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type: datablock
references: doi:10.13018/BMR19435
alternative label: bmr19435
title: Structural studies on dinuclear ruthenium(II) complexes that bind diastereoselectively to an anti-parallel folded human telomere sequence
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atom chem shift.comp id: DG
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 5.05
atom chem shift.val err: 0.03

1,19435,32
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 32
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DG
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 4.46
atom chem shift.val err: 0.03

1,19435,33
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 33
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.comp id: DG
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 4.23
atom chem shift.val err: 0.03

1,19435,34
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 34
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: DG
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 4.17
atom chem shift.val err: 0.03

1,19435,35
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 35
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DG
atom chem shift.comp index id: 4
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 4
atom chem shift.val: 7.98
atom chem shift.val err: 0.03

1,19435,36
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 36
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 6.35
atom chem shift.val err: 0.03

1,19435,37
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 37
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.55
atom chem shift.val err: 0.03

1,19435,38
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 38
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 2.55
atom chem shift.val err: 0.03

1,19435,39
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 39
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
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atom chem shift.comp id: DT
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 4.85
atom chem shift.val err: 0.03

1,19435,40
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 40
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 4.23
atom chem shift.val err: 0.03

1,19435,41
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 41
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 4.14
atom chem shift.val err: 0.03

1,19435,42
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 42
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 4.14
atom chem shift.val err: 0.03

1,19435,43
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 43
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 7.62
atom chem shift.val err: 0.03

1,19435,44
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 44
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 5
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 1.93
atom chem shift.val err: 0.03

1,19435,45
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 45
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 5
atom chem shift.val: 1.93
atom chem shift.val err: 0.03

1,19435,46
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.ambiguity code: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 5
atom chem shift.val: 1.93
atom chem shift.val err: 0.03

1,19435,47
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 47
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 4.62
atom chem shift.val err: 0.03

1,19435,48
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 48
atom chem shift.ambiguity code: 2
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 1.13
atom chem shift.val err: 0.03

1,19435,49
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 49
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DT
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 1.26
atom chem shift.val err: 0.03

1,19435,50
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 50
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atom chem shift.comp id: DT
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 4.46
atom chem shift.val err: 0.03

1,19435,51
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 51
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DT
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 4.10
atom chem shift.val err: 0.03

1,19435,52
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 52
atom chem shift.ambiguity code: 2
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 4.02
atom chem shift.val err: 0.03

1,19435,53
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 7.16
atom chem shift.val err: 0.03

1,19435,54
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 54
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atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 6
atom chem shift.val: 1.90
atom chem shift.val err: 0.03

1,19435,55
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 55
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atom chem shift.comp id: DT
atom chem shift.comp index id: 6
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 6
atom chem shift.val: 1.90
atom chem shift.val err: 0.03

1,19435,56
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 56
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.90
atom chem shift.val err: 0.03

1,19435,57
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DA
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 6.20
atom chem shift.val err: 0.03

1,19435,58
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 58
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DA
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 2.53
atom chem shift.val err: 0.03

1,19435,59
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 59
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DA
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 2.66
atom chem shift.val err: 0.03

1,19435,60
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 60
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DA
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 4.59
atom chem shift.val err: 0.03

1,19435,61
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 61
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DA
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 4.58
atom chem shift.val err: 0.03

1,19435,62
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 62
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: DA
atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 7
atom chem shift.val: 3.26
atom chem shift.val err: 0.03

1,19435,63
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.comp index id: 7
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 7
atom chem shift.val: 8.11
atom chem shift.val err: 0.03

1,19435,64
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 64
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 11.97
atom chem shift.val err: 0.03

1,19435,65
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.seq id: 8
atom chem shift.val: 5.95
atom chem shift.val err: 0.03

1,19435,66
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 66
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2'
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atom chem shift.atom type: H
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 8
atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 3.08
atom chem shift.val err: 0.03

1,19435,67
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 67
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2''
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atom chem shift.atom type: H
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atom chem shift.auth atom id: H2''
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 8
atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 2.51
atom chem shift.val err: 0.03

1,19435,68
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 68
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H3'
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atom chem shift.atom type: H
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atom chem shift.auth seq id: 8
atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 4.86
atom chem shift.val err: 0.03

1,19435,69
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 69
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H4'
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atom chem shift.atom type: H
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atom chem shift.auth seq id: 8
atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 4.43
atom chem shift.val err: 0.03

1,19435,70
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 70
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 4.18
atom chem shift.val err: 0.03

1,19435,71
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 71
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 8
atom chem shift.comp id: DG
atom chem shift.comp index id: 8
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 8
atom chem shift.val: 7.29
atom chem shift.val err: 0.03

1,19435,72
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 72
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
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: 11.69
atom chem shift.val err: 0.03

1,19435,73
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 73
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1'
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atom chem shift.atom type: H
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
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: 5.59
atom chem shift.val err: 0.03

1,19435,74
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 74
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2'
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atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 2.96
atom chem shift.val err: 0.03

1,19435,75
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 75
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2''
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atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2''
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 2.63
atom chem shift.val err: 0.03

1,19435,76
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 76
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H3'
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atom chem shift.atom type: H
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
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: 5.22
atom chem shift.val err: 0.03

1,19435,77
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 77
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
atom chem shift.comp index id: 9
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 9
atom chem shift.val: 4.44
atom chem shift.val err: 0.03

1,19435,78
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 78
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 9
atom chem shift.comp id: DG
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: 8.41
atom chem shift.val err: 0.03

1,19435,79
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 79
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
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atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
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: 11.09
atom chem shift.val err: 0.03

1,19435,80
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 80
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
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: 6.32
atom chem shift.val err: 0.03

1,19435,81
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 81
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2'
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atom chem shift.atom type: H
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
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: 2.68
atom chem shift.val err: 0.03

1,19435,82
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 82
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2''
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
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: 2.68
atom chem shift.val err: 0.03

1,19435,83
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 83
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
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: 5.41
atom chem shift.val err: 0.03

1,19435,84
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 84
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 4.29
atom chem shift.val err: 0.03

1,19435,85
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 85
atom chem shift.ambiguity code: 2
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 4.07
atom chem shift.val err: 0.03

1,19435,86
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 86
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DG
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 4.39
atom chem shift.val err: 0.03

1,19435,87
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 87
atom chem shift.ambiguity code: 1
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atom chem shift.auth seq id: 10
atom chem shift.comp id: DG
atom chem shift.comp index id: 10
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 10
atom chem shift.val: 7.90
atom chem shift.val err: 0.03

1,19435,88
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 88
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
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: 5.65
atom chem shift.val err: 0.03

1,19435,89
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 89
atom chem shift.ambiguity code: 2
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atom chem shift.auth seq id: 11
atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 2.13
atom chem shift.val err: 0.03

1,19435,90
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 90
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 2.24
atom chem shift.val err: 0.03

1,19435,91
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 91
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 4.50
atom chem shift.val err: 0.03

1,19435,92
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 92
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 4.22
atom chem shift.val err: 0.03

1,19435,93
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 93
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 4.13
atom chem shift.val err: 0.03

1,19435,94
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 94
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 4.06
atom chem shift.val err: 0.03

1,19435,95
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 95
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 11
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 11
atom chem shift.val: 7.68
atom chem shift.val err: 0.03

1,19435,96
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 96
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
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: 1.91
atom chem shift.val err: 0.03

1,19435,97
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 97
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atom chem shift.comp id: DT
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: 1.91
atom chem shift.val err: 0.03

1,19435,98
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 98
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atom chem shift.comp id: DT
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: 1.91
atom chem shift.val err: 0.03

1,19435,99
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 99
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
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: 5.56
atom chem shift.val err: 0.03

1,19435,100
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DT
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.15
atom chem shift.val err: 0.03

1,19435,101
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 101
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DT
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 12
atom chem shift.val: 1.33
atom chem shift.val err: 0.03

1,19435,102
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 102
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
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: 3.79
atom chem shift.val err: 0.03

1,19435,103
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 103
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atom chem shift.comp id: DT
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: 3.64
atom chem shift.val err: 0.03

1,19435,104
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 104
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atom chem shift.comp id: DT
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: 3.45
atom chem shift.val err: 0.03

1,19435,105
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 105
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.46
atom chem shift.val err: 0.03

1,19435,106
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.comp id: DT
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: 7.00
atom chem shift.val err: 0.03

1,19435,107
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 107
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atom chem shift.comp id: DT
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 12
atom chem shift.val: 1.51
atom chem shift.val err: 0.03

1,19435,108
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 108
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.51
atom chem shift.val err: 0.03

1,19435,109
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 109
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DT
atom chem shift.comp index id: 12
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 12
atom chem shift.val: 1.51
atom chem shift.val err: 0.03

1,19435,110
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 110
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DA
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.88
atom chem shift.val err: 0.03

1,19435,111
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 111
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DA
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 13
atom chem shift.val: 2.66
atom chem shift.val err: 0.03

1,19435,112
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 112
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DA
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.60
atom chem shift.val err: 0.03

1,19435,113
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.comp id: DA
atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 13
atom chem shift.val: 4.74
atom chem shift.val err: 0.03

1,19435,114
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 114
atom chem shift.ambiguity code: 2
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.75
atom chem shift.val err: 0.03

1,19435,115
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 115
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.57
atom chem shift.val err: 0.03

1,19435,116
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 116
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atom chem shift.comp index id: 13
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 13
atom chem shift.val: 7.92
atom chem shift.val err: 0.03

1,19435,117
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 10.85
atom chem shift.val err: 0.03

1,19435,118
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 6.38
atom chem shift.val err: 0.03

1,19435,119
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.74
atom chem shift.val err: 0.03

1,19435,120
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.88
atom chem shift.val err: 0.03

1,19435,121
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.04
atom chem shift.val err: 0.03

1,19435,122
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.54
atom chem shift.val err: 0.03

1,19435,123
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.01
atom chem shift.val err: 0.03

1,19435,124
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.13
atom chem shift.val err: 0.03

1,19435,125
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 8.02
atom chem shift.val err: 0.03

1,19435,126
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 15
atom chem shift.val: 11.17
atom chem shift.val err: 0.03

1,19435,127
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.comp id: DG
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.98
atom chem shift.val err: 0.03

1,19435,128
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.val: 3.41
atom chem shift.val err: 0.03

1,19435,129
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.77
atom chem shift.val err: 0.03

1,19435,130
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.17
atom chem shift.val err: 0.03

1,19435,131
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.val err: 0.03

1,19435,132
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.val err: 0.03

1,19435,133
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.val err: 0.03

1,19435,134
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.comp id: DG
atom chem shift.comp index id: 15
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 15
atom chem shift.val: 7.24
atom chem shift.val err: 0.03

1,19435,135
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 135
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: DG
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 16
atom chem shift.val: 11.39
atom chem shift.val err: 0.03

1,19435,136
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 136
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atom chem shift.comp id: DG
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 16
atom chem shift.val: 5.95
atom chem shift.val err: 0.03

1,19435,137
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 137
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: DG
atom chem shift.comp index id: 16
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 16
atom chem shift.val: 2.68
atom chem shift.val err: 0.03

1,19435,138
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 138
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atom chem shift.val: 2.68
atom chem shift.val err: 0.03

1,19435,139
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.val: 5.25
atom chem shift.val err: 0.03

1,19435,140
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.val: 4.26
atom chem shift.val err: 0.03

1,19435,141
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.38
atom chem shift.val err: 0.03

1,19435,142
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.47
atom chem shift.val err: 0.03

1,19435,143
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 17
atom chem shift.val: 6.48
atom chem shift.val err: 0.03

1,19435,144
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 144
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.48
atom chem shift.val err: 0.03

1,19435,145
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 2.60
atom chem shift.val err: 0.03

1,19435,146
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 5.06
atom chem shift.val err: 0.03

1,19435,147
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.57
atom chem shift.val err: 0.03

1,19435,148
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 4.27
atom chem shift.val err: 0.03

1,19435,149
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.03

1,19435,150
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 7.99
atom chem shift.val err: 0.03

1,19435,151
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.03

1,19435,152
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.03

1,19435,153
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.03

1,19435,154
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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1,19435,155
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,156
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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1,19435,157
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.val err: 0.03

1,19435,158
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val err: 0.03

1,19435,159
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,160
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,161
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.val err: 0.03

1,19435,162
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,163
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,164
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.val err: 0.03

1,19435,165
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,166
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,167
type: atom chem shift
of datablock: info:bmrb/19435
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1,19435,168
type: atom chem shift
of datablock: info:bmrb/19435
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atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H3'
atom chem shift.auth comp id: DA
atom chem shift.auth seq id: 19
atom chem shift.comp id: DA
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: 5.13
atom chem shift.val err: 0.03

1,19435,169
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 169
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H4'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H4'
atom chem shift.auth comp id: DA
atom chem shift.auth seq id: 19
atom chem shift.comp id: DA
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 4.46
atom chem shift.val err: 0.03

1,19435,170
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 170
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H5'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H5'
atom chem shift.auth comp id: DA
atom chem shift.auth seq id: 19
atom chem shift.comp id: DA
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.82
atom chem shift.val err: 0.03

1,19435,171
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 171
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H5''
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H5''
atom chem shift.auth comp id: DA
atom chem shift.auth seq id: 19
atom chem shift.comp id: DA
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 4.06
atom chem shift.val err: 0.03

1,19435,172
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 172
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H8
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H8
atom chem shift.auth comp id: DA
atom chem shift.auth seq id: 19
atom chem shift.comp id: DA
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: 8.46
atom chem shift.val err: 0.03

1,19435,173
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 173
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H1
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
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: 11.28
atom chem shift.val err: 0.03

1,19435,174
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 174
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H1'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
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: 6.09
atom chem shift.val err: 0.03

1,19435,175
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 175
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 3.49
atom chem shift.val err: 0.03

1,19435,176
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 176
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2''
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2''
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
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: 2.93
atom chem shift.val err: 0.03

1,19435,177
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 177
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H3'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H3'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
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: 5.06
atom chem shift.val err: 0.03

1,19435,178
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 178
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H4'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H4'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 4.48
atom chem shift.val err: 0.03

1,19435,179
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 179
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H5'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H5'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 4.33
atom chem shift.val err: 0.03

1,19435,180
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 180
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H8
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H8
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 20
atom chem shift.comp id: DG
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: 7.38
atom chem shift.val err: 0.03

1,19435,181
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 181
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H1
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
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: 11.30
atom chem shift.val err: 0.03

1,19435,182
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 182
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H1'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
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: 6.22
atom chem shift.val err: 0.03

1,19435,183
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 183
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
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: 2.57
atom chem shift.val err: 0.03

1,19435,184
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 184
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2''
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2''
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
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: 2.73
atom chem shift.val err: 0.03

1,19435,185
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 185
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H3'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H3'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
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: 5.06
atom chem shift.val err: 0.03

1,19435,186
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 186
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H4'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H4'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 4.47
atom chem shift.val err: 0.03

1,19435,187
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 187
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H8
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H8
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 21
atom chem shift.comp id: DG
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 21
atom chem shift.val: 7.47
atom chem shift.val err: 0.03

1,19435,188
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 188
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H1
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
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: 11.00
atom chem shift.val err: 0.03

1,19435,189
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 189
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H1'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H1'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
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: 6.34
atom chem shift.val err: 0.03

1,19435,190
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 190
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 3.32
atom chem shift.val err: 0.03

1,19435,191
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 191
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H2''
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H2''
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 2.41
atom chem shift.val err: 0.03

1,19435,192
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 192
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H3'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H3'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.75
atom chem shift.val err: 0.03

1,19435,193
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 193
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H4'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H4'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.35
atom chem shift.val err: 0.03

1,19435,194
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 194
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H5'
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H5'
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.39
atom chem shift.val err: 0.03

1,19435,195
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 195
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H5''
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H5''
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 4.10
atom chem shift.val err: 0.03

1,19435,196
type: atom chem shift
of datablock: info:bmrb/19435
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 19435
atom chem shift.id: 196
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H8
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth asym id: A
atom chem shift.auth atom id: H8
atom chem shift.auth comp id: DG
atom chem shift.auth seq id: 22
atom chem shift.comp id: DG
atom chem shift.comp index id: 22
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 22
atom chem shift.val: 7.92
atom chem shift.val err: 0.03

19435,RUL
type: chem comp
of datablock: info:bmrb/19435
reference to entry: entry
chem comp.entry id: 19435
chem comp.id: RUL
chem comp.ambiguous flag: no
chem comp.aromatic: yes
chem comp.formal charge: 4+
chem comp.formula: C64 H44 N14 Ru2
chem comp.formula weight: 1211.268
chem comp.ideal coordinates details: Corina
chem comp.ideal coordinates missing flag: yes
chem comp.inchi code: InChI=1S/C24H12N6.4C10H8N2.2Ru/c1-5-13-17(25-9-1)18-14(6-2-10-26-18)22-21(13)29-23-15-7-3-11-27-19(15)20-16(24(23)30-22)8-4-12-28-20;4*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;/h1-12H;4*1-8H;;/q;;;;;2*+2
chem comp.initial date: 2013-09-09Z
chem comp.model coordinates db code: 2MCC
chem comp.model coordinates missing flag: no
chem comp.modified date: 2013-09-09Z
chem comp.name: tetrakis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)(mu-tetrapyrido[3,2-a:2',3'-c:3'',2''-h:2''',3'''-j]phenazine-1kappa~2~N~4~,N~5~:2kappa~2~N~13~,N~14~)diruthenium(4+)
chem comp.number atoms all: 124
chem comp.number atoms nh: 80
chem comp.pdb code: RUL
chem comp.processing site: RCSB
chem comp.provenance: PDB
chem comp.release status: HOLD
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_RUL
chem comp.three letter code: RUL
chem comp.type: NON-POLYMER

info:pdb-ccd/RUL

pdb-ccd:RUL

info:pdb.ligand/RUL

pdb.ligand:RUL

RU3,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: RU3
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: RU3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: RU3
chem comp atom.charge: 2
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.612
chem comp atom.model cartn y: -5.236
chem comp atom.model cartn z: 4.873
chem comp atom.pdb atom id: RU3
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: RU

RU4,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: RU4
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: RU4
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: RU4
chem comp atom.charge: 2
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.390
chem comp atom.model cartn y: -7.817
chem comp atom.model cartn z: -7.167
chem comp atom.pdb atom id: RU4
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: N
chem comp atom.type symbol: RU

N15,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N15
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N15
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N15
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.913
chem comp atom.model cartn y: -5.075
chem comp atom.model cartn z: 3.823
chem comp atom.pdb atom id: N15
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C65,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C65
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C65
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C65
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.632
chem comp atom.model cartn y: -5.334
chem comp atom.model cartn z: 4.283
chem comp atom.pdb atom id: C65
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C66,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C66
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C66
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C66
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.435
chem comp atom.model cartn y: -5.705
chem comp atom.model cartn z: 3.414
chem comp atom.pdb atom id: C66
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C67,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C67
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C67
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C67
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.183
chem comp atom.model cartn y: -5.851
chem comp atom.model cartn z: 2.005
chem comp atom.pdb atom id: C67
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C68,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C68
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C68
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C68
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.126
chem comp atom.model cartn y: -5.485
chem comp atom.model cartn z: 1.495
chem comp atom.pdb atom id: C68
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C69,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C69
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C69
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C69
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.165
chem comp atom.model cartn y: -5.194
chem comp atom.model cartn z: 2.444
chem comp atom.pdb atom id: C69
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C70,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C70
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C70
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C70
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.491
chem comp atom.model cartn y: -5.405
chem comp atom.model cartn z: 0.083
chem comp atom.pdb atom id: C70
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N16,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N16
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N16
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N16
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.526
chem comp atom.model cartn y: -5.635
chem comp atom.model cartn z: -0.896
chem comp atom.pdb atom id: N16
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N17,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N17
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N17
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N17
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.413
chem comp atom.model cartn y: -4.747
chem comp atom.model cartn z: 3.101
chem comp atom.pdb atom id: N17
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C71,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C71
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C71
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C71
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.774
chem comp atom.model cartn y: -4.728
chem comp atom.model cartn z: 2.800
chem comp atom.pdb atom id: C71
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C72,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C72
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C72
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C72
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -6.281
chem comp atom.model cartn y: -4.922
chem comp atom.model cartn z: 1.490
chem comp atom.pdb atom id: C72
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C73,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C73
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C73
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C73
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.342
chem comp atom.model cartn y: -5.194
chem comp atom.model cartn z: 0.437
chem comp atom.pdb atom id: C73
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C74,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C74
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C74
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C74
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.921
chem comp atom.model cartn y: -5.150
chem comp atom.model cartn z: 0.687
chem comp atom.pdb atom id: C74
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C75,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C75
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C75
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C75
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.517
chem comp atom.model cartn y: -5.026
chem comp atom.model cartn z: 2.053
chem comp atom.pdb atom id: C75
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C76,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C76
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C76
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C76
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.883
chem comp atom.model cartn y: -5.257
chem comp atom.model cartn z: -0.334
chem comp atom.pdb atom id: C76
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N18,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N18
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N18
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N18
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.237
chem comp atom.model cartn y: -5.387
chem comp atom.model cartn z: -1.699
chem comp atom.pdb atom id: N18
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N19,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N19
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N19
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N19
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.460
chem comp atom.model cartn y: -5.538
chem comp atom.model cartn z: 5.785
chem comp atom.pdb atom id: N19
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C77,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C77
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C77
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C77
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.878
chem comp atom.model cartn y: -4.960
chem comp atom.model cartn z: 6.927
chem comp atom.pdb atom id: C77
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C78,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C78
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C78
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C78
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -7.239
chem comp atom.model cartn y: -5.192
chem comp atom.model cartn z: 7.399
chem comp atom.pdb atom id: C78
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C79,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C79
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C79
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C79
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -7.971
chem comp atom.model cartn y: -6.063
chem comp atom.model cartn z: 6.660
chem comp atom.pdb atom id: C79
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C80,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C80
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C80
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C80
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -7.487
chem comp atom.model cartn y: -6.874
chem comp atom.model cartn z: 5.611
chem comp atom.pdb atom id: C80
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C81,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C81
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C81
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C81
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -6.068
chem comp atom.model cartn y: -6.691
chem comp atom.model cartn z: 5.302
chem comp atom.pdb atom id: C81
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N20,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N20
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N20
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N20
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.951
chem comp atom.model cartn y: -7.149
chem comp atom.model cartn z: 4.363
chem comp atom.pdb atom id: N20
chem comp atom.pdbx ordinal: 25
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C82,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C82
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C82
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C82
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.052
chem comp atom.model cartn y: -7.959
chem comp atom.model cartn z: 3.693
chem comp atom.pdb atom id: C82
chem comp atom.pdbx ordinal: 26
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C83,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C83
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C83
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C83
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.450
chem comp atom.model cartn y: -9.283
chem comp atom.model cartn z: 3.218
chem comp atom.pdb atom id: C83
chem comp atom.pdbx ordinal: 27
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C84,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C84
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C84
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C84
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.732
chem comp atom.model cartn y: -9.673
chem comp atom.model cartn z: 3.502
chem comp atom.pdb atom id: C84
chem comp atom.pdbx ordinal: 28
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C85,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C85
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C85
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C85
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.673
chem comp atom.model cartn y: -8.923
chem comp atom.model cartn z: 4.135
chem comp atom.pdb atom id: C85
chem comp atom.pdbx ordinal: 29
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C86,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C86
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C86
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C86
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.262
chem comp atom.model cartn y: -7.599
chem comp atom.model cartn z: 4.601
chem comp atom.pdb atom id: C86
chem comp atom.pdbx ordinal: 30
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N21,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N21
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N21
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N21
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.484
chem comp atom.model cartn y: -3.385
chem comp atom.model cartn z: 5.675
chem comp atom.pdb atom id: N21
chem comp atom.pdbx ordinal: 31
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C87,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C87
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C87
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C87
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.543
chem comp atom.model cartn y: -2.463
chem comp atom.model cartn z: 5.553
chem comp atom.pdb atom id: C87
chem comp atom.pdbx ordinal: 32
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C88,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C88
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C88
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C88
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.874
chem comp atom.model cartn y: -1.558
chem comp atom.model cartn z: 6.573
chem comp atom.pdb atom id: C88
chem comp atom.pdbx ordinal: 33
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C89,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C89
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C89
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C89
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.907
chem comp atom.model cartn y: -1.346
chem comp atom.model cartn z: 7.570
chem comp atom.pdb atom id: C89
chem comp atom.pdbx ordinal: 34
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C90,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C90
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C90
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C90
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.795
chem comp atom.model cartn y: -2.172
chem comp atom.model cartn z: 7.752
chem comp atom.pdb atom id: C90
chem comp atom.pdbx ordinal: 35
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C91,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C91
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C91
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C91
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.729
chem comp atom.model cartn y: -3.345
chem comp atom.model cartn z: 6.943
chem comp atom.pdb atom id: C91
chem comp atom.pdbx ordinal: 36
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N22,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N22
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N22
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N22
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.675
chem comp atom.model cartn y: -5.650
chem comp atom.model cartn z: 6.679
chem comp atom.pdb atom id: N22
chem comp atom.pdbx ordinal: 37
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C92,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C92
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C92
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C92
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.437
chem comp atom.model cartn y: -6.961
chem comp atom.model cartn z: 7.148
chem comp atom.pdb atom id: C92
chem comp atom.pdbx ordinal: 38
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C93,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C93
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C93
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C93
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.391
chem comp atom.model cartn y: -7.185
chem comp atom.model cartn z: 8.146
chem comp atom.pdb atom id: C93
chem comp atom.pdbx ordinal: 39
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C94,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C94
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C94
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C94
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.716
chem comp atom.model cartn y: -6.096
chem comp atom.model cartn z: 8.549
chem comp atom.pdb atom id: C94
chem comp atom.pdbx ordinal: 40
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C95,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C95
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C95
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C95
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.003
chem comp atom.model cartn y: -4.759
chem comp atom.model cartn z: 8.182
chem comp atom.pdb atom id: C95
chem comp atom.pdbx ordinal: 41
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C96,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C96
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C96
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C96
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.112
chem comp atom.model cartn y: -4.594
chem comp atom.model cartn z: 7.263
chem comp atom.pdb atom id: C96
chem comp atom.pdbx ordinal: 42
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N23,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N23
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N23
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N23
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.603
chem comp atom.model cartn y: -7.078
chem comp atom.model cartn z: -5.574
chem comp atom.pdb atom id: N23
chem comp atom.pdbx ordinal: 43
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C97,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C97
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C97
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C97
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.917
chem comp atom.model cartn y: -7.368
chem comp atom.model cartn z: -5.184
chem comp atom.pdb atom id: C97
chem comp atom.pdbx ordinal: 44
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C98,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C98
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C98
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C98
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 2.376
chem comp atom.model cartn y: -7.251
chem comp atom.model cartn z: -3.840
chem comp atom.pdb atom id: C98
chem comp atom.pdbx ordinal: 45
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C99,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C99
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: C99
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C99
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.481
chem comp atom.model cartn y: -6.901
chem comp atom.model cartn z: -2.829
chem comp atom.pdb atom id: C99
chem comp atom.pdbx ordinal: 46
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C100,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C100
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C100
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C100
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.117
chem comp atom.model cartn y: -6.529
chem comp atom.model cartn z: -3.161
chem comp atom.pdb atom id: C100
chem comp atom.pdbx ordinal: 47
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C101,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C101
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C101
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C101
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.313
chem comp atom.model cartn y: -6.720
chem comp atom.model cartn z: -4.517
chem comp atom.pdb atom id: C101
chem comp atom.pdbx ordinal: 48
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C102,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C102
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C102
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C102
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.900
chem comp atom.model cartn y: -5.968
chem comp atom.model cartn z: -2.226
chem comp atom.pdb atom id: C102
chem comp atom.pdbx ordinal: 49
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N24,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N24
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N24
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N24
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.975
chem comp atom.model cartn y: -6.772
chem comp atom.model cartn z: -6.281
chem comp atom.pdb atom id: N24
chem comp atom.pdbx ordinal: 50
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C103,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C103
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C103
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C103
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.329
chem comp atom.model cartn y: -6.827
chem comp atom.model cartn z: -6.659
chem comp atom.pdb atom id: C103
chem comp atom.pdbx ordinal: 51
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C104,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C104
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C104
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C104
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.401
chem comp atom.model cartn y: -6.600
chem comp atom.model cartn z: -5.742
chem comp atom.pdb atom id: C104
chem comp atom.pdbx ordinal: 52
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C105,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C105
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C105
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C105
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.084
chem comp atom.model cartn y: -6.399
chem comp atom.model cartn z: -4.351
chem comp atom.pdb atom id: C105
chem comp atom.pdbx ordinal: 53
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C106,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C106
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C106
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C106
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.681
chem comp atom.model cartn y: -6.270
chem comp atom.model cartn z: -3.956
chem comp atom.pdb atom id: C106
chem comp atom.pdbx ordinal: 54
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C107,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C107
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C107
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C107
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.715
chem comp atom.model cartn y: -6.566
chem comp atom.model cartn z: -4.886
chem comp atom.pdb atom id: C107
chem comp atom.pdbx ordinal: 55
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C108,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C108
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C108
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C108
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.274
chem comp atom.model cartn y: -5.836
chem comp atom.model cartn z: -2.595
chem comp atom.pdb atom id: C108
chem comp atom.pdbx ordinal: 56
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N25,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N25
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N25
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N25
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.228
chem comp atom.model cartn y: -8.980
chem comp atom.model cartn z: -7.862
chem comp atom.pdb atom id: N25
chem comp atom.pdbx ordinal: 57
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C109,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C109
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C109
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C109
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.590
chem comp atom.model cartn y: -8.973
chem comp atom.model cartn z: -9.126
chem comp atom.pdb atom id: C109
chem comp atom.pdbx ordinal: 58
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C110,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C110
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C110
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C110
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 2.711
chem comp atom.model cartn y: -9.884
chem comp atom.model cartn z: -9.539
chem comp atom.pdb atom id: C110
chem comp atom.pdbx ordinal: 59
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C111,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C111
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C111
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C111
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.052
chem comp atom.model cartn y: -10.700
chem comp atom.model cartn z: -8.566
chem comp atom.pdb atom id: C111
chem comp atom.pdbx ordinal: 60
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C112,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C112
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C112
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C112
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 2.712
chem comp atom.model cartn y: -10.870
chem comp atom.model cartn z: -7.352
chem comp atom.pdb atom id: C112
chem comp atom.pdbx ordinal: 61
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C113,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C113
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C113
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C113
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.427
chem comp atom.model cartn y: -9.976
chem comp atom.model cartn z: -7.014
chem comp atom.pdb atom id: C113
chem comp atom.pdbx ordinal: 62
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N26,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N26
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N26
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N26
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.677
chem comp atom.model cartn y: -9.513
chem comp atom.model cartn z: -6.143
chem comp atom.pdb atom id: N26
chem comp atom.pdbx ordinal: 63
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C114,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C114
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C114
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C114
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.721
chem comp atom.model cartn y: -9.764
chem comp atom.model cartn z: -5.439
chem comp atom.pdb atom id: C114
chem comp atom.pdbx ordinal: 64
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C115,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C115
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C115
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C115
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.617
chem comp atom.model cartn y: -10.784
chem comp atom.model cartn z: -4.349
chem comp atom.pdb atom id: C115
chem comp atom.pdbx ordinal: 65
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C116,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C116
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C116
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C116
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.245
chem comp atom.model cartn y: -11.307
chem comp atom.model cartn z: -4.179
chem comp atom.pdb atom id: C116
chem comp atom.pdbx ordinal: 66
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C117,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C117
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C117
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C117
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.721
chem comp atom.model cartn y: -11.063
chem comp atom.model cartn z: -4.968
chem comp atom.pdb atom id: C117
chem comp atom.pdbx ordinal: 67
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C118,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C118
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C118
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C118
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.642
chem comp atom.model cartn y: -10.222
chem comp atom.model cartn z: -6.090
chem comp atom.pdb atom id: C118
chem comp atom.pdbx ordinal: 68
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N27,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N27
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N27
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N27
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.508
chem comp atom.model cartn y: -8.469
chem comp atom.model cartn z: -8.799
chem comp atom.pdb atom id: N27
chem comp atom.pdbx ordinal: 69
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C119,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C119
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C119
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C119
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.155
chem comp atom.model cartn y: -9.703
chem comp atom.model cartn z: -8.796
chem comp atom.pdb atom id: C119
chem comp atom.pdbx ordinal: 70
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C120,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C120
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C120
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C120
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.333
chem comp atom.model cartn y: -9.870
chem comp atom.model cartn z: -9.710
chem comp atom.pdb atom id: C120
chem comp atom.pdbx ordinal: 71
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C121,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C121
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C121
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C121
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.593
chem comp atom.model cartn y: -8.871
chem comp atom.model cartn z: -10.498
chem comp atom.pdb atom id: C121
chem comp atom.pdbx ordinal: 72
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C122,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C122
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C122
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C122
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.902
chem comp atom.model cartn y: -7.632
chem comp atom.model cartn z: -10.579
chem comp atom.pdb atom id: C122
chem comp atom.pdbx ordinal: 73
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C123,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C123
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C123
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C123
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.748
chem comp atom.model cartn y: -7.526
chem comp atom.model cartn z: -9.680
chem comp atom.pdb atom id: C123
chem comp atom.pdbx ordinal: 74
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N28,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: N28
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: N28
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: N28
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.008
chem comp atom.model cartn y: -6.355
chem comp atom.model cartn z: -8.528
chem comp atom.pdb atom id: N28
chem comp atom.pdbx ordinal: 75
chem comp atom.stereo config: N
chem comp atom.type symbol: N

C124,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C124
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C124
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C124
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.333
chem comp atom.model cartn y: -5.856
chem comp atom.model cartn z: -8.789
chem comp atom.pdb atom id: C124
chem comp atom.pdbx ordinal: 76
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C125,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C125
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C125
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C125
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.654
chem comp atom.model cartn y: -5.115
chem comp atom.model cartn z: -9.856
chem comp atom.pdb atom id: C125
chem comp atom.pdbx ordinal: 77
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C126,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C126
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C126
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C126
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.674
chem comp atom.model cartn y: -5.028
chem comp atom.model cartn z: -10.994
chem comp atom.pdb atom id: C126
chem comp atom.pdbx ordinal: 78
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C127,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C127
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C127
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C127
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.599
chem comp atom.model cartn y: -5.629
chem comp atom.model cartn z: -10.830
chem comp atom.pdb atom id: C127
chem comp atom.pdbx ordinal: 79
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C128,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: C128
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 0
chem comp atom.alt atom id: C128
chem comp atom.aromatic flag: yes
chem comp atom.bmrb code: C128
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.839
chem comp atom.model cartn y: -6.432
chem comp atom.model cartn z: -9.761
chem comp atom.pdb atom id: C128
chem comp atom.pdbx ordinal: 80
chem comp atom.stereo config: N
chem comp atom.type symbol: C

H45,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H45
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H45
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H45
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.434
chem comp atom.model cartn y: -5.252
chem comp atom.model cartn z: 5.342
chem comp atom.pdb atom id: H45
chem comp atom.pdbx ordinal: 81
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H46,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H46
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H46
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H46
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.425
chem comp atom.model cartn y: -5.875
chem comp atom.model cartn z: 3.810
chem comp atom.pdb atom id: H46
chem comp atom.pdbx ordinal: 82
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H47,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H47
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H47
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H47
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.950
chem comp atom.model cartn y: -6.224
chem comp atom.model cartn z: 1.342
chem comp atom.pdb atom id: H47
chem comp atom.pdbx ordinal: 83
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H48,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H48
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H48
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H48
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -6.476
chem comp atom.model cartn y: -4.557
chem comp atom.model cartn z: 3.603
chem comp atom.pdb atom id: H48
chem comp atom.pdbx ordinal: 84
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H49,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H49
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H49
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H49
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -7.341
chem comp atom.model cartn y: -4.867
chem comp atom.model cartn z: 1.290
chem comp atom.pdb atom id: H49
chem comp atom.pdbx ordinal: 85
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H50,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H50
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H50
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H50
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.703
chem comp atom.model cartn y: -5.434
chem comp atom.model cartn z: -0.552
chem comp atom.pdb atom id: H50
chem comp atom.pdbx ordinal: 86
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H51,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H51
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H51
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H51
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.209
chem comp atom.model cartn y: -4.327
chem comp atom.model cartn z: 7.491
chem comp atom.pdb atom id: H51
chem comp atom.pdbx ordinal: 87
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H52,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H52
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H52
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H52
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -7.636
chem comp atom.model cartn y: -4.704
chem comp atom.model cartn z: 8.277
chem comp atom.pdb atom id: H52
chem comp atom.pdbx ordinal: 88
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H53,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H53
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H53
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H53
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -9.022
chem comp atom.model cartn y: -6.143
chem comp atom.model cartn z: 6.896
chem comp atom.pdb atom id: H53
chem comp atom.pdbx ordinal: 89
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H54,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H54
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H54
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H54
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -8.114
chem comp atom.model cartn y: -7.574
chem comp atom.model cartn z: 5.079
chem comp atom.pdb atom id: H54
chem comp atom.pdbx ordinal: 90
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H55,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H55
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H55
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H55
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.045
chem comp atom.model cartn y: -7.609
chem comp atom.model cartn z: 3.519
chem comp atom.pdb atom id: H55
chem comp atom.pdbx ordinal: 91
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H56,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H56
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H56
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H56
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.769
chem comp atom.model cartn y: -9.920
chem comp atom.model cartn z: 2.672
chem comp atom.pdb atom id: H56
chem comp atom.pdbx ordinal: 92
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H57,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H57
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H57
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H57
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.022
chem comp atom.model cartn y: -10.667
chem comp atom.model cartn z: 3.195
chem comp atom.pdb atom id: H57
chem comp atom.pdbx ordinal: 93
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H58,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H58
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H58
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H58
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -6.678
chem comp atom.model cartn y: -9.288
chem comp atom.model cartn z: 4.287
chem comp atom.pdb atom id: H58
chem comp atom.pdbx ordinal: 94
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H59,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H59
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H59
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H59
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.121
chem comp atom.model cartn y: -2.453
chem comp atom.model cartn z: 4.641
chem comp atom.pdb atom id: H59
chem comp atom.pdbx ordinal: 95
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H60,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H60
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H60
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H60
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.826
chem comp atom.model cartn y: -1.049
chem comp atom.model cartn z: 6.591
chem comp atom.pdb atom id: H60
chem comp atom.pdbx ordinal: 96
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H61,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H61
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H61
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H61
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.030
chem comp atom.model cartn y: -0.500
chem comp atom.model cartn z: 8.230
chem comp atom.pdb atom id: H61
chem comp atom.pdbx ordinal: 97
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H62,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H62
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H62
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H62
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.024
chem comp atom.model cartn y: -1.934
chem comp atom.model cartn z: 8.470
chem comp atom.pdb atom id: H62
chem comp atom.pdbx ordinal: 98
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H63,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H63
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H63
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H63
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.021
chem comp atom.model cartn y: -7.789
chem comp atom.model cartn z: 6.774
chem comp atom.pdb atom id: H63
chem comp atom.pdbx ordinal: 99
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H64,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H64
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H64
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H64
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.174
chem comp atom.model cartn y: -8.169
chem comp atom.model cartn z: 8.536
chem comp atom.pdb atom id: H64
chem comp atom.pdbx ordinal: 100
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H65,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H65
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H65
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H65
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.121
chem comp atom.model cartn y: -6.254
chem comp atom.model cartn z: 9.213
chem comp atom.pdb atom id: H65
chem comp atom.pdbx ordinal: 101
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H66,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H66
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H66
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H66
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.436
chem comp atom.model cartn y: -3.921
chem comp atom.model cartn z: 8.560
chem comp atom.pdb atom id: H66
chem comp atom.pdbx ordinal: 102
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H67,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H67
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H67
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H67
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 2.616
chem comp atom.model cartn y: -7.696
chem comp atom.model cartn z: -5.939
chem comp atom.pdb atom id: H67
chem comp atom.pdbx ordinal: 103
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H68,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H68
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H68
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H68
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.414
chem comp atom.model cartn y: -7.433
chem comp atom.model cartn z: -3.605
chem comp atom.pdb atom id: H68
chem comp atom.pdbx ordinal: 104
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H69,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H69
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H69
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H69
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.803
chem comp atom.model cartn y: -6.907
chem comp atom.model cartn z: -1.798
chem comp atom.pdb atom id: H69
chem comp atom.pdbx ordinal: 105
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H70,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H70
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H70
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H70
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.569
chem comp atom.model cartn y: -7.051
chem comp atom.model cartn z: -7.688
chem comp atom.pdb atom id: H70
chem comp atom.pdbx ordinal: 106
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H71,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H71
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H71
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H71
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -5.425
chem comp atom.model cartn y: -6.580
chem comp atom.model cartn z: -6.084
chem comp atom.pdb atom id: H71
chem comp atom.pdbx ordinal: 107
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H72,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H72
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H72
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H72
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.869
chem comp atom.model cartn y: -6.344
chem comp atom.model cartn z: -3.612
chem comp atom.pdb atom id: H72
chem comp atom.pdbx ordinal: 108
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H73,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H73
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H73
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H73
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.098
chem comp atom.model cartn y: -8.333
chem comp atom.model cartn z: -9.844
chem comp atom.pdb atom id: H73
chem comp atom.pdbx ordinal: 109
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H74,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H74
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H74
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H74
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.178
chem comp atom.model cartn y: -9.870
chem comp atom.model cartn z: -10.513
chem comp atom.pdb atom id: H74
chem comp atom.pdbx ordinal: 110
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H75,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H75
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H75
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H75
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.812
chem comp atom.model cartn y: -11.403
chem comp atom.model cartn z: -8.875
chem comp atom.pdb atom id: H75
chem comp atom.pdbx ordinal: 111
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H76,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H76
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H76
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H76
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 3.216
chem comp atom.model cartn y: -11.521
chem comp atom.model cartn z: -6.653
chem comp atom.pdb atom id: H76
chem comp atom.pdbx ordinal: 112
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H77,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H77
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H77
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H77
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.652
chem comp atom.model cartn y: -9.251
chem comp atom.model cartn z: -5.629
chem comp atom.pdb atom id: H77
chem comp atom.pdbx ordinal: 113
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H78,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H78
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H78
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H78
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -2.456
chem comp atom.model cartn y: -11.104
chem comp atom.model cartn z: -3.750
chem comp atom.pdb atom id: H78
chem comp atom.pdbx ordinal: 114
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H79,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H79
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H79
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H79
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -0.050
chem comp atom.model cartn y: -11.940
chem comp atom.model cartn z: -3.326
chem comp atom.pdb atom id: H79
chem comp atom.pdbx ordinal: 115
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H80,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H80
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H80
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H80
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 1.670
chem comp atom.model cartn y: -11.536
chem comp atom.model cartn z: -4.761
chem comp atom.pdb atom id: H80
chem comp atom.pdbx ordinal: 116
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H81,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H81
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H81
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H81
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.821
chem comp atom.model cartn y: -10.509
chem comp atom.model cartn z: -8.160
chem comp atom.pdb atom id: H81
chem comp atom.pdbx ordinal: 117
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H82,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H82
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H82
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H82
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.931
chem comp atom.model cartn y: -10.770
chem comp atom.model cartn z: -9.712
chem comp atom.pdb atom id: H82
chem comp atom.pdbx ordinal: 118
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H83,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H83
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H83
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H83
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -4.430
chem comp atom.model cartn y: -8.996
chem comp atom.model cartn z: -11.169
chem comp atom.pdb atom id: H83
chem comp atom.pdbx ordinal: 119
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H84,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H84
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H84
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H84
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -3.201
chem comp atom.model cartn y: -6.836
chem comp atom.model cartn z: -11.245
chem comp atom.pdb atom id: H84
chem comp atom.pdbx ordinal: 120
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H85,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H85
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H85
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H85
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 2.113
chem comp atom.model cartn y: -6.097
chem comp atom.model cartn z: -8.082
chem comp atom.pdb atom id: H85
chem comp atom.pdbx ordinal: 121
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H86,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H86
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H86
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H86
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 2.597
chem comp atom.model cartn y: -4.590
chem comp atom.model cartn z: -9.899
chem comp atom.pdb atom id: H86
chem comp atom.pdbx ordinal: 122
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H87,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H87
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H87
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H87
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 0.934
chem comp atom.model cartn y: -4.521
chem comp atom.model cartn z: -11.912
chem comp atom.pdb atom id: H87
chem comp atom.pdbx ordinal: 123
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H88,RUL,19435
type: chem comp atom
of datablock: info:bmrb/19435
reference to entry: entry
chem comp atom.atom id: H88
chem comp atom.comp id: RUL
chem comp atom.entry id: 19435
chem comp atom.align: 1
chem comp atom.alt atom id: H88
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: H88
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: -1.379
chem comp atom.model cartn y: -5.448
chem comp atom.model cartn z: -11.555
chem comp atom.pdb atom id: H88
chem comp atom.pdbx ordinal: 124
chem comp atom.stereo config: N
chem comp atom.type symbol: H

RUL,19435,1
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 1
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C126
chem comp bond.atom id 2: C127
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,2
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 2
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C126
chem comp bond.atom id 2: C125
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,3
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 3
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C127
chem comp bond.atom id 2: C128
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,4
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 4
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C122
chem comp bond.atom id 2: C121
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,5
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 5
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C122
chem comp bond.atom id 2: C123
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,6
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 6
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C121
chem comp bond.atom id 2: C120
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,7
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 7
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C125
chem comp bond.atom id 2: C124
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,8
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C128
chem comp bond.atom id 2: C123
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,9
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 9
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C128
chem comp bond.atom id 2: N28
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,10
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 10
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C120
chem comp bond.atom id 2: C119
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,11
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 11
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C123
chem comp bond.atom id 2: N27
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,12
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 12
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C110
chem comp bond.atom id 2: C109
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,13
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 13
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C110
chem comp bond.atom id 2: C111
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,14
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 14
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C109
chem comp bond.atom id 2: N25
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,15
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 15
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N27
chem comp bond.atom id 2: C119
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,16
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 16
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N27
chem comp bond.atom id 2: RU4
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,17
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 17
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C124
chem comp bond.atom id 2: N28
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,18
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 18
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C111
chem comp bond.atom id 2: C112
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,19
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 19
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N28
chem comp bond.atom id 2: RU4
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,20
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 20
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N25
chem comp bond.atom id 2: RU4
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,21
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 21
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N25
chem comp bond.atom id 2: C113
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,22
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 22
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C112
chem comp bond.atom id 2: C113
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,23
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 23
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: RU4
chem comp bond.atom id 2: N24
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,24
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 24
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: RU4
chem comp bond.atom id 2: N26
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,25
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 25
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: RU4
chem comp bond.atom id 2: N23
chem comp bond.ordinal: 25
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,26
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 26
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C113
chem comp bond.atom id 2: C118
chem comp bond.ordinal: 26
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,27
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 27
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C103
chem comp bond.atom id 2: N24
chem comp bond.ordinal: 27
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,28
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 28
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C103
chem comp bond.atom id 2: C104
chem comp bond.ordinal: 28
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,29
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 29
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N24
chem comp bond.atom id 2: C107
chem comp bond.ordinal: 29
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,30
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 30
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N26
chem comp bond.atom id 2: C118
chem comp bond.ordinal: 30
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,31
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 31
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N26
chem comp bond.atom id 2: C114
chem comp bond.ordinal: 31
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,32
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 32
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C118
chem comp bond.atom id 2: C117
chem comp bond.ordinal: 32
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,33
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 33
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C104
chem comp bond.atom id 2: C105
chem comp bond.ordinal: 33
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,34
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 34
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N23
chem comp bond.atom id 2: C97
chem comp bond.ordinal: 34
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,35
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 35
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N23
chem comp bond.atom id 2: C101
chem comp bond.ordinal: 35
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,36
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 36
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C114
chem comp bond.atom id 2: C115
chem comp bond.ordinal: 36
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,37
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 37
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C97
chem comp bond.atom id 2: C98
chem comp bond.ordinal: 37
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,38
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 38
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C117
chem comp bond.atom id 2: C116
chem comp bond.ordinal: 38
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,39
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 39
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C107
chem comp bond.atom id 2: C101
chem comp bond.ordinal: 39
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,40
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 40
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C107
chem comp bond.atom id 2: C106
chem comp bond.ordinal: 40
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,41
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 41
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C101
chem comp bond.atom id 2: C100
chem comp bond.ordinal: 41
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,42
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 42
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C105
chem comp bond.atom id 2: C106
chem comp bond.ordinal: 42
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,43
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 43
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C115
chem comp bond.atom id 2: C116
chem comp bond.ordinal: 43
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,44
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 44
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C106
chem comp bond.atom id 2: C108
chem comp bond.ordinal: 44
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,45
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 45
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C98
chem comp bond.atom id 2: C99
chem comp bond.ordinal: 45
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,46
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 46
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C100
chem comp bond.atom id 2: C99
chem comp bond.ordinal: 46
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,47
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 47
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C100
chem comp bond.atom id 2: C102
chem comp bond.ordinal: 47
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,48
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 48
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C108
chem comp bond.atom id 2: C102
chem comp bond.ordinal: 48
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,49
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 49
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C108
chem comp bond.atom id 2: N18
chem comp bond.ordinal: 49
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,50
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 50
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C102
chem comp bond.atom id 2: N16
chem comp bond.ordinal: 50
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,51
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 51
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N18
chem comp bond.atom id 2: C76
chem comp bond.ordinal: 51
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,52
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 52
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N16
chem comp bond.atom id 2: C70
chem comp bond.ordinal: 52
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,53
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 53
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C76
chem comp bond.atom id 2: C70
chem comp bond.ordinal: 53
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,54
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 54
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C76
chem comp bond.atom id 2: C74
chem comp bond.ordinal: 54
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,55
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 55
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C70
chem comp bond.atom id 2: C68
chem comp bond.ordinal: 55
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,56
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 56
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C73
chem comp bond.atom id 2: C74
chem comp bond.ordinal: 56
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,57
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 57
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C73
chem comp bond.atom id 2: C72
chem comp bond.ordinal: 57
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,58
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 58
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C74
chem comp bond.atom id 2: C75
chem comp bond.ordinal: 58
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,59
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 59
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C72
chem comp bond.atom id 2: C71
chem comp bond.ordinal: 59
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,60
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 60
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C68
chem comp bond.atom id 2: C67
chem comp bond.ordinal: 60
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,61
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 61
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C68
chem comp bond.atom id 2: C69
chem comp bond.ordinal: 61
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,62
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 62
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C67
chem comp bond.atom id 2: C66
chem comp bond.ordinal: 62
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,63
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 63
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C75
chem comp bond.atom id 2: C69
chem comp bond.ordinal: 63
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,64
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 64
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C75
chem comp bond.atom id 2: N17
chem comp bond.ordinal: 64
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,65
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 65
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C69
chem comp bond.atom id 2: N15
chem comp bond.ordinal: 65
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,66
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 66
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C71
chem comp bond.atom id 2: N17
chem comp bond.ordinal: 66
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,67
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 67
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N17
chem comp bond.atom id 2: RU3
chem comp bond.ordinal: 67
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,68
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 68
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C83
chem comp bond.atom id 2: C84
chem comp bond.ordinal: 68
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,69
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 69
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C83
chem comp bond.atom id 2: C82
chem comp bond.ordinal: 69
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,70
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 70
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C66
chem comp bond.atom id 2: C65
chem comp bond.ordinal: 70
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,71
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 71
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C84
chem comp bond.atom id 2: C85
chem comp bond.ordinal: 71
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,72
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 72
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C82
chem comp bond.atom id 2: N20
chem comp bond.ordinal: 72
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,73
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 73
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N15
chem comp bond.atom id 2: C65
chem comp bond.ordinal: 73
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,74
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 74
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N15
chem comp bond.atom id 2: RU3
chem comp bond.ordinal: 74
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,75
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 75
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C85
chem comp bond.atom id 2: C86
chem comp bond.ordinal: 75
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,76
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 76
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N20
chem comp bond.atom id 2: C86
chem comp bond.ordinal: 76
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,77
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 77
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N20
chem comp bond.atom id 2: RU3
chem comp bond.ordinal: 77
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,78
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 78
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C86
chem comp bond.atom id 2: C81
chem comp bond.ordinal: 78
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,79
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 79
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: RU3
chem comp bond.atom id 2: N21
chem comp bond.ordinal: 79
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,80
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 80
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: RU3
chem comp bond.atom id 2: N19
chem comp bond.ordinal: 80
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,81
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 81
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: RU3
chem comp bond.atom id 2: N22
chem comp bond.ordinal: 81
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,82
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 82
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C81
chem comp bond.atom id 2: C80
chem comp bond.ordinal: 82
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,83
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 83
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C81
chem comp bond.atom id 2: N19
chem comp bond.ordinal: 83
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,84
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 84
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C87
chem comp bond.atom id 2: N21
chem comp bond.ordinal: 84
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,85
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 85
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C87
chem comp bond.atom id 2: C88
chem comp bond.ordinal: 85
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,86
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 86
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C80
chem comp bond.atom id 2: C79
chem comp bond.ordinal: 86
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,87
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 87
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N21
chem comp bond.atom id 2: C91
chem comp bond.ordinal: 87
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,88
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 88
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N19
chem comp bond.atom id 2: C77
chem comp bond.ordinal: 88
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,89
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 89
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C88
chem comp bond.atom id 2: C89
chem comp bond.ordinal: 89
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,90
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 90
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C79
chem comp bond.atom id 2: C78
chem comp bond.ordinal: 90
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,91
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 91
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N22
chem comp bond.atom id 2: C92
chem comp bond.ordinal: 91
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,92
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 92
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: N22
chem comp bond.atom id 2: C96
chem comp bond.ordinal: 92
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,93
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 93
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C77
chem comp bond.atom id 2: C78
chem comp bond.ordinal: 93
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,94
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 94
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C91
chem comp bond.atom id 2: C96
chem comp bond.ordinal: 94
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,95
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 95
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C91
chem comp bond.atom id 2: C90
chem comp bond.ordinal: 95
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,96
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 96
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C92
chem comp bond.atom id 2: C93
chem comp bond.ordinal: 96
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,97
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 97
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C96
chem comp bond.atom id 2: C95
chem comp bond.ordinal: 97
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,98
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 98
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C89
chem comp bond.atom id 2: C90
chem comp bond.ordinal: 98
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,99
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 99
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C93
chem comp bond.atom id 2: C94
chem comp bond.ordinal: 99
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

RUL,19435,100
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 100
chem comp bond.aromatic flag: yes
chem comp bond.atom id 1: C95
chem comp bond.atom id 2: C94
chem comp bond.ordinal: 100
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,101
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 101
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C65
chem comp bond.atom id 2: H45
chem comp bond.ordinal: 101
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,102
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 102
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C66
chem comp bond.atom id 2: H46
chem comp bond.ordinal: 102
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,103
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 103
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C67
chem comp bond.atom id 2: H47
chem comp bond.ordinal: 103
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,104
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 104
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C71
chem comp bond.atom id 2: H48
chem comp bond.ordinal: 104
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,105
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 105
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C72
chem comp bond.atom id 2: H49
chem comp bond.ordinal: 105
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,106
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 106
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C73
chem comp bond.atom id 2: H50
chem comp bond.ordinal: 106
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,107
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 107
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C77
chem comp bond.atom id 2: H51
chem comp bond.ordinal: 107
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,108
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 108
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C78
chem comp bond.atom id 2: H52
chem comp bond.ordinal: 108
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,109
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 109
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C79
chem comp bond.atom id 2: H53
chem comp bond.ordinal: 109
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,110
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 110
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C80
chem comp bond.atom id 2: H54
chem comp bond.ordinal: 110
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,111
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 111
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C82
chem comp bond.atom id 2: H55
chem comp bond.ordinal: 111
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,112
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 112
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C83
chem comp bond.atom id 2: H56
chem comp bond.ordinal: 112
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,113
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 113
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C84
chem comp bond.atom id 2: H57
chem comp bond.ordinal: 113
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,114
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 114
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C85
chem comp bond.atom id 2: H58
chem comp bond.ordinal: 114
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,115
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 115
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C87
chem comp bond.atom id 2: H59
chem comp bond.ordinal: 115
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,116
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 116
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C88
chem comp bond.atom id 2: H60
chem comp bond.ordinal: 116
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,117
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 117
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C89
chem comp bond.atom id 2: H61
chem comp bond.ordinal: 117
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,118
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 118
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C90
chem comp bond.atom id 2: H62
chem comp bond.ordinal: 118
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,119
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 119
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C92
chem comp bond.atom id 2: H63
chem comp bond.ordinal: 119
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,120
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 120
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C93
chem comp bond.atom id 2: H64
chem comp bond.ordinal: 120
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,121
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 121
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C94
chem comp bond.atom id 2: H65
chem comp bond.ordinal: 121
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,122
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 122
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C95
chem comp bond.atom id 2: H66
chem comp bond.ordinal: 122
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,123
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 123
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C97
chem comp bond.atom id 2: H67
chem comp bond.ordinal: 123
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,124
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 124
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C98
chem comp bond.atom id 2: H68
chem comp bond.ordinal: 124
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,125
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 125
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C99
chem comp bond.atom id 2: H69
chem comp bond.ordinal: 125
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,126
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 126
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C103
chem comp bond.atom id 2: H70
chem comp bond.ordinal: 126
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,127
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 127
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C104
chem comp bond.atom id 2: H71
chem comp bond.ordinal: 127
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,128
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 128
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C105
chem comp bond.atom id 2: H72
chem comp bond.ordinal: 128
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,129
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 129
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C109
chem comp bond.atom id 2: H73
chem comp bond.ordinal: 129
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,130
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 130
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C110
chem comp bond.atom id 2: H74
chem comp bond.ordinal: 130
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,131
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 131
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C111
chem comp bond.atom id 2: H75
chem comp bond.ordinal: 131
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,132
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 132
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C112
chem comp bond.atom id 2: H76
chem comp bond.ordinal: 132
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,133
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 133
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C114
chem comp bond.atom id 2: H77
chem comp bond.ordinal: 133
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,134
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 134
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C115
chem comp bond.atom id 2: H78
chem comp bond.ordinal: 134
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,135
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 135
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C116
chem comp bond.atom id 2: H79
chem comp bond.ordinal: 135
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,136
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 136
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C117
chem comp bond.atom id 2: H80
chem comp bond.ordinal: 136
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,137
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 137
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C119
chem comp bond.atom id 2: H81
chem comp bond.ordinal: 137
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,138
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 138
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C120
chem comp bond.atom id 2: H82
chem comp bond.ordinal: 138
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,139
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 139
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C121
chem comp bond.atom id 2: H83
chem comp bond.ordinal: 139
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,140
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 140
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C122
chem comp bond.atom id 2: H84
chem comp bond.ordinal: 140
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,141
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 141
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C124
chem comp bond.atom id 2: H85
chem comp bond.ordinal: 141
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,142
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 142
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C125
chem comp bond.atom id 2: H86
chem comp bond.ordinal: 142
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,143
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 143
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C126
chem comp bond.atom id 2: H87
chem comp bond.ordinal: 143
chem comp bond.stereo config: N
chem comp bond.value order: SING

RUL,19435,144
type: chem comp bond
of datablock: info:bmrb/19435
chem comp bond.comp id: RUL
chem comp bond.entry id: 19435
chem comp bond.id: 144
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C127
chem comp bond.atom id 2: H88
chem comp bond.ordinal: 144
chem comp bond.stereo config: N
chem comp bond.value order: SING

http://bmrbpub.pdbj.org/rdf/bmr19435/chem_comp_descriptor/RUL,C1%3DCC%3D%5BN%5D2C(%3DC1)C3%3DCC%3DCC%3D%5BN%5D3%5BRu%2B2%5D245(%5BN%5D6%3DC7C(%3DCC%3DC6)c8c(nc9c1,19435,OECHEM,1.7.6,SMILES
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: C1=CC=[N]2C(=C1)C3=CC=CC=[N]3[Ru+2]245([N]6=C7C(=CC=C6)c8c(nc9c1c2c3c(c9n8)C=CC=[N]3[Ru+2]36([N]2=CC=C1)([N]1=C(C=CC=C1)C1=[N]3C=CC=C1)[N]1=C(C=CC=C1)C1=[N]6C=CC=C1)C1=CC=C[N]4=C17)[N]1=CC=CC=C1C1=CC=CC=[N]51
chem comp descriptor.entry id: 19435
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES

http://bmrbpub.pdbj.org/rdf/bmr19435/chem_comp_descriptor/RUL,C1%3DCC%3D%5BN%5D2C(%3DC1)C3%3DCC%3DCC%3D%5BN%5D3%5BRu%2B2%5D245(%5BN%5D6%3DC7C(%3DCC%3DC6)c8c(nc9c1,19435,OECHEM,1.7.6,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: C1=CC=[N]2C(=C1)C3=CC=CC=[N]3[Ru+2]245([N]6=C7C(=CC=C6)c8c(nc9c1c2c3c(c9n8)C=CC=[N]3[Ru+2]36([N]2=CC=C1)([N]1=C(C=CC=C1)C1=[N]3C=CC=C1)[N]1=C(C=CC=C1)C1=[N]6C=CC=C1)C1=CC=C[N]4=C17)[N]1=CC=CC=C1C1=CC=CC=[N]51
chem comp descriptor.entry id: 19435
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.7.6
chem comp descriptor.type: SMILES_CANONICAL

RUL,CUPZTUKKQZECGK-UHFFFAOYSA-N,19435,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: CUPZTUKKQZECGK-UHFFFAOYSA-N
chem comp descriptor.entry id: 19435
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr19435/chem_comp_descriptor/RUL,InChI%3D1S%2FC24H12N6.4C10H8N2.2Ru%2Fc1-5-13-17(25-9-1)18-14(6-2-10-26,19435,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: InChI=1S/C24H12N6.4C10H8N2.2Ru/c1-5-13-17(25-9-1)18-14(6-2-10-26-18)22-21(13)29-23-15-7-3-11-27-19(15)20-16(24(23)30-22)8-4-12-28-20;4*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;/h1-12H;4*1-8H;;/q;;;;;2*+2
chem comp descriptor.entry id: 19435
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

RUL,n1c%13c(nc4c1c2cccn%11c2c3n(cccc34)[Ru+2]7%10%11(n5ccccc5c6ccccn,19435,ACD,12.01,SMILES
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: n1c%13c(nc4c1c2cccn%11c2c3n(cccc34)[Ru+2]7%10%11(n5ccccc5c6ccccn67)n8ccccc8c9ccccn9%10)c%12cccn%21c%12c%14c%13cccn%14[Ru+2]%17%20%21(n%15ccccc%15c%16ccccn%16%17)n%18ccccc%18c%19ccccn%19%20
chem comp descriptor.entry id: 19435
chem comp descriptor.program: ACD
chem comp descriptor.program version: 12.01
chem comp descriptor.type: SMILES

RUL,[Ru++]|1|2|3(|n4ccccc4c5ccccn|15)(|n6ccccc6c7ccccn|27)|n8cccc9c8,19435,CACTVS,3.385,SMILES
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: [Ru++]|1|2|3(|n4ccccc4c5ccccn|15)(|n6ccccc6c7ccccn|27)|n8cccc9c8c%10n|3cccc%10c%11nc%12c%13cccn%14|[Ru++]|%15|%16(|n%17ccccc%17c%18ccccn|%15%18)(|n%19ccccc%19c%20ccccn|%16%20)|n%21cccc(c%21c%13%14)c%12nc9%11
chem comp descriptor.entry id: 19435
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.385
chem comp descriptor.type: SMILES

RUL,[Ru++]|1|2|3(|n4ccccc4c5ccccn|15)(|n6ccccc6c7ccccn|27)|n8cccc9c8,19435,CACTVS,3.385,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/19435
chem comp descriptor.comp id: RUL
chem comp descriptor.descriptor: [Ru++]|1|2|3(|n4ccccc4c5ccccn|15)(|n6ccccc6c7ccccn|27)|n8cccc9c8c%10n|3cccc%10c%11nc%12c%13cccn%14|[Ru++]|%15|%16(|n%17ccccc%17c%18ccccn|%15%18)(|n%19ccccc%19c%20ccccn|%16%20)|n%21cccc(c%21c%13%14)c%12nc9%11
chem comp descriptor.entry id: 19435
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.385
chem comp descriptor.type: SMILES_CANONICAL

RUL,19435,tetrakis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)(mu-tetrapyrido[3,ACD,12.01,systematic name
type: chem comp identifier
of datablock: info:bmrb/19435
chem comp identifier.comp id: RUL
chem comp identifier.entry id: 19435
chem comp identifier.identifier: tetrakis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)(mu-tetrapyrido[3,2-a:2',3'-c:3'',2''-h:2''',3'''-j]phenazine-1kappa~2~N~4~,N~5~:2kappa~2~N~13~,N~14~)diruthenium(4+)
chem comp identifier.program: ACD
chem comp identifier.program version: 12.01
chem comp identifier.type: systematic name

1,19435,1
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 1
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: DA
chem shift completeness char.comp index id: 1
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 194350301

1,19435,2
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 2
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 2
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,3
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 3
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 3
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,4
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 4
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 4
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,5
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 5
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.900
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: DT
chem shift completeness char.comp index id: 5
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 194350301

1,19435,6
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 6
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 0.857
chem shift completeness char.bb chem shift coverage: 0.857
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: DT
chem shift completeness char.comp index id: 6
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 194350301

1,19435,7
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 7
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 0.857
chem shift completeness char.bb chem shift coverage: 0.857
chem shift completeness char.chem shift 1h coverage: 0.778
chem shift completeness char.chem shift coverage: 0.778
chem shift completeness char.comp id: DA
chem shift completeness char.comp index id: 7
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 194350301

1,19435,8
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 8
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.857
chem shift completeness char.bb chem shift coverage: 0.857
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 8
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,9
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 9
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.714
chem shift completeness char.bb chem shift coverage: 0.714
chem shift completeness char.chem shift 1h coverage: 0.778
chem shift completeness char.chem shift coverage: 0.778
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 9
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,10
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 10
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,11
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 11
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.900
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: DT
chem shift completeness char.comp index id: 11
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 194350301

1,19435,12
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 12
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.900
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: DT
chem shift completeness char.comp index id: 12
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 194350301

1,19435,13
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 13
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 0.857
chem shift completeness char.bb chem shift coverage: 0.857
chem shift completeness char.chem shift 1h coverage: 0.778
chem shift completeness char.chem shift coverage: 0.778
chem shift completeness char.comp id: DA
chem shift completeness char.comp index id: 13
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 194350301

1,19435,14
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 14
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,15
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 15
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 15
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,16
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 16
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.857
chem shift completeness char.bb chem shift coverage: 0.857
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 16
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,17
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 17
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.900
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: DT
chem shift completeness char.comp index id: 17
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 194350301

1,19435,18
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 18
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.900
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: DT
chem shift completeness char.comp index id: 18
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 194350301

1,19435,19
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 19
chem shift completeness char.arom chem shift 1h coverage: 0.500
chem shift completeness char.arom chem shift coverage: 0.500
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: DA
chem shift completeness char.comp index id: 19
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 194350301

1,19435,20
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 20
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.857
chem shift completeness char.bb chem shift coverage: 0.857
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 20
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,21
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 21
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.714
chem shift completeness char.bb chem shift coverage: 0.714
chem shift completeness char.chem shift 1h coverage: 0.778
chem shift completeness char.chem shift coverage: 0.778
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 21
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435,22
type: chem shift completeness char
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 19435
chem shift completeness char.id: 22
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: DG
chem shift completeness char.comp index id: 22
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 194350301

1,19435
type: chem shift completeness list
of datablock: info:bmrb/19435
reference to entry: entry
chem shift completeness list.assigned chem shift list id: 1
chem shift completeness list.entry id: 19435
chem shift completeness list.arom chem shift 1h fraction: 34/44
chem shift completeness list.arom chem shift fraction: 34/44
chem shift completeness list.assigned residue coverage: 1.000
chem shift completeness list.bb chem shift 1h fraction: 144/154
chem shift completeness list.bb chem shift fraction: 144/154
chem shift completeness list.chem shift 1h fraction: 184/204
chem shift completeness list.chem shift fraction: 184/204
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr19435_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polydeoxyribonucleotide
chem shift completeness list.methyl chem shift 1h fraction: 6/6
chem shift completeness list.methyl chem shift fraction: 6/6
chem shift completeness list.output file name: bmr19435_chem_shift_completeness.str
chem shift completeness list.queried date: 2020-07-22Z
chem shift completeness list.sc chem shift 1h fraction: 40/50
chem shift completeness list.sc chem shift fraction: 40/50
chem shift completeness list.sf category: chem_shift_completeness_list
chem shift completeness list.sf framecode: chem_shift_completeness_list_1
chem shift completeness list.sf id: 194350301

1,19435,1
type: chem shift experiment
of datablock: info:bmrb/19435
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 19435
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: 2D 1H-1H NOESY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,19435,2
type: chem shift experiment
of datablock: info:bmrb/19435
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 19435
chem shift experiment.experiment id: 2
chem shift experiment.experiment name: 2D 1H-1H TOCSY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,19435,3
type: chem shift experiment
of datablock: info:bmrb/19435
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 19435
chem shift experiment.experiment id: 3
chem shift experiment.experiment name: 2D 1H-1H COSY
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,19435,4
type: chem shift experiment
of datablock: info:bmrb/19435
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 19435
chem shift experiment.experiment id: 4
chem shift experiment.experiment name: 2D 1H-31P HSQC
chem shift experiment.sample id: 0
chem shift experiment.sample state: isotropic

1,H,1,19435,DSS
type: chem shift ref
of datablock: info:bmrb/19435
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: 19435
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 0
chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 1.0
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

19435,1
type: chem shift reference
of datablock: info:bmrb/19435
reference to entry: entry
chem shift reference.entry id: 19435
chem shift reference.id: 1
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chemical_shift_reference_1

19435,1
type: citation
of datablock: info:bmrb/19435
reference to entry: entry
citation.entry id: 19435
citation.id: 1
citation.class: entry citation
citation.doi: 10.1021/jm401119b
citation.journal abbrev: J. Med. Chem.
citation.journal issn: 0022-2623
citation.journal issue: 21
citation.journal name full: Journal of medicinal chemistry
citation.journal volume: 56
citation.page first: 8674
citation.page last: 8683
citation.pubmed id: 24088028
citation.sf category: citations
citation.sf framecode: citation_1
citation.status: published
citation.title: Structural studies on dinuclear ruthenium(II) complexes that bind diastereoselectively to an antiparallel folded human telomere sequence.
citation.type: journal
citation.year: 2013

info:doi/10.1021/jm401119b

doi:10.1021/jm401119b

urn:ISSN:0022-2623

issn:0022-2623

info:pmid/24088028

pubmed:24088028

1,19435,1
type: citation author
of datablock: info:bmrb/19435
citation author.citation id: 1
citation author.entry id: 19435
citation author.ordinal: 1
citation author.family name: Wilson
citation author.given name: Tom
citation author.pdbx name: Wilson, T.

1,19435,2
type: citation author
of datablock: info:bmrb/19435
citation author.citation id: 1
citation author.entry id: 19435
citation author.ordinal: 2
citation author.family name: Costa
citation author.given name: Paulo
citation author.middle initials: J.
citation author.pdbx name: Costa, P.J.

1,19435,3
type: citation author
of datablock: info:bmrb/19435
citation author.citation id: 1
citation author.entry id: 19435
citation author.ordinal: 3
citation author.family name: Felix
citation author.given name: Vitor
citation author.pdbx name: Felix, V.

1,19435,4
type: citation author
of datablock: info:bmrb/19435
citation author.citation id: 1
citation author.entry id: 19435
citation author.ordinal: 4
citation author.family name: Williamson
citation author.given name: Mike
citation author.middle initials: P.
citation author.pdbx name: Williamson, M.P.

1,19435,5
type: citation author
of datablock: info:bmrb/19435
citation author.citation id: 1
citation author.entry id: 19435
citation author.ordinal: 5
citation author.family name: Thomas
citation author.given name: Jim
citation author.middle initials: A.
citation author.pdbx name: Thomas, J.A.

19435,assigned chemical shifts
type: data set
of datablock: info:bmrb/19435
reference to entry: entry
data set.entry id: 19435
data set.type: assigned_chemical_shifts
data set.count: 1

19435,1H chemical shifts
type: datum
of datablock: info:bmrb/19435
reference to entry: entry
datum.entry id: 19435
datum.type: 1H chemical shifts
datum.count: 196

19435,1
type: entity
of datablock: info:bmrb/19435
reference to entry: entry
entity.entry id: 19435
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 7046.467
entity.name: human telomere quadruplex
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 22
entity.paramagnetic: no
entity.parent entity id: 0
entity.polymer author seq details: Folds to a basket G-quadruplex
entity.polymer seq one letter code: AGGGTTAGGGTTAGGGTTAGGG
entity.polymer seq one letter code can: AGGGTTAGGGTTAGGGTTAGGG
entity.polymer strand id: A
entity.polymer type: polydeoxyribonucleotide
entity.sf category: entity
entity.sf framecode: human_telomere_quadruplex
entity.src method: syn
entity.type: polymer

19435,2
type: entity
of datablock: info:bmrb/19435
reference to entry: entry
entity.entry id: 19435
entity.id: 2
entity.bmrb code: RUL
entity.formula weight: 1211.268
entity.name: entity RUL
entity.nonpolymer comp id: RUL
entity.nonpolymer comp label: chem_comp_RUL
entity.number of nonpolymer components: 1
entity.parent entity id: 2
entity.polymer seq one letter code can: (RUL)
entity.sf category: entity
entity.sf framecode: entity_RUL
entity.type: non-polymer

1,19435,1
type: entity assembly
of datablock: info:bmrb/19435
entity assembly.assembly id: 1
entity assembly.entry id: 19435
entity assembly.id: 1
entity assembly.asym id: A
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: human telomere quadruplex
entity assembly.entity id: 1
entity assembly.entity label: human_telomere_quadruplex
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,19435,2
type: entity assembly
of datablock: info:bmrb/19435
entity assembly.assembly id: 1
entity assembly.entry id: 19435
entity assembly.id: 2
entity assembly.asym id: B
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: DD-bisRuthenium ligand
entity assembly.entity id: 2
entity assembly.entity label: entity_RUL
entity assembly.experimental data reported: no
entity assembly.physical state: native

2,19435,1
type: entity atom list
of datablock: info:bmrb/19435
entity atom list.entity id: 2
entity atom list.entry id: 19435
entity atom list.id: 1
entity atom list.atom id: C100
entity atom list.comp id: RUL
entity atom list.comp index id: 1
entity atom list.sf id: 105544

2,19435,2
type: entity atom list
of datablock: info:bmrb/19435
entity atom list.entity id: 2
entity atom list.entry id: 19435
entity atom list.id: 2
entity atom list.atom id: C101
entity atom list.comp id: RUL
entity atom list.comp index id: 1
entity atom list.sf id: 105544

2,19435,3
type: entity atom list
of datablock: info:bmrb/19435
entity atom list.entity id: 2
entity atom list.entry id: 19435
entity atom list.id: 3
entity atom list.atom id: C102
entity atom list.comp id: RUL
entity atom list.comp index id: 1
entity atom list.sf id: 105544

2,19435,4
type: entity atom list
of datablock: info:bmrb/19435
entity atom list.entity id: 2
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2,19435,BMRB
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entity systematic name.name: tetrakis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)(mu-tetrapyrido[3,2-a:2',3'-c:3'',2''-h:2''',3'''-j]phenazine-1kappa~2~N~4~,N~5~:2kappa~2~N~13~,N~14~)diruthenium

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http://bmrbpub.pdbj.org/rdf/bmr19435/entry/19435
type: entry
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entry.id: 19435
entry.accession date: 2013-08-17Z
entry.assigned pdb id: 2MCC
entry.details: Complex between DNA quadruplex (human telomere) and DD-bisRuthenium ligand
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2014-02-02Z
entry.nmr star version: 3.1.1.61
entry.original nmr star version: 3.1
entry.original release date: 2013-09-29Z
entry.origination: author
entry.sf category: entry_information
entry.sf framecode: entry_information
entry.submission date: 2013-08-17Z
entry.title: Structural studies on dinuclear ruthenium(II) complexes that bind diastereoselectively to an anti-parallel folded human telomere sequence
entry.type: macromolecule
entry.version type: original

info:pdb/2MCC

pdb:2MCC

19435,1
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19435,2
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19435,3
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19435,4
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19435,5
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19435,1,1
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19435,1,3
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19435,2
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release.entry id: 19435
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release.author: BMRB
release.date: 2014-02-02Z
release.detail: update entry citation
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19435,1
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19435,1
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19435,1,1
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sample component.entity label: human_telomere_quadruplex
sample component.isotopic labeling: natural abundance
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19435,2,1
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19435,1
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19435,1
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19435,1
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19435,complex
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19435,DNA
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19435,quadruplex
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19435,ruthenium
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19435,1,structure solution
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19435,Schwieters, Kuszewski, Tjandra and Clore,1
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