chem comp atom.model cartn z: 17.957
chem comp atom.model cartn z ideal: -1.925
chem comp atom.pdb atom id: O1A
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2A,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O2A
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O2A
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2A
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 8.105
chem comp atom.model cartn x ideal: -3.040
chem comp atom.model cartn y: 34.398
chem comp atom.model cartn y ideal: 3.450
chem comp atom.model cartn z: 20.129
chem comp atom.model cartn z ideal: -0.282
chem comp atom.pdb atom id: O2A
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O5',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O5'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O5'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O5'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.430
chem comp atom.model cartn x ideal: -0.988
chem comp atom.model cartn y: 33.153
chem comp atom.model cartn y ideal: 1.876
chem comp atom.model cartn z: 19.900
chem comp atom.model cartn z ideal: 0.190
chem comp atom.pdb atom id: O5'
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C5',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C5'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C5'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C5'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.549
chem comp atom.model cartn x ideal: 0.134
chem comp atom.model cartn y: 33.044
chem comp atom.model cartn y ideal: 2.622
chem comp atom.model cartn z: 21.378
chem comp atom.model cartn z ideal: -0.287
chem comp atom.pdb atom id: C5'
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C4',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C4'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C4'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C4'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.046
chem comp atom.model cartn x ideal: 1.360
chem comp atom.model cartn y: 33.618
chem comp atom.model cartn y ideal: 2.304
chem comp atom.model cartn z: 21.474
chem comp atom.model cartn z ideal: 0.570
chem comp atom.pdb atom id: C4'
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O4',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O4'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O4'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O4'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.052
chem comp atom.model cartn x ideal: 1.749
chem comp atom.model cartn y: 32.830
chem comp atom.model cartn y ideal: 0.933
chem comp atom.model cartn z: 20.818
chem comp atom.model cartn z ideal: 0.378
chem comp atom.pdb atom id: O4'
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C3',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.307
chem comp atom.model cartn x ideal: 2.548
chem comp atom.model cartn y: 34.969
chem comp atom.model cartn y ideal: 3.182
chem comp atom.model cartn z: 21.057
chem comp atom.model cartn z ideal: 0.132
chem comp atom.pdb atom id: C3'
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: S
chem comp atom.type symbol: C

O3',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.109
chem comp atom.model cartn x ideal: 2.994
chem comp atom.model cartn y: 35.672
chem comp atom.model cartn y ideal: 3.997
chem comp atom.model cartn z: 21.971
chem comp atom.model cartn z ideal: 1.218
chem comp atom.pdb atom id: O3'
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C2',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.839
chem comp atom.model cartn x ideal: 3.645
chem comp atom.model cartn y: 34.971
chem comp atom.model cartn y ideal: 2.166
chem comp atom.model cartn z: 19.593
chem comp atom.model cartn z ideal: -0.269
chem comp atom.pdb atom id: C2'
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: R
chem comp atom.type symbol: C

O2',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.672
chem comp atom.model cartn x ideal: 4.929
chem comp atom.model cartn y: 35.961
chem comp atom.model cartn y ideal: 2.593
chem comp atom.model cartn z: 19.355
chem comp atom.model cartn z ideal: 0.190
chem comp atom.pdb atom id: O2'
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: O

C1',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C1'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C1'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C1'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.846
chem comp atom.model cartn x ideal: 3.188
chem comp atom.model cartn y: 33.622
chem comp atom.model cartn y ideal: 0.886
chem comp atom.model cartn z: 19.927
chem comp atom.model cartn z ideal: 0.476
chem comp atom.pdb atom id: C1'
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: R
chem comp atom.type symbol: C

N9,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: N9
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: N9
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N9
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 14.001
chem comp atom.model cartn x ideal: 3.711
chem comp atom.model cartn y: 32.833
chem comp atom.model cartn y ideal: -0.311
chem comp atom.model cartn z: 18.649
chem comp atom.model cartn z ideal: -0.188
chem comp atom.pdb atom id: N9
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C8,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C8
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C8
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C8
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.934
chem comp atom.model cartn x ideal: 3.094
chem comp atom.model cartn y: 32.452
chem comp atom.model cartn y ideal: -1.021
chem comp atom.model cartn z: 17.848
chem comp atom.model cartn z ideal: -1.176
chem comp atom.pdb atom id: C8
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N7,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: N7
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: N7
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N7
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.640
chem comp atom.model cartn x ideal: 3.843
chem comp atom.model cartn y: 31.798
chem comp atom.model cartn y ideal: -2.023
chem comp atom.model cartn z: 16.899
chem comp atom.model cartn z ideal: -1.533
chem comp atom.pdb atom id: N7
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C5,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C5
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C5
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C5
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.029
chem comp atom.model cartn x ideal: 4.981
chem comp atom.model cartn y: 31.889
chem comp atom.model cartn y ideal: -2.017
chem comp atom.model cartn z: 17.001
chem comp atom.model cartn z ideal: -0.798
chem comp atom.pdb atom id: C5
chem comp atom.pdbx ordinal: 25
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C6,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C6
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C6
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.899
chem comp atom.model cartn x ideal: 6.129
chem comp atom.model cartn y: 31.394
chem comp atom.model cartn y ideal: -2.842
chem comp atom.model cartn z: 16.238
chem comp atom.model cartn z ideal: -0.753
chem comp atom.pdb atom id: C6
chem comp atom.pdbx ordinal: 26
chem comp atom.stereo config: N
chem comp atom.type symbol: C

O6,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: O6
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: O6
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: O6
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.982
chem comp atom.model cartn x ideal: 6.235
chem comp atom.model cartn y: 30.680
chem comp atom.model cartn y ideal: -3.807
chem comp atom.model cartn z: 15.191
chem comp atom.model cartn z ideal: -1.491
chem comp atom.pdb atom id: O6
chem comp atom.pdbx ordinal: 27
chem comp atom.stereo config: N
chem comp atom.type symbol: O

N1,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: N1
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: N1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: N1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.274
chem comp atom.model cartn x ideal: 7.106
chem comp atom.model cartn y: 31.628
chem comp atom.model cartn y ideal: -2.535
chem comp atom.model cartn z: 16.800
chem comp atom.model cartn z ideal: 0.129
chem comp atom.pdb atom id: N1
chem comp atom.pdbx ordinal: 28
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C2,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C2
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: C2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 17.304
chem comp atom.model cartn x ideal: 6.978
chem comp atom.model cartn y: 32.295
chem comp atom.model cartn y ideal: -1.454
chem comp atom.model cartn z: 17.896
chem comp atom.model cartn z ideal: 0.950
chem comp atom.pdb atom id: C2
chem comp atom.pdbx ordinal: 29
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N2,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: N2
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: N2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: N2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.677
chem comp atom.model cartn x ideal: 7.986
chem comp atom.model cartn y: 32.450
chem comp atom.model cartn y ideal: -1.165
chem comp atom.model cartn z: 18.475
chem comp atom.model cartn z ideal: 1.835
chem comp atom.pdb atom id: N2
chem comp atom.pdbx ordinal: 30
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N3,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: N3
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: N3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: N3
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 16.384
chem comp atom.model cartn x ideal: 5.916
chem comp atom.model cartn y: 32.736
chem comp atom.model cartn y ideal: -0.679
chem comp atom.model cartn z: 18.739
chem comp atom.model cartn z ideal: 0.917
chem comp atom.pdb atom id: N3
chem comp atom.pdbx ordinal: 31
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C4,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: C4
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: C4
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C4
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 15.218
chem comp atom.model cartn x ideal: 4.911
chem comp atom.model cartn y: 32.517
chem comp atom.model cartn y ideal: -0.918
chem comp atom.model cartn z: 18.135
chem comp atom.model cartn z ideal: 0.066
chem comp atom.pdb atom id: C4
chem comp atom.pdbx ordinal: 32
chem comp atom.stereo config: N
chem comp atom.type symbol: C

HOG2,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HOG2
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HOG2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOG2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.595
chem comp atom.model cartn x ideal: -6.838
chem comp atom.model cartn y: 33.105
chem comp atom.model cartn y ideal: -3.775
chem comp atom.model cartn z: 21.075
chem comp atom.model cartn z ideal: 2.106
chem comp atom.pdb atom id: HOG2
chem comp atom.pdbx ordinal: 33
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOG3,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HOG3
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HOG3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOG3
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.982
chem comp atom.model cartn x ideal: -4.439
chem comp atom.model cartn y: 29.715
chem comp atom.model cartn y ideal: -3.753
chem comp atom.model cartn z: 22.501
chem comp atom.model cartn z ideal: 0.055
chem comp atom.pdb atom id: HOG3
chem comp atom.pdbx ordinal: 34
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOB2,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HOB2
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HOB2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOB2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 5.858
chem comp atom.model cartn x ideal: -6.132
chem comp atom.model cartn y: 31.396
chem comp atom.model cartn y ideal: 1.611
chem comp atom.model cartn z: 18.041
chem comp atom.model cartn z ideal: 0.846
chem comp atom.pdb atom id: HOB2
chem comp atom.pdbx ordinal: 35
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HOA2,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HOA2
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HOA2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HOA2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 7.743
chem comp atom.model cartn x ideal: -3.133
chem comp atom.model cartn y: 34.996
chem comp atom.model cartn y ideal: 3.717
chem comp atom.model cartn z: 19.486
chem comp atom.model cartn z ideal: 0.643
chem comp atom.pdb atom id: HOA2
chem comp atom.pdbx ordinal: 36
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H5'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: H5'1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H5'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 9.819
chem comp atom.model cartn x ideal: 0.335
chem comp atom.model cartn y: 33.672
chem comp atom.model cartn y ideal: 2.352
chem comp atom.model cartn z: 21.910
chem comp atom.model cartn z ideal: -1.324
chem comp atom.pdb atom id: H5'
chem comp atom.pdbx ordinal: 37
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H5'',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H5''
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: H5'2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H5''
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 10.469
chem comp atom.model cartn x ideal: -0.086
chem comp atom.model cartn y: 32.007
chem comp atom.model cartn y ideal: 3.688
chem comp atom.model cartn z: 21.735
chem comp atom.model cartn z ideal: -0.226
chem comp atom.pdb atom id: H5''
chem comp atom.pdbx ordinal: 38
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H4',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H4'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: H4'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H4'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.283
chem comp atom.model cartn x ideal: 1.133
chem comp atom.model cartn y: 33.581
chem comp atom.model cartn y ideal: 2.480
chem comp atom.model cartn z: 22.548
chem comp atom.model cartn z ideal: 1.621
chem comp atom.pdb atom id: H4'
chem comp atom.pdbx ordinal: 39
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H3',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: H3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.335
chem comp atom.model cartn x ideal: 2.270
chem comp atom.model cartn y: 35.482
chem comp atom.model cartn y ideal: 3.803
chem comp atom.model cartn z: 21.016
chem comp atom.model cartn z ideal: -0.720
chem comp atom.pdb atom id: H3'
chem comp atom.pdbx ordinal: 40
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO3',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HO3'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HO3'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HO3'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: yes
chem comp atom.model cartn x: 13.253
chem comp atom.model cartn x ideal: 3.741
chem comp atom.model cartn y: 36.555
chem comp atom.model cartn y ideal: 4.571
chem comp atom.model cartn z: 21.653
chem comp atom.model cartn z ideal: 0.998
chem comp atom.pdb atom id: HO3'
chem comp atom.pdbx ordinal: 41
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H2',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: H2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 12.075
chem comp atom.model cartn x ideal: 3.652
chem comp atom.model cartn y: 34.730
chem comp atom.model cartn y ideal: 2.007
chem comp atom.model cartn z: 18.840
chem comp atom.model cartn z ideal: -1.347
chem comp atom.pdb atom id: H2'
chem comp atom.pdbx ordinal: 42
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HO2',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HO2'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HO2'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HO2'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 13.966
chem comp atom.model cartn x ideal: 5.218
chem comp atom.model cartn y: 35.918
chem comp atom.model cartn y ideal: 3.438
chem comp atom.model cartn z: 18.453
chem comp atom.model cartn z ideal: -0.180
chem comp atom.pdb atom id: HO2'
chem comp atom.pdbx ordinal: 43
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H1',GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H1'
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: H1'
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H1'
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 14.805
chem comp atom.model cartn x ideal: 3.503
chem comp atom.model cartn y: 33.958
chem comp atom.model cartn y ideal: 0.916
chem comp atom.model cartn z: 20.347
chem comp atom.model cartn z ideal: 1.519
chem comp atom.pdb atom id: H1'
chem comp atom.pdbx ordinal: 44
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H8,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: H8
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: H8
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H8
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 11.873
chem comp atom.model cartn x ideal: 2.128
chem comp atom.model cartn y: 32.624
chem comp atom.model cartn y ideal: -0.786
chem comp atom.model cartn z: 17.951
chem comp atom.model cartn z ideal: -1.599
chem comp atom.pdb atom id: H8
chem comp atom.pdbx ordinal: 45
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN1,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HN1
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 1
chem comp atom.alt atom id: HN1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HN1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.102
chem comp atom.model cartn x ideal: 7.903
chem comp atom.model cartn y: 31.290
chem comp atom.model cartn y ideal: -3.086
chem comp atom.model cartn z: 16.354
chem comp atom.model cartn z ideal: 0.179
chem comp atom.pdb atom id: HN1
chem comp atom.pdbx ordinal: 46
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN21,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HN21
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HN21
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HN21
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 18.794
chem comp atom.model cartn x ideal: 8.776
chem comp atom.model cartn y: 32.845
chem comp atom.model cartn y ideal: -1.728
chem comp atom.model cartn z: 19.386
chem comp atom.model cartn z ideal: 1.870
chem comp atom.pdb atom id: HN21
chem comp atom.pdbx ordinal: 47
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN22,GTP,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: HN22
chem comp atom.comp id: GTP
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: HN22
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: HN22
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 19.477
chem comp atom.model cartn x ideal: 7.909
chem comp atom.model cartn y: 32.159
chem comp atom.model cartn y ideal: -0.399
chem comp atom.model cartn z: 17.950
chem comp atom.model cartn z ideal: 2.425
chem comp atom.pdb atom id: HN22
chem comp atom.pdbx ordinal: 48
chem comp atom.stereo config: N
chem comp atom.type symbol: H

MG,MG,52024
type: chem comp atom
of datablock: info:bmrb/52024
reference to entry: entry
chem comp atom.atom id: MG
chem comp atom.comp id: MG
chem comp atom.entry id: 52024
chem comp atom.align: 0
chem comp atom.alt atom id: MG
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: MG
chem comp atom.charge: 2
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.000
chem comp atom.model cartn x ideal: 0.000
chem comp atom.model cartn y: 0.000
chem comp atom.model cartn y ideal: 0.000
chem comp atom.model cartn z: 0.000
chem comp atom.model cartn z ideal: 0.000
chem comp atom.pdb atom id: MG
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: MG

GTP,52024,1
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 1
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O1G
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,2
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 2
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O2G
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,3
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 3
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O3G
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,4
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 4
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PG
chem comp bond.atom id 2: O3B
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,5
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 5
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2G
chem comp bond.atom id 2: HOG2
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,6
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 6
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3G
chem comp bond.atom id 2: HOG3
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,7
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 7
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3B
chem comp bond.atom id 2: PB
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,8
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PB
chem comp bond.atom id 2: O1B
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,9
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 9
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PB
chem comp bond.atom id 2: O2B
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,10
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 10
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PB
chem comp bond.atom id 2: O3A
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,11
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 11
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2B
chem comp bond.atom id 2: HOB2
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,12
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 12
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3A
chem comp bond.atom id 2: PA
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,13
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 13
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O1A
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,14
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 14
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O2A
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,15
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 15
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: PA
chem comp bond.atom id 2: O5'
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,16
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 16
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2A
chem comp bond.atom id 2: HOA2
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,17
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 17
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O5'
chem comp bond.atom id 2: C5'
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,18
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 18
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5'
chem comp bond.atom id 2: C4'
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,19
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 19
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5'
chem comp bond.atom id 2: H5'
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,20
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 20
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5'
chem comp bond.atom id 2: H5''
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,21
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 21
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4'
chem comp bond.atom id 2: O4'
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,22
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 22
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4'
chem comp bond.atom id 2: C3'
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,23
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 23
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4'
chem comp bond.atom id 2: H4'
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,24
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 24
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O4'
chem comp bond.atom id 2: C1'
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,25
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 25
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3'
chem comp bond.atom id 2: O3'
chem comp bond.ordinal: 25
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,26
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 26
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3'
chem comp bond.atom id 2: C2'
chem comp bond.ordinal: 26
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,27
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 27
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3'
chem comp bond.atom id 2: H3'
chem comp bond.ordinal: 27
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,28
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 28
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O3'
chem comp bond.atom id 2: HO3'
chem comp bond.ordinal: 28
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,29
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 29
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2'
chem comp bond.atom id 2: O2'
chem comp bond.ordinal: 29
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,30
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 30
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2'
chem comp bond.atom id 2: C1'
chem comp bond.ordinal: 30
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,31
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 31
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2'
chem comp bond.atom id 2: H2'
chem comp bond.ordinal: 31
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,32
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 32
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O2'
chem comp bond.atom id 2: HO2'
chem comp bond.ordinal: 32
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,33
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 33
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1'
chem comp bond.atom id 2: N9
chem comp bond.ordinal: 33
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,34
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 34
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1'
chem comp bond.atom id 2: H1'
chem comp bond.ordinal: 34
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,35
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 35
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N9
chem comp bond.atom id 2: C8
chem comp bond.ordinal: 35
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,36
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 36
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N9
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 36
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,37
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 37
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: N7
chem comp bond.ordinal: 37
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,38
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 38
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H8
chem comp bond.ordinal: 38
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,39
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 39
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N7
chem comp bond.atom id 2: C5
chem comp bond.ordinal: 39
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,40
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 40
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 40
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,41
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 41
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 41
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,42
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 42
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: O6
chem comp bond.ordinal: 42
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,43
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 43
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: N1
chem comp bond.ordinal: 43
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,44
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 44
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: C2
chem comp bond.ordinal: 44
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,45
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 45
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: HN1
chem comp bond.ordinal: 45
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,46
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 46
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N2
chem comp bond.ordinal: 46
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,47
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 47
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N3
chem comp bond.ordinal: 47
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

GTP,52024,48
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 48
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: HN21
chem comp bond.ordinal: 48
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,49
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 49
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: HN22
chem comp bond.ordinal: 49
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,52024,50
type: chem comp bond
of datablock: info:bmrb/52024
chem comp bond.comp id: GTP
chem comp bond.entry id: 52024
chem comp bond.id: 50
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 50
chem comp bond.stereo config: N
chem comp bond.value order: SING

GTP,,52024,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: InChI=1S/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
chem comp descriptor.entry id: 52024
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr52024/chem_comp_descriptor/GTP,NC1%3DNc2n(cnc2C(%3DO)N1)%5BC%40%40H%5D3O%5BC%40H%5D(CO%5BP%5D(O)(%3DO)O%5BP%5D(O)(%3DO)O%5BP%5D(O,52024,CACTVS,3.370,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@H](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)[C@@H](O)[C@H]3O
chem comp descriptor.entry id: 52024
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.370
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr52024/chem_comp_descriptor/GTP,NC1%3DNc2n(cnc2C(%3DO)N1)%5BCH%5D3O%5BCH%5D(CO%5BP%5D(O)(%3DO)O%5BP%5D(O)(%3DO)O%5BP%5D(O)(O,52024,CACTVS,3.370,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: NC1=Nc2n(cnc2C(=O)N1)[CH]3O[CH](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)[CH](O)[CH]3O
chem comp descriptor.entry id: 52024
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.370
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr52024/chem_comp_descriptor/GTP,O%3DP(O)(O)OP(%3DO)(O)OP(%3DO)(O)OCC3OC(n2cnc1c2N%3DC(N)NC1%3DO)C(O)C3O,52024,ACD,12.01,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)C(O)C3O
chem comp descriptor.entry id: 52024
chem comp descriptor.program: ACD
chem comp descriptor.program version: 12.01
chem comp descriptor.type: SMILES

GTP,XKMLYUALXHKNFT-UUOKFMHZSA-N,52024,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: XKMLYUALXHKNFT-UUOKFMHZSA-N
chem comp descriptor.entry id: 52024
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr52024/chem_comp_descriptor/GTP,c1nc2c(n1C3C(C(C(O3)COP(%3DO)(O)OP(%3DO)(O)OP(%3DO)(O)O)O)O)N%3DC(NC2%3DO),52024,OECHEM,1.7.6,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: c1nc2c(n1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
chem comp descriptor.entry id: 52024
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr52024/chem_comp_descriptor/GTP,c1nc2c(n1%5BC%40H%5D3%5BC%40%40H%5D(%5BC%40%40H%5D(%5BC%40H%5D(O3)CO%5BP%40%5D(%3DO)(O)O%5BP%40%5D(%3DO)(O)O,52024,OECHEM,1.7.6,SMILES_CAN[cell cut: 206 characters, first 200 kept]
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: GTP
chem comp descriptor.descriptor: c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)O[P@](=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
chem comp descriptor.entry id: 52024
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES_CANONICAL

http://bmrbpub.pdbj.org/rdf/bmr52024/chem_comp_descriptor/MG,InChI%3D1S%2FMg%2Fq%2B2,52024,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: InChI=1S/Mg/q+2
chem comp descriptor.entry id: 52024
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

MG,JLVVSXFLKOJNIY-UHFFFAOYSA-N,52024,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: JLVVSXFLKOJNIY-UHFFFAOYSA-N
chem comp descriptor.entry id: 52024
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

MG,[Mg++],52024,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg++]
chem comp descriptor.entry id: 52024
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

MG,[Mg++],52024,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg++]
chem comp descriptor.entry id: 52024
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

MG,[Mg+2],52024,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg+2]
chem comp descriptor.entry id: 52024
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

MG,[Mg+2],52024,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg+2]
chem comp descriptor.entry id: 52024
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

MG,[Mg+2],52024,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/52024
chem comp descriptor.comp id: MG
chem comp descriptor.descriptor: [Mg+2]
chem comp descriptor.entry id: 52024
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

GTP,52024,[[(2R,3S,4R,5R)-5-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)-3,OECHEM,1.7.6,systematic name
type: chem comp identifier
of datablock: info:bmrb/52024
chem comp identifier.comp id: GTP
chem comp identifier.entry id: 52024
chem comp identifier.identifier: [[(2R,3S,4R,5R)-5-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.7.6
chem comp identifier.type: systematic name

GTP,52024,guanosine 5'-(tetrahydrogen triphosphate),ACD,12.01,systematic name
type: chem comp identifier
of datablock: info:bmrb/52024
chem comp identifier.comp id: GTP
chem comp identifier.entry id: 52024
chem comp identifier.identifier: guanosine 5'-(tetrahydrogen triphosphate)
chem comp identifier.program: ACD
chem comp identifier.program version: 12.01
chem comp identifier.type: systematic name

MG,52024,magnesium,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/52024
chem comp identifier.comp id: MG
chem comp identifier.entry id: 52024
chem comp identifier.identifier: magnesium
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

MG,52024,magnesium(+2) cation,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/52024
chem comp identifier.comp id: MG
chem comp identifier.entry id: 52024
chem comp identifier.identifier: magnesium(+2) cation
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

1,52024,1
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: 3D HNCO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52024,2
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 2
chem shift experiment.experiment name: 3D HN(CA)CO
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52024,3
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 3
chem shift experiment.experiment name: 3D HNCA
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52024,4
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 4
chem shift experiment.experiment name: 3D HN(CO)CA
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52024,5
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 5
chem shift experiment.experiment name: 3D HNCACB
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52024,6
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 6
chem shift experiment.experiment name: 3D CBCA(CO)NH
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,52024,8
type: chem shift experiment
of datablock: info:bmrb/52024
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 52024
chem shift experiment.experiment id: 8
chem shift experiment.experiment name: 3D 15N-separated NOESY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

13,C,1,52024,water
type: chem shift ref
of datablock: info:bmrb/52024
chem shift ref.atom isotope number: 13
chem shift ref.atom type: C
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 52024
chem shift ref.mol common name: water
chem shift ref.atom group: protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 4.7
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: indirect

1,H,1,52024,water
type: chem shift ref
of datablock: info:bmrb/52024
chem shift ref.atom isotope number: 1
chem shift ref.atom type: H
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 52024
chem shift ref.mol common name: water
chem shift ref.atom group: protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 4.7
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 1
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

15,N,1,52024,water
type: chem shift ref
of datablock: info:bmrb/52024
chem shift ref.atom isotope number: 15
chem shift ref.atom type: N
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 52024
chem shift ref.mol common name: water
chem shift ref.atom group: protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 4.7
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: indirect

52024,1
type: chem shift reference
of datablock: info:bmrb/52024
reference to entry: entry
chem shift reference.entry id: 52024
chem shift reference.id: 1
chem shift reference.name: _Chem_shift_reference.1
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chem_shift_reference_1

1,52024,1
type: chem shift software
of datablock: info:bmrb/52024
chem shift software.assigned chem shift list id: 1
chem shift software.entry id: 52024
chem shift software.software id: 1
chem shift software.method id: 0
chem shift software.software label: software_1

1,52024,2
type: chem shift software
of datablock: info:bmrb/52024
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52024,1
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citation.class: entry citation
citation.doi: 10.1038/s41594-023-01070-z
citation.journal abbrev: Nat. Struct. Mol. Biol.
citation.journal issue: 10
citation.journal name full: Nature structural & molecular biology
citation.journal volume: 30
citation.page first: 1446
citation.page last: 1455
citation.pubmed id: 37640864
citation.sf category: citations
citation.sf framecode: citations_1
citation.status: published
citation.title: Excited-state observation of active K-Ras reveals differential structural dynamics of wild-type versus oncogenic G12D and G12C mutants.
citation.type: journal
citation.year: 2023

info:doi/10.1038/s41594-023-01070-z

doi:10.1038/s41594-023-01070-z

info:pmid/37640864

pubmed:37640864

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entity comp index.entry id: 52024
entity comp index.id: 71
entity comp index.auth seq id: 68
entity comp index.comp id: ARG

1,52024,72
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 72
entity comp index.auth seq id: 69
entity comp index.comp id: ASP

1,52024,73
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 73
entity comp index.auth seq id: 70
entity comp index.comp id: GLN

1,52024,74
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 74
entity comp index.auth seq id: 71
entity comp index.comp id: TYR

1,52024,75
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 75
entity comp index.auth seq id: 72
entity comp index.comp id: MET

1,52024,76
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 76
entity comp index.auth seq id: 73
entity comp index.comp id: ARG

1,52024,77
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 77
entity comp index.auth seq id: 74
entity comp index.comp id: THR

1,52024,78
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 78
entity comp index.auth seq id: 75
entity comp index.comp id: GLY

1,52024,79
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 79
entity comp index.auth seq id: 76
entity comp index.comp id: GLU

1,52024,80
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 80
entity comp index.auth seq id: 77
entity comp index.comp id: GLY

1,52024,81
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 81
entity comp index.auth seq id: 78
entity comp index.comp id: PHE

1,52024,82
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 82
entity comp index.auth seq id: 79
entity comp index.comp id: LEU

1,52024,83
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 83
entity comp index.auth seq id: 80
entity comp index.comp id: CYS

1,52024,84
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 84
entity comp index.auth seq id: 81
entity comp index.comp id: VAL

1,52024,85
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 85
entity comp index.auth seq id: 82
entity comp index.comp id: PHE

1,52024,86
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 86
entity comp index.auth seq id: 83
entity comp index.comp id: ALA

1,52024,87
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 87
entity comp index.auth seq id: 84
entity comp index.comp id: ILE

1,52024,88
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 88
entity comp index.auth seq id: 85
entity comp index.comp id: ASN

1,52024,89
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 89
entity comp index.auth seq id: 86
entity comp index.comp id: ASN

1,52024,90
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 90
entity comp index.auth seq id: 87
entity comp index.comp id: THR

1,52024,91
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 91
entity comp index.auth seq id: 88
entity comp index.comp id: LYS

1,52024,92
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 92
entity comp index.auth seq id: 89
entity comp index.comp id: SER

1,52024,93
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 93
entity comp index.auth seq id: 90
entity comp index.comp id: PHE

1,52024,94
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 94
entity comp index.auth seq id: 91
entity comp index.comp id: GLU

1,52024,95
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 95
entity comp index.auth seq id: 92
entity comp index.comp id: ASP

1,52024,96
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 96
entity comp index.auth seq id: 93
entity comp index.comp id: ILE

1,52024,97
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 97
entity comp index.auth seq id: 94
entity comp index.comp id: HIS

1,52024,98
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 98
entity comp index.auth seq id: 95
entity comp index.comp id: HIS

1,52024,99
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 99
entity comp index.auth seq id: 96
entity comp index.comp id: TYR

1,52024,100
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 100
entity comp index.auth seq id: 97
entity comp index.comp id: ARG

1,52024,101
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 101
entity comp index.auth seq id: 98
entity comp index.comp id: GLU

1,52024,102
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 102
entity comp index.auth seq id: 99
entity comp index.comp id: GLN

1,52024,103
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 103
entity comp index.auth seq id: 100
entity comp index.comp id: ILE

1,52024,104
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 104
entity comp index.auth seq id: 101
entity comp index.comp id: LYS

1,52024,105
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 105
entity comp index.auth seq id: 102
entity comp index.comp id: ARG

1,52024,106
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 106
entity comp index.auth seq id: 103
entity comp index.comp id: VAL

1,52024,107
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 107
entity comp index.auth seq id: 104
entity comp index.comp id: LYS

1,52024,108
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 108
entity comp index.auth seq id: 105
entity comp index.comp id: ASP

1,52024,109
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 109
entity comp index.auth seq id: 106
entity comp index.comp id: SER

1,52024,110
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 110
entity comp index.auth seq id: 107
entity comp index.comp id: GLU

1,52024,111
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 111
entity comp index.auth seq id: 108
entity comp index.comp id: ASP

1,52024,112
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 112
entity comp index.auth seq id: 109
entity comp index.comp id: VAL

1,52024,113
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 113
entity comp index.auth seq id: 110
entity comp index.comp id: PRO

1,52024,114
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 114
entity comp index.auth seq id: 111
entity comp index.comp id: MET

1,52024,115
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 115
entity comp index.auth seq id: 112
entity comp index.comp id: VAL

1,52024,116
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 116
entity comp index.auth seq id: 113
entity comp index.comp id: LEU

1,52024,117
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 117
entity comp index.auth seq id: 114
entity comp index.comp id: VAL

1,52024,118
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 118
entity comp index.auth seq id: 115
entity comp index.comp id: GLY

1,52024,119
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 119
entity comp index.auth seq id: 116
entity comp index.comp id: ASN

1,52024,120
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 120
entity comp index.auth seq id: 117
entity comp index.comp id: LYS

1,52024,121
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 121
entity comp index.auth seq id: 118
entity comp index.comp id: CYS

1,52024,122
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 122
entity comp index.auth seq id: 119
entity comp index.comp id: ASP

1,52024,123
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 123
entity comp index.auth seq id: 120
entity comp index.comp id: LEU

1,52024,124
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 124
entity comp index.auth seq id: 121
entity comp index.comp id: PRO

1,52024,125
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 125
entity comp index.auth seq id: 122
entity comp index.comp id: SER

1,52024,126
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 126
entity comp index.auth seq id: 123
entity comp index.comp id: ARG

1,52024,127
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 127
entity comp index.auth seq id: 124
entity comp index.comp id: THR

1,52024,128
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 128
entity comp index.auth seq id: 125
entity comp index.comp id: VAL

1,52024,129
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 129
entity comp index.auth seq id: 126
entity comp index.comp id: ASP

1,52024,130
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 130
entity comp index.auth seq id: 127
entity comp index.comp id: THR

1,52024,131
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 131
entity comp index.auth seq id: 128
entity comp index.comp id: LYS

1,52024,132
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 132
entity comp index.auth seq id: 129
entity comp index.comp id: GLN

1,52024,133
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 133
entity comp index.auth seq id: 130
entity comp index.comp id: ALA

1,52024,134
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 134
entity comp index.auth seq id: 131
entity comp index.comp id: GLN

1,52024,135
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 135
entity comp index.auth seq id: 132
entity comp index.comp id: ASP

1,52024,136
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 136
entity comp index.auth seq id: 133
entity comp index.comp id: LEU

1,52024,137
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 137
entity comp index.auth seq id: 134
entity comp index.comp id: ALA

1,52024,138
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 138
entity comp index.auth seq id: 135
entity comp index.comp id: ARG

1,52024,139
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 139
entity comp index.auth seq id: 136
entity comp index.comp id: SER

1,52024,140
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 140
entity comp index.auth seq id: 137
entity comp index.comp id: TYR

1,52024,141
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 141
entity comp index.auth seq id: 138
entity comp index.comp id: GLY

1,52024,142
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 142
entity comp index.auth seq id: 139
entity comp index.comp id: ILE

1,52024,143
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 143
entity comp index.auth seq id: 140
entity comp index.comp id: PRO

1,52024,144
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 144
entity comp index.auth seq id: 141
entity comp index.comp id: PHE

1,52024,145
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 145
entity comp index.auth seq id: 142
entity comp index.comp id: ILE

1,52024,146
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 146
entity comp index.auth seq id: 143
entity comp index.comp id: GLU

1,52024,147
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 147
entity comp index.auth seq id: 144
entity comp index.comp id: THR

1,52024,148
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 148
entity comp index.auth seq id: 145
entity comp index.comp id: SER

1,52024,149
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 149
entity comp index.auth seq id: 146
entity comp index.comp id: ALA

1,52024,150
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 150
entity comp index.auth seq id: 147
entity comp index.comp id: LYS

1,52024,151
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 151
entity comp index.auth seq id: 148
entity comp index.comp id: THR

1,52024,152
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 152
entity comp index.auth seq id: 149
entity comp index.comp id: ARG

1,52024,153
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 153
entity comp index.auth seq id: 150
entity comp index.comp id: GLN

1,52024,154
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 154
entity comp index.auth seq id: 151
entity comp index.comp id: GLY

1,52024,155
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 155
entity comp index.auth seq id: 152
entity comp index.comp id: VAL

1,52024,156
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 156
entity comp index.auth seq id: 153
entity comp index.comp id: ASP

1,52024,157
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 157
entity comp index.auth seq id: 154
entity comp index.comp id: ASP

1,52024,158
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 158
entity comp index.auth seq id: 155
entity comp index.comp id: ALA

1,52024,159
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 159
entity comp index.auth seq id: 156
entity comp index.comp id: PHE

1,52024,160
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 160
entity comp index.auth seq id: 157
entity comp index.comp id: TYR

1,52024,161
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 161
entity comp index.auth seq id: 158
entity comp index.comp id: THR

1,52024,162
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 162
entity comp index.auth seq id: 159
entity comp index.comp id: LEU

1,52024,163
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 163
entity comp index.auth seq id: 160
entity comp index.comp id: VAL

1,52024,164
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 164
entity comp index.auth seq id: 161
entity comp index.comp id: ARG

1,52024,165
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 165
entity comp index.auth seq id: 162
entity comp index.comp id: GLU

1,52024,166
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 166
entity comp index.auth seq id: 163
entity comp index.comp id: ILE

1,52024,167
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 167
entity comp index.auth seq id: 164
entity comp index.comp id: ARG

1,52024,168
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 168
entity comp index.auth seq id: 165
entity comp index.comp id: LYS

1,52024,169
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 169
entity comp index.auth seq id: 166
entity comp index.comp id: HIS

1,52024,170
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 170
entity comp index.auth seq id: 167
entity comp index.comp id: LYS

1,52024,171
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
entity comp index.id: 171
entity comp index.auth seq id: 168
entity comp index.comp id: GLU

1,52024,172
type: entity comp index
of datablock: info:bmrb/52024
entity comp index.entity id: 1
entity comp index.entry id: 52024
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2,52024,173
type: entity comp index
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3,52024,174
type: entity comp index
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1,52024,1
type: entity experimental src
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entity experimental src.entity experimental src list id: 1
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entity experimental src.entity id: 1
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entity experimental src.host org name common: E. coli
entity experimental src.host org ncbi taxonomy id: 562
entity experimental src.host org scientific name: Escherichia coli
entity experimental src.host org species: coli
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entity experimental src.vector type: plasmid

info:taxonomy/562

taxonomy:562

52024,1
type: entity experimental src list
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type: entity natural src
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entity natural src.entity chimera segment id: 0
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entity natural src.genus: Homo
entity natural src.kingdom: Metazoa
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entity natural src.organism name common: human
entity natural src.organism name scientific: Homo sapiens
entity natural src.species: sapiens
entity natural src.superkingdom: Eukaryota
entity natural src.type: organism

info:taxonomy/9606

taxonomy:9606

52024,1
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type: entity poly seq
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type: entity poly seq
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type: entity poly seq
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1,52024,42
type: entity poly seq
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1,52024,47
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1,52024,48
type: entity poly seq
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http://bmrbpub.pdbj.org/rdf/bmr52024/entry/52024
type: entry
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entry.id: 52024
entry.accession date: 2023-07-09Z
entry.assigned pdb deposition code: <!DOCTYPE html PUBLIC -//W3C//DTD XHTML 1.0 Strict//EN
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2023-07-10Z
entry.nmr star version: 3.2.14.0
entry.original nmr star version: 3.1
entry.original release date: 2023-07-10Z
entry.origination: author
entry.sf category: entry_information
entry.sf framecode: entry_information_1
entry.submission date: 2023-07-09Z
entry.title: Backbone 1H, 15N and 13C chemical shift assignments for the G-domain of human K-Ras4B(1-169) G12C mutant bound to GTP at physiological pH
entry.type: macromolecule
entry.version type: original

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experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D HN(CO)CA
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

52024,1,5
type: experiment
of datablock: info:bmrb/52024
experiment.entry id: 52024
experiment.experiment list id: 1
experiment.id: 5
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D HNCACB
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

52024,1,6
type: experiment
of datablock: info:bmrb/52024
experiment.entry id: 52024
experiment.experiment list id: 1
experiment.id: 6
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D CBCA(CO)NH
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

52024,1,7
type: experiment
of datablock: info:bmrb/52024
experiment.entry id: 52024
experiment.experiment list id: 1
experiment.id: 7
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
experiment.emr instrument id: 0
experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D 15N-separated NOESY
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

52024,1,8
type: experiment
of datablock: info:bmrb/52024
experiment.entry id: 52024
experiment.experiment list id: 1
experiment.id: 8
experiment.chromatographic column id: 0
experiment.chromatographic system id: 0
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experiment.fluorescence instrument id: 0
experiment.mass spectrometer id: 0
experiment.name: 3D 15N-separated NOESY
experiment.nmr spectrometer id: 1
experiment.nmr spectrometer label: NMR_spectrometer_1
experiment.nmr spectrometer probe id: 0
experiment.raw data flag: no
experiment.sample condition list id: 1
experiment.sample condition list label: sample_conditions_1
experiment.sample id: 1
experiment.sample label: sample_1
experiment.sample state: isotropic

52024,1
type: experiment list
of datablock: info:bmrb/52024
reference to entry: entry
experiment list.entry id: 52024
experiment list.id: 1
experiment list.sf category: experiment_list
experiment list.sf framecode: experiment_list_1

52024,1
type: nmr spectrometer
of datablock: info:bmrb/52024
reference to entry: entry
nmr spectrometer.entry id: 52024
nmr spectrometer.id: 1
nmr spectrometer.field strength: 850
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: AVANCE III
nmr spectrometer.name: Bruker Avance III 850 MHz
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: NMR_spectrometer_1

52021,BMRB,52024
type: related entries
of datablock: info:bmrb/52024
reference to entry: entry
related entries.database accession code: 52021
related entries.database name: BMRB
related entries.entry id: 52024
related entries.relationship: G-domain of wildtype human K-Ras4B(1-169) bound to GTP

info:bmrb/52021

52023,BMRB,52024
type: related entries
of datablock: info:bmrb/52024
reference to entry: entry
related entries.database accession code: 52023
related entries.database name: BMRB
related entries.entry id: 52024
related entries.relationship: G-domain of human K-Ras4B(1-169) G12D mutant bound to GTP

info:bmrb/52023

52024,2
type: release
of datablock: info:bmrb/52024
reference to entry: entry
release.entry id: 52024
release.release number: 2
release.author: BMRB
release.date: 2023-10-30Z
release.detail: update entry citation
release.submission date: 2023-07-09Z
release.type: update

52024,1
type: release
of datablock: info:bmrb/52024
reference to entry: entry
release.entry id: 52024
release.release number: 1
release.author: author
release.date: 2023-08-21Z
release.detail: original release
release.submission date: 2023-07-09Z
release.type: original

52024,1
type: sample
of datablock: info:bmrb/52024
reference to entry: entry
sample.entry id: 52024
sample.id: 1
sample.aggregate sample number: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.name: 13C 15N sample
sample.sf category: sample
sample.sf framecode: sample_1
sample.solvent system: 95% H2O/5% D2O
sample.type: solution

52024,1,1
type: sample component
of datablock: info:bmrb/52024
sample component.entry id: 52024
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 650
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: [U-100% 13C; U-100% 15N]
sample component.mol common name: K-Ras G12C mutant

52024,2,1
type: sample component
of datablock: info:bmrb/52024
sample component.entry id: 52024
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 10
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: GUANOSINE-5'-TRIPHOSPHATE

52024,3,1
type: sample component
of datablock: info:bmrb/52024
sample component.entry id: 52024
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 5
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: Magnesium ion

52024,1
type: sample condition list
of datablock: info:bmrb/52024
reference to entry: entry
sample condition list.entry id: 52024
sample condition list.id: 1
sample condition list.name: _Sample_condition_list.1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

52024,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/52024
sample condition variable.entry id: 52024
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 30
sample condition variable.val units: mM

52024,1,pH
type: sample condition variable
of datablock: info:bmrb/52024
sample condition variable.entry id: 52024
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 7.0
sample condition variable.val units: pH

52024,1,pressure
type: sample condition variable
of datablock: info:bmrb/52024
sample condition variable.entry id: 52024
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

52024,1,temperature
type: sample condition variable
of datablock: info:bmrb/52024
sample condition variable.entry id: 52024
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 288
sample condition variable.val units: K

52024,1
type: software
of datablock: info:bmrb/52024
reference to entry: entry
software.entry id: 52024
software.id: 1
software.name: TOPSPIN
software.sf category: software
software.sf framecode: software_1

52024,2
type: software
of datablock: info:bmrb/52024
reference to entry: entry
software.entry id: 52024
software.id: 2
software.name: NMRPipe
software.sf category: software
software.sf framecode: software_2

52024,3
type: software
of datablock: info:bmrb/52024
reference to entry: entry
software.entry id: 52024
software.id: 3
software.name: NMRViewJ
software.sf category: software
software.sf framecode: software_3

52024,1,collection
type: task
of datablock: info:bmrb/52024
task.entry id: 52024
task.software id: 1
task.task: collection

52024,3,data analysis
type: task
of datablock: info:bmrb/52024
task.entry id: 52024
task.software id: 3
task.task: data analysis

52024,2,processing
type: task
of datablock: info:bmrb/52024
task.entry id: 52024
task.software id: 2
task.task: processing