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11249,1
type: assembly
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reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
assembly.entry id: 11249
assembly.id: 1
assembly.details: holo GrxS14 contains two molecular apo GrxS14 and glutathione, and assembles a [2Fe-2S] cluster.
assembly.molecular mass: 24000
assembly.name: holo GrxS14
assembly.non standard bonds: yes
assembly.number of components: 5
assembly.paramagnetic: yes
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https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
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referenced by chem shift completeness char: 1,11249,34
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11249,1
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1,11249,1
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1,11249,145
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1,11249,150
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1,11249,151
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1,11249,152
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1,11249,153
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1,11249,154
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1,11249,155
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1,11249,156
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1,11249,157
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1,11249,158
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1,11249,159
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1,11249,160
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1,11249,161
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1,11249,162
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1,11249,163
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1,11249,164
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1,11249,165
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1,11249,166
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1,11249,167
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1,11249,168
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1,11249,170
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1,11249,171
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1,11249,173
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1,11249,174
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1,11249,175
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1,11249,176
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1,11249,177
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1,11249,178
type: atom chem shift
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1,11249,179
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1,11249,180
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1,11249,181
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1,11249,182
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1,11249,183
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1,11249,184
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1,11249,186
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1,11249,187
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1,11249,188
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1,11249,190
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1,11249,193
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1,11249,198
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1,11249,199
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1,11249,200
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1,11249,201
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1,11249,202
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1,11249,203
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1,11249,204
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 1.853

1,11249,220
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 220
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 1
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atom chem shift.auth atom id: HE1
atom chem shift.auth comp id: K
atom chem shift.auth seq id: 19
atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.056

1,11249,221
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 221
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HE3
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atom chem shift.atom type: H
atom chem shift.auth atom id: HE2
atom chem shift.auth comp id: K
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 3.056

1,11249,222
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 222
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: K
atom chem shift.auth seq id: 19
atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 1.670

1,11249,223
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 223
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
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atom chem shift.auth comp id: K
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 1.540

1,11249,224
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 174.532

1,11249,225
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 58.793

1,11249,226
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.val: 33.383

1,11249,227
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 28.885

1,11249,228
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 228
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 42.460

1,11249,229
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 229
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: K
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atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 19
atom chem shift.val: 24.633

1,11249,230
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 230
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: K
atom chem shift.auth seq id: 19
atom chem shift.comp id: LYS
atom chem shift.comp index id: 19
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 19
atom chem shift.val: 121.628

1,11249,231
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 231
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HN
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 20
atom chem shift.val: 8.760

1,11249,232
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 1
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atom chem shift.auth atom id: HA
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 4.961

1,11249,233
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.auth atom id: HB
atom chem shift.auth comp id: V
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
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atom chem shift.val: 2.381

1,11249,234
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG11
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 0.907

1,11249,235
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG11
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 0.907

1,11249,236
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG11
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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: 0.907

1,11249,237
type: atom chem shift
of datablock: info:bmrb/11249
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.atom id: HG21
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atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 20
atom chem shift.val: 0.784

1,11249,238
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 238
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG22
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atom chem shift.auth atom id: HG21
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
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atom chem shift.val: 0.784

1,11249,239
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 20
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atom chem shift.val: 0.784

1,11249,240
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 177.001

1,11249,241
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 61.727

1,11249,242
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,243
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 21.003

1,11249,244
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,245
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 1
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atom chem shift.atom isotope number: 15
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atom chem shift.auth seq id: 20
atom chem shift.comp id: VAL
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1,11249,246
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 8.884

1,11249,247
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 4.777

1,11249,248
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 1.772

1,11249,249
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 0.846

1,11249,250
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 0.846

1,11249,251
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
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atom chem shift.val: 0.846

1,11249,252
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.auth seq id: 21
atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 0.157

1,11249,253
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 253
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
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atom chem shift.val: 0.157

1,11249,254
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 254
atom chem shift.ambiguity code: 2
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 0.157

1,11249,255
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: V
atom chem shift.auth seq id: 21
atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 178.771

1,11249,256
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: V
atom chem shift.auth seq id: 21
atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 21
atom chem shift.val: 61.142

1,11249,257
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.auth comp id: V
atom chem shift.auth seq id: 21
atom chem shift.comp id: VAL
atom chem shift.comp index id: 21
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1,11249,258
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1,11249,259
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1,11249,260
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1,11249,261
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1,11249,273
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1,11249,275
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1,11249,277
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atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 36
atom chem shift.comp id: SER
atom chem shift.comp index id: 36
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 36
atom chem shift.val: 120.484

1,11249,373
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 373
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: Q
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 3.802

1,11249,374
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 374
atom chem shift.ambiguity code: 2
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atom chem shift.atom id: HB2
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB1
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atom chem shift.auth seq id: 37
atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 2.048

1,11249,375
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 375
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
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atom chem shift.atom type: H
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atom chem shift.auth comp id: Q
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 2.330

1,11249,376
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HE21
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atom chem shift.auth comp id: Q
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 7.397

1,11249,377
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 377
atom chem shift.ambiguity code: 2
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atom chem shift.auth atom id: HE22
atom chem shift.auth comp id: Q
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 6.807

1,11249,378
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.auth comp id: Q
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 2.330

1,11249,379
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 379
atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: Q
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 2.330

1,11249,380
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 59.855

1,11249,381
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 381
atom chem shift.ambiguity code: 1
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atom chem shift.comp id: GLN
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 28.537

1,11249,382
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 382
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.auth atom id: CG
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atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 37
atom chem shift.val: 33.465

1,11249,383
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 383
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: NE2
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: NE2
atom chem shift.auth comp id: Q
atom chem shift.auth seq id: 37
atom chem shift.comp id: GLN
atom chem shift.comp index id: 37
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 37
atom chem shift.val: 111.046

1,11249,384
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 384
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: T
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atom chem shift.comp id: THR
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atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 3.842

1,11249,385
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 38
atom chem shift.val: 4.489

1,11249,386
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 386
atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: T
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atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.110

1,11249,387
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 387
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
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atom chem shift.comp id: THR
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.110

1,11249,388
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 388
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG23
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atom chem shift.comp id: THR
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.110

1,11249,389
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 389
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
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atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: T
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atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 67.086

1,11249,390
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 390
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: T
atom chem shift.auth seq id: 38
atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 69.042

1,11249,391
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 391
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG2
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG2
atom chem shift.auth comp id: T
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atom chem shift.comp id: THR
atom chem shift.comp index id: 38
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 38
atom chem shift.val: 22.064

1,11249,392
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 392
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 39
atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 3.447

1,11249,393
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 393
atom chem shift.ambiguity code: 1
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atom chem shift.atom type: H
atom chem shift.auth atom id: HB
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 39
atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 2.006

1,11249,394
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 394
atom chem shift.ambiguity code: 2
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atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG11
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 39
atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 39
atom chem shift.val: 0.879

1,11249,395
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 395
atom chem shift.ambiguity code: 2
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atom chem shift.atom type: H
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atom chem shift.auth comp id: V
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.879

1,11249,396
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
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atom chem shift.auth atom id: HG11
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 39
atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 39
atom chem shift.val: 0.879

1,11249,397
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 397
atom chem shift.ambiguity code: 2
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atom chem shift.atom type: H
atom chem shift.auth atom id: HG21
atom chem shift.auth comp id: V
atom chem shift.auth seq id: 39
atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
atom chem shift.entity assembly id: 1
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atom chem shift.val: 1.157

1,11249,398
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.auth comp id: V
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
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atom chem shift.val: 1.157

1,11249,399
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 2
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atom chem shift.auth comp id: V
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atom chem shift.comp id: VAL
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atom chem shift.val: 1.157

1,11249,400
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 67.748

1,11249,401
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 31.342

1,11249,402
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.auth comp id: V
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atom chem shift.comp id: VAL
atom chem shift.comp index id: 39
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atom chem shift.val: 23.692

1,11249,403
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
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atom chem shift.ambiguity code: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 24.143

1,11249,404
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 3.264

1,11249,405
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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1,11249,406
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 406
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1,11249,407
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,408
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,409
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,410
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,488
type: atom chem shift
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1,11249,489
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1,11249,490
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1,11249,491
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1,11249,492
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1,11249,493
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1,11249,495
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1,11249,496
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1,11249,497
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1,11249,498
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1,11249,500
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1,11249,501
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1,11249,502
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1,11249,503
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1,11249,505
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1,11249,506
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1,11249,508
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1,11249,509
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atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: S
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atom chem shift.comp id: SER
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atom chem shift.entity assembly id: 1
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atom chem shift.seq id: 52
atom chem shift.val: 66.830

1,11249,564
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 564
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: S
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atom chem shift.comp id: SER
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 120.495

1,11249,565
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 8.758

1,11249,566
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.103

1,11249,567
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 1.730

1,11249,568
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.492

1,11249,569
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,570
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.492

1,11249,571
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.entity assembly id: 1
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atom chem shift.val: 0.910

1,11249,572
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.id: 572
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atom chem shift.val: 0.910

1,11249,573
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 0.910

1,11249,574
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: VAL
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atom chem shift.val: 177.043

1,11249,575
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 61.181

1,11249,576
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 34.547

1,11249,577
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,578
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,579
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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atom chem shift.assembly atom id: 0
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atom chem shift.atom isotope number: 15
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atom chem shift.comp id: VAL
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1,11249,580
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,581
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,582
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,583
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,584
type: atom chem shift
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1,11249,585
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1,11249,586
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,587
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1,11249,588
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1,11249,589
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1,11249,590
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1,11249,591
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1,11249,592
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1,11249,593
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1,11249,594
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1,11249,595
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1,11249,596
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1,11249,597
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1,11249,598
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1,11249,599
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1,11249,600
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1,11249,601
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1,11249,975
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1,11249,977
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1,11249,978
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1,11249,979
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1,11249,980
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1,11249,981
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1,11249,982
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1,11249,983
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1,11249,984
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1,11249,985
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1,11249,986
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1,11249,987
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1,11249,988
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1,11249,989
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1,11249,990
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1,11249,991
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1,11249,992
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1,11249,993
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1,11249,996
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1,11249,997
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1,11249,999
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1,11249,1002
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1,11249,1003
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1,11249,1012
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1,11249,1020
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1,11249,1021
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1,11249,1022
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1,11249,1026
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1,11249,1027
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1,11249,1028
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1,11249,1037
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1,11249,1041
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1,11249,1042
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1,11249,1076
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atom chem shift.val: 7.383

1,11249,1095
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1,11249,1096
type: atom chem shift
of datablock: info:bmrb/11249
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atom chem shift.val: 2.129

1,11249,1097
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1098
type: atom chem shift
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1,11249,1099
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
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1,11249,1100
type: atom chem shift
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1,11249,1101
type: atom chem shift
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1,11249,1102
type: atom chem shift
of datablock: info:bmrb/11249
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atom chem shift.val: 29.698

1,11249,1103
type: atom chem shift
of datablock: info:bmrb/11249
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atom chem shift.val: 36.250

1,11249,1104
type: atom chem shift
of datablock: info:bmrb/11249
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atom chem shift.comp id: GLU
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atom chem shift.val: 117.378

1,11249,1105
type: atom chem shift
of datablock: info:bmrb/11249
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atom chem shift.val: 8.086

1,11249,1106
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1107
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1,11249,1108
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1109
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atom chem shift.val: 7.648

1,11249,1110
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1111
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1112
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1113
type: atom chem shift
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1,11249,1114
type: atom chem shift
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1,11249,1115
type: atom chem shift
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1,11249,1116
type: atom chem shift
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1,11249,1117
type: atom chem shift
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1,11249,1118
type: atom chem shift
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1,11249,1119
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1120
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1121
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1122
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1123
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1124
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1125
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1126
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1127
type: atom chem shift
of datablock: info:bmrb/11249
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1,11249,1128
type: atom chem shift
of datablock: info:bmrb/11249
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atom chem shift.val: 174.438

1,11249,1129
type: atom chem shift
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1,11249,1130
type: atom chem shift
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1,11249,1131
type: atom chem shift
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1,11249,1132
type: atom chem shift
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1,11249,1134
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1,11249,1135
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1,11249,1136
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1,11249,1137
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1,11249,1138
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1,11249,1139
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1,11249,1140
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1,11249,1141
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1,11249,1142
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1,11249,1143
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1,11249,1144
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1,11249,1145
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1,11249,1146
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1,11249,1150
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1,11249,1151
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1,11249,1152
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1,11249,1153
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1,11249,1155
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1,11249,1156
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1,11249,1163
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atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: A
atom chem shift.auth seq id: 106
atom chem shift.comp id: ALA
atom chem shift.comp index id: 106
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 106
atom chem shift.val: 121.495

1,11249,1171
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1171
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HN
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 8.023

1,11249,1172
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1172
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 4.467

1,11249,1173
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1173
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB1
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 2.824

1,11249,1174
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1174
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 2.224

1,11249,1175
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1175
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG1
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 2.736

1,11249,1176
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1176
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HG3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HG2
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 2.831

1,11249,1177
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1177
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 173.968

1,11249,1178
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1178
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 56.294

1,11249,1179
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1179
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 32.424

1,11249,1180
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1180
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CG
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CG
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 32.096

1,11249,1181
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1181
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: M
atom chem shift.auth seq id: 107
atom chem shift.comp id: MET
atom chem shift.comp index id: 107
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 107
atom chem shift.val: 114.483

1,11249,1182
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1182
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HN
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 7.752

1,11249,1183
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1183
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 4.643

1,11249,1184
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1184
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB1
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 3.040

1,11249,1185
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1185
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 3.040

1,11249,1186
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1186
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: C
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: C
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 177.382

1,11249,1187
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1187
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 59.204

1,11249,1188
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1188
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 28.144

1,11249,1189
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1189
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: C
atom chem shift.auth seq id: 108
atom chem shift.comp id: CYS
atom chem shift.comp index id: 108
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 108
atom chem shift.val: 117.310

1,11249,1190
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1190
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: H
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HN
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 7.749

1,11249,1191
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1191
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HA
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HA
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 4.330

1,11249,1192
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1192
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB2
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB1
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 3.945

1,11249,1193
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1193
atom chem shift.ambiguity code: 2
atom chem shift.assembly atom id: 0
atom chem shift.atom id: HB3
atom chem shift.atom isotope number: 1
atom chem shift.atom type: H
atom chem shift.auth atom id: HB2
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 3.945

1,11249,1194
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1194
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CA
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CA
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 60.283

1,11249,1195
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1195
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: CB
atom chem shift.atom isotope number: 13
atom chem shift.atom type: C
atom chem shift.auth atom id: CB
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 65.047

1,11249,1196
type: atom chem shift
of datablock: info:bmrb/11249
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 11249
atom chem shift.id: 1196
atom chem shift.ambiguity code: 1
atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.auth atom id: N
atom chem shift.auth comp id: S
atom chem shift.auth seq id: 109
atom chem shift.comp id: SER
atom chem shift.comp index id: 109
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 109
atom chem shift.val: 123.236

1,11249,1
type: bond
of datablock: info:bmrb/11249
bond.assembly id: 1
bond.entry id: 11249
bond.id: 1
bond.atom id 1: SG
bond.atom id 2: FE1
bond.auth atom id 1: SG
bond.auth atom id 2: FE1
bond.auth comp id 1: CYS
bond.auth entity assembly name 1: apo GrxS14 1
bond.auth entity assembly name 2: [2Fe-2S] cluster
bond.auth seq id 1: 33
bond.comp id 1: CYS
bond.comp id 2: FES
bond.comp index id 1: 33
bond.comp index id 2: 1
bond.entity assembly id 1: 1
bond.entity assembly id 2: 5
bond.entity assembly name 1: apo GrxS14 no.1
bond.entity assembly name 2: [2Fe-2S] cluster
bond.entity id 1: 1
bond.entity id 2: 3
bond.seq id 1: 33
bond.seq id 2: 1
bond.type: na
bond.value order: sing

1,11249,2
type: bond
of datablock: info:bmrb/11249
bond.assembly id: 1
bond.entry id: 11249
bond.id: 2
bond.atom id 1: SG2
bond.atom id 2: FE1
bond.auth atom id 1: SG
bond.auth atom id 2: FE1
bond.auth entity assembly name 1: glutathione1
bond.auth entity assembly name 2: [2Fe-2S] cluster
bond.comp id 1: GSH
bond.comp id 2: FES
bond.comp index id 1: 1
bond.comp index id 2: 1
bond.entity assembly id 1: 3
bond.entity assembly id 2: 5
bond.entity assembly name 1: glutathione no.1
bond.entity assembly name 2: [2Fe-2S] cluster
bond.entity id 1: 2
bond.entity id 2: 3
bond.seq id 1: 1
bond.seq id 2: 1
bond.type: na
bond.value order: sing

1,11249,3
type: bond
of datablock: info:bmrb/11249
bond.assembly id: 1
bond.entry id: 11249
bond.id: 3
bond.atom id 1: SG
bond.atom id 2: FE2
bond.auth atom id 1: SG
bond.auth atom id 2: FE2
bond.auth comp id 1: CYS
bond.auth entity assembly name 1: apo GrxS14 2
bond.auth entity assembly name 2: [2Fe-2S] cluster
bond.auth seq id 1: 33
bond.comp id 1: CYS
bond.comp id 2: FES
bond.comp index id 1: 33
bond.comp index id 2: 1
bond.entity assembly id 1: 2
bond.entity assembly id 2: 5
bond.entity assembly name 1: apo GrxS14 no.2
bond.entity assembly name 2: [2Fe-2S] cluster
bond.entity id 1: 1
bond.entity id 2: 3
bond.seq id 1: 33
bond.seq id 2: 1
bond.type: na
bond.value order: sing

1,11249,4
type: bond
of datablock: info:bmrb/11249
bond.assembly id: 1
bond.entry id: 11249
bond.id: 4
bond.atom id 1: SG2
bond.atom id 2: FE2
bond.auth atom id 1: SG
bond.auth atom id 2: FE2
bond.auth entity assembly name 1: glutathione2
bond.auth entity assembly name 2: [2Fe-2S] cluster
bond.comp id 1: GSH
bond.comp id 2: FES
bond.comp index id 1: 1
bond.comp index id 2: 1
bond.entity assembly id 1: 4
bond.entity assembly id 2: 5
bond.entity assembly name 1: glutathione no.2
bond.entity assembly name 2: [2Fe-2S] cluster
bond.entity id 1: 2
bond.entity id 2: 3
bond.seq id 1: 1
bond.seq id 2: 1
bond.type: na
bond.value order: sing

11249,FES
type: chem comp
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp.entry id: 11249
chem comp.id: FES
chem comp.aromatic: no
chem comp.details: Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Jun 9 14:05:32 2009
chem comp.formal charge: 0
chem comp.formula: Fe2 S2
chem comp.formula weight: 175.820
chem comp.ideal coordinates missing flag: no
chem comp.model coordinates db code: 1CZP
chem comp.model coordinates missing flag: no
chem comp.name: FE2/S2 (INORGANIC) CLUSTER
chem comp.pdb code: FES
chem comp.processing site: RCSB
chem comp.provenance: na
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_FES
chem comp.three letter code: FES
chem comp.type: NON-POLYMER

info:pdb-ccd/FES

urn:miriam:pdb-ccd:FES

info:pdb.ligand/FES

urn:miriam:pdb.ligand:FES

11249,GSH
type: chem comp
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp.entry id: 11249
chem comp.id: GSH
chem comp.aromatic: no
chem comp.details: Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Jun 9 14:23:24 2009
chem comp.formal charge: 0
chem comp.formula: C10 H17 N3 O6 S
chem comp.formula weight: 307.323
chem comp.ideal coordinates missing flag: no
chem comp.model coordinates db code: 1DUG
chem comp.model coordinates missing flag: no
chem comp.name: GLUTATHIONE
chem comp.pdb code: GSH
chem comp.processing site: RCSB
chem comp.provenance: na
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_GSH
chem comp.three letter code: GSH
chem comp.type: NON-POLYMER

info:pdb-ccd/GSH

urn:miriam:pdb-ccd:GSH

info:pdb.ligand/GSH

urn:miriam:pdb.ligand:GSH

C1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: C1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 31.172
chem comp atom.model cartn x ideal: 0.306
chem comp atom.model cartn y: 53.847
chem comp atom.model cartn y ideal: -0.374
chem comp atom.model cartn z: 20.706
chem comp atom.model cartn z ideal: 6.000
chem comp atom.pdb atom id: C1
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: C2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 37.346
chem comp atom.model cartn x ideal: 0.569
chem comp atom.model cartn y: 57.714
chem comp atom.model cartn y ideal: 0.323
chem comp atom.model cartn z: 23.017
chem comp atom.model cartn z ideal: -2.508
chem comp atom.pdb atom id: C2
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C3,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: C3
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 37.907
chem comp atom.model cartn x ideal: 0.569
chem comp atom.model cartn y: 60.166
chem comp atom.model cartn y ideal: -0.456
chem comp atom.model cartn z: 20.621
chem comp atom.model cartn z ideal: -6.122
chem comp atom.pdb atom id: C3
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CA1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CA1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 30.857
chem comp atom.model cartn x ideal: 0.717
chem comp atom.model cartn y: 55.360
chem comp atom.model cartn y ideal: 0.449
chem comp atom.model cartn z: 20.819
chem comp atom.model cartn z ideal: 4.806
chem comp atom.pdb atom id: CA1
chem comp atom.stereo config: S
chem comp atom.type symbol: C

CA2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CA2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 36.116
chem comp atom.model cartn x ideal: -0.344
chem comp atom.model cartn y: 57.167
chem comp atom.model cartn y ideal: 0.035
chem comp atom.model cartn z: 23.759
chem comp atom.model cartn z ideal: -1.344
chem comp atom.pdb atom id: CA2
chem comp atom.stereo config: R
chem comp atom.type symbol: C

CA3,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CA3
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 38.183
chem comp atom.model cartn x ideal: 1.144
chem comp atom.model cartn y: 58.698
chem comp atom.model cartn y ideal: 0.153
chem comp atom.model cartn z: 20.898
chem comp atom.model cartn z ideal: -4.869
chem comp atom.pdb atom id: CA3
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CB1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CB1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 31.682
chem comp atom.model cartn x ideal: 0.133
chem comp atom.model cartn y: 56.017
chem comp atom.model cartn y ideal: -0.169
chem comp atom.model cartn z: 21.948
chem comp atom.model cartn z ideal: 3.534
chem comp atom.pdb atom id: CB1
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CB2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CB2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 36.612
chem comp atom.model cartn x ideal: -1.724
chem comp atom.model cartn y: 56.159
chem comp atom.model cartn y ideal: 0.638
chem comp atom.model cartn z: 24.826
chem comp atom.model cartn z ideal: -1.618
chem comp atom.pdb atom id: CB2
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CD1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CD1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 33.943
chem comp atom.model cartn x ideal: -0.023
chem comp atom.model cartn y: 56.783
chem comp atom.model cartn y ideal: 0.057
chem comp atom.model cartn z: 22.767
chem comp atom.model cartn z ideal: 1.070
chem comp atom.pdb atom id: CD1
chem comp atom.stereo config: N
chem comp atom.type symbol: C

CG1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: CG1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 33.168
chem comp atom.model cartn x ideal: 0.550
chem comp atom.model cartn y: 56.236
chem comp atom.model cartn y ideal: 0.666
chem comp atom.model cartn z: 21.535
chem comp atom.model cartn z ideal: 2.323
chem comp atom.pdb atom id: CG1
chem comp atom.stereo config: N
chem comp atom.type symbol: C

H12,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: H12
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 30.531
chem comp atom.model cartn x ideal: -1.095
chem comp atom.model cartn y: 52.090
chem comp atom.model cartn y ideal: -0.618
chem comp atom.model cartn z: 21.239
chem comp atom.model cartn z ideal: 7.418
chem comp atom.pdb atom id: H12
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H32,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: H32
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 36.864
chem comp atom.model cartn x ideal: 0.849
chem comp atom.model cartn y: 61.674
chem comp atom.model cartn y ideal: -0.716
chem comp atom.model cartn z: 21.138
chem comp atom.model cartn z ideal: -8.094
chem comp atom.pdb atom id: H32
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HA1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HA1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 31.143
chem comp atom.model cartn x ideal: 0.342
chem comp atom.model cartn y: 55.815
chem comp atom.model cartn y ideal: 1.466
chem comp atom.model cartn z: 19.842
chem comp atom.model cartn z ideal: 4.920
chem comp atom.pdb atom id: HA1
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HA2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HA2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 35.543
chem comp atom.model cartn x ideal: -0.437
chem comp atom.model cartn y: 57.989
chem comp atom.model cartn y ideal: -1.042
chem comp atom.model cartn z: 24.248
chem comp atom.model cartn z ideal: -1.214
chem comp atom.pdb atom id: HA2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HA31,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HA31
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 39.199
chem comp atom.model cartn x ideal: 1.237
chem comp atom.model cartn y: 58.530
chem comp atom.model cartn y ideal: 1.231
chem comp atom.model cartn z: 21.324
chem comp atom.model cartn z ideal: -5.000
chem comp atom.pdb atom id: HA31
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HA32,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HA32
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 38.306
chem comp atom.model cartn x ideal: 2.126
chem comp atom.model cartn y: 58.105
chem comp atom.model cartn y ideal: -0.275
chem comp atom.model cartn z: 19.961
chem comp atom.model cartn z ideal: -4.674
chem comp atom.pdb atom id: HA32
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB12,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HB12
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 31.212
chem comp atom.model cartn x ideal: 0.508
chem comp atom.model cartn y: 56.969
chem comp atom.model cartn y ideal: -1.186
chem comp atom.model cartn z: 22.290
chem comp atom.model cartn z ideal: 3.420
chem comp atom.pdb atom id: HB12
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB13,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HB13
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 31.607
chem comp atom.model cartn x ideal: -0.953
chem comp atom.model cartn y: 55.433
chem comp atom.model cartn y ideal: -0.189
chem comp atom.model cartn z: 22.895
chem comp atom.model cartn z ideal: 3.605
chem comp atom.pdb atom id: HB13
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB22,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HB22
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 37.214
chem comp atom.model cartn x ideal: -1.630
chem comp atom.model cartn y: 55.347
chem comp atom.model cartn y ideal: 1.716
chem comp atom.model cartn z: 24.355
chem comp atom.model cartn z ideal: -1.749
chem comp atom.pdb atom id: HB22
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HB23,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HB23
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 37.396
chem comp atom.model cartn x ideal: -2.139
chem comp atom.model cartn y: 56.618
chem comp atom.model cartn y ideal: 0.197
chem comp atom.model cartn z: 25.471
chem comp atom.model cartn z ideal: -2.524
chem comp atom.pdb atom id: HB23
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HG12,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HG12
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 33.634
chem comp atom.model cartn x ideal: 0.175
chem comp atom.model cartn y: 55.317
chem comp atom.model cartn y ideal: 1.683
chem comp atom.model cartn z: 21.108
chem comp atom.model cartn z ideal: 2.437
chem comp atom.pdb atom id: HG12
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HG13,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HG13
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 33.272
chem comp atom.model cartn x ideal: 1.638
chem comp atom.model cartn y: 56.889
chem comp atom.model cartn y ideal: 0.686
chem comp atom.model cartn z: 20.637
chem comp atom.model cartn z ideal: 2.252
chem comp atom.pdb atom id: HG13
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN11,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HN11
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 29.220
chem comp atom.model cartn x ideal: 2.408
chem comp atom.model cartn y: 56.613
chem comp atom.model cartn y ideal: 0.945
chem comp atom.model cartn z: 21.109
chem comp atom.model cartn z ideal: 3.847
chem comp atom.pdb atom id: HN11
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN12,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HN12
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 29.080
chem comp atom.model cartn x ideal: 2.483
chem comp atom.model cartn y: 55.108
chem comp atom.model cartn y ideal: -0.482
chem comp atom.model cartn z: 21.847
chem comp atom.model cartn z ideal: 4.606
chem comp atom.pdb atom id: HN12
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HN2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 35.562
chem comp atom.model cartn x ideal: 0.755
chem comp atom.model cartn y: 55.782
chem comp atom.model cartn y ideal: 1.431
chem comp atom.model cartn z: 22.121
chem comp atom.model cartn z ideal: -0.182
chem comp atom.pdb atom id: HN2
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HN3,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HN3
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 36.146
chem comp atom.model cartn x ideal: -0.558
chem comp atom.model cartn y: 58.100
chem comp atom.model cartn y ideal: -0.636
chem comp atom.model cartn z: 21.464
chem comp atom.model cartn z ideal: -3.876
chem comp atom.pdb atom id: HN3
chem comp atom.stereo config: N
chem comp atom.type symbol: H

HSG,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: HSG
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 35.571
chem comp atom.model cartn x ideal: -3.948
chem comp atom.model cartn y: 54.845
chem comp atom.model cartn y ideal: 0.889
chem comp atom.model cartn z: 26.491
chem comp atom.model cartn z ideal: -0.651
chem comp atom.pdb atom id: HSG
chem comp atom.stereo config: N
chem comp atom.type symbol: H

N1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: N1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 29.428
chem comp atom.model cartn x ideal: 2.182
chem comp atom.model cartn y: 55.618
chem comp atom.model cartn y ideal: 0.475
chem comp atom.model cartn z: 21.035
chem comp atom.model cartn z ideal: 4.710
chem comp atom.pdb atom id: N1
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: N2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 35.249
chem comp atom.model cartn x ideal: 0.214
chem comp atom.model cartn y: 56.484
chem comp atom.model cartn y ideal: 0.628
chem comp atom.model cartn z: 22.793
chem comp atom.model cartn z ideal: -0.127
chem comp atom.pdb atom id: N2
chem comp atom.stereo config: N
chem comp atom.type symbol: N

N3,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: N3
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 37.120
chem comp atom.model cartn x ideal: 0.255
chem comp atom.model cartn y: 58.164
chem comp atom.model cartn y ideal: -0.126
chem comp atom.model cartn z: 21.761
chem comp atom.model cartn z ideal: -3.739
chem comp atom.pdb atom id: N3
chem comp atom.stereo config: N
chem comp atom.type symbol: N

O11,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: O11
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 32.169
chem comp atom.model cartn x ideal: 1.001
chem comp atom.model cartn y: 53.494
chem comp atom.model cartn y ideal: -1.291
chem comp atom.model cartn z: 20.068
chem comp atom.model cartn z ideal: 6.369
chem comp atom.pdb atom id: O11
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O12,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: O12
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 30.338
chem comp atom.model cartn x ideal: -0.831
chem comp atom.model cartn y: 53.018
chem comp atom.model cartn y ideal: -0.089
chem comp atom.model cartn z: 21.309
chem comp atom.model cartn z ideal: 6.652
chem comp atom.pdb atom id: O12
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: O2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 38.471
chem comp atom.model cartn x ideal: 1.586
chem comp atom.model cartn y: 57.755
chem comp atom.model cartn y ideal: 0.961
chem comp atom.model cartn z: 23.531
chem comp atom.model cartn z ideal: -2.336
chem comp atom.pdb atom id: O2
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O31,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: O31
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 38.580
chem comp atom.model cartn x ideal: -0.474
chem comp atom.model cartn y: 60.693
chem comp atom.model cartn y ideal: -1.062
chem comp atom.model cartn z: 19.719
chem comp atom.model cartn z ideal: -6.075
chem comp atom.pdb atom id: O31
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O32,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: O32
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 37.037
chem comp atom.model cartn x ideal: 1.217
chem comp atom.model cartn y: 60.756
chem comp atom.model cartn y ideal: -0.325
chem comp atom.model cartn z: 21.312
chem comp atom.model cartn z ideal: -7.290
chem comp atom.pdb atom id: O32
chem comp atom.stereo config: N
chem comp atom.type symbol: O

OE1,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: OE1
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 33.375
chem comp atom.model cartn x ideal: -0.700
chem comp atom.model cartn y: 57.449
chem comp atom.model cartn y ideal: -0.947
chem comp atom.model cartn z: 23.647
chem comp atom.model cartn z ideal: 1.139
chem comp atom.pdb atom id: OE1
chem comp atom.stereo config: N
chem comp atom.type symbol: O

SG2,GSH,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: SG2
chem comp atom.comp id: GSH
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 35.267
chem comp atom.model cartn x ideal: -2.823
chem comp atom.model cartn y: 55.464
chem comp atom.model cartn y ideal: 0.291
chem comp atom.model cartn z: 25.837
chem comp atom.model cartn z ideal: -0.218
chem comp atom.pdb atom id: SG2
chem comp atom.stereo config: N
chem comp atom.type symbol: S

FE1,FES,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: FE1
chem comp atom.comp id: FES
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.237
chem comp atom.model cartn x ideal: 0.000
chem comp atom.model cartn y: 5.409
chem comp atom.model cartn y ideal: -0.213
chem comp atom.model cartn z: 27.398
chem comp atom.model cartn z ideal: -1.531
chem comp atom.pdb atom id: FE1
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

FE2,FES,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: FE2
chem comp atom.comp id: FES
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 16.361
chem comp atom.model cartn x ideal: 0.000
chem comp atom.model cartn y: 2.666
chem comp atom.model cartn y ideal: -0.213
chem comp atom.model cartn z: 27.488
chem comp atom.model cartn z ideal: 1.531
chem comp atom.pdb atom id: FE2
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

S1,FES,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: S1
chem comp atom.comp id: FES
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 17.422
chem comp atom.model cartn x ideal: 1.461
chem comp atom.model cartn y: 4.079
chem comp atom.model cartn y ideal: 0.372
chem comp atom.model cartn z: 28.829
chem comp atom.model cartn z ideal: 0.000
chem comp atom.pdb atom id: S1
chem comp atom.stereo config: N
chem comp atom.type symbol: S

S2,FES,11249
type: chem comp atom
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem comp atom.atom id: S2
chem comp atom.comp id: FES
chem comp atom.entry id: 11249
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.380
chem comp atom.model cartn x ideal: -1.461
chem comp atom.model cartn y: 3.919
chem comp atom.model cartn y ideal: 0.372
chem comp atom.model cartn z: 25.972
chem comp atom.model cartn z ideal: 0.000
chem comp atom.pdb atom id: S2
chem comp atom.stereo config: N
chem comp atom.type symbol: S

FES,11249,1
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: FES
chem comp bond.entry id: 11249
chem comp bond.id: 1
chem comp bond.atom id 1: FE1
chem comp bond.atom id 2: S1
chem comp bond.value order: SING

GSH,11249,2
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 2
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: CA1
chem comp bond.value order: SING

FES,11249,3
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: FES
chem comp bond.entry id: 11249
chem comp bond.id: 3
chem comp bond.atom id 1: FE1
chem comp bond.atom id 2: S2
chem comp bond.value order: SING

GSH,11249,4
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 4
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: HN11
chem comp bond.value order: SING

GSH,11249,5
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 5
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: HN12
chem comp bond.value order: SING

FES,11249,6
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: FES
chem comp bond.entry id: 11249
chem comp bond.id: 6
chem comp bond.atom id 1: FE2
chem comp bond.atom id 2: S1
chem comp bond.value order: SING

FES,11249,7
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: FES
chem comp bond.entry id: 11249
chem comp bond.id: 7
chem comp bond.atom id 1: FE2
chem comp bond.atom id 2: S2
chem comp bond.value order: SING

GSH,11249,8
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 8
chem comp bond.atom id 1: CA1
chem comp bond.atom id 2: C1
chem comp bond.value order: SING

GSH,11249,9
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 9
chem comp bond.atom id 1: CA1
chem comp bond.atom id 2: CB1
chem comp bond.value order: SING

GSH,11249,10
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 10
chem comp bond.atom id 1: CA1
chem comp bond.atom id 2: HA1
chem comp bond.value order: SING

GSH,11249,11
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 11
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O11
chem comp bond.value order: DOUB

GSH,11249,12
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 12
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O12
chem comp bond.value order: SING

GSH,11249,13
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 13
chem comp bond.atom id 1: O12
chem comp bond.atom id 2: H12
chem comp bond.value order: SING

GSH,11249,14
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 14
chem comp bond.atom id 1: CB1
chem comp bond.atom id 2: CG1
chem comp bond.value order: SING

GSH,11249,15
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 15
chem comp bond.atom id 1: CB1
chem comp bond.atom id 2: HB12
chem comp bond.value order: SING

GSH,11249,16
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 16
chem comp bond.atom id 1: CB1
chem comp bond.atom id 2: HB13
chem comp bond.value order: SING

GSH,11249,17
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 17
chem comp bond.atom id 1: CG1
chem comp bond.atom id 2: CD1
chem comp bond.value order: SING

GSH,11249,18
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 18
chem comp bond.atom id 1: CG1
chem comp bond.atom id 2: HG12
chem comp bond.value order: SING

GSH,11249,19
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 19
chem comp bond.atom id 1: CG1
chem comp bond.atom id 2: HG13
chem comp bond.value order: SING

GSH,11249,20
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 20
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: OE1
chem comp bond.value order: DOUB

GSH,11249,21
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 21
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: N2
chem comp bond.value order: SING

GSH,11249,22
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 22
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: CA2
chem comp bond.value order: SING

GSH,11249,23
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 23
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: HN2
chem comp bond.value order: SING

GSH,11249,24
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 24
chem comp bond.atom id 1: CA2
chem comp bond.atom id 2: C2
chem comp bond.value order: SING

GSH,11249,25
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 25
chem comp bond.atom id 1: CA2
chem comp bond.atom id 2: CB2
chem comp bond.value order: SING

GSH,11249,26
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 26
chem comp bond.atom id 1: CA2
chem comp bond.atom id 2: HA2
chem comp bond.value order: SING

GSH,11249,27
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 27
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: O2
chem comp bond.value order: DOUB

GSH,11249,28
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 28
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N3
chem comp bond.value order: SING

GSH,11249,29
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 29
chem comp bond.atom id 1: CB2
chem comp bond.atom id 2: SG2
chem comp bond.value order: SING

GSH,11249,30
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 30
chem comp bond.atom id 1: CB2
chem comp bond.atom id 2: HB22
chem comp bond.value order: SING

GSH,11249,31
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 31
chem comp bond.atom id 1: CB2
chem comp bond.atom id 2: HB23
chem comp bond.value order: SING

GSH,11249,32
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 32
chem comp bond.atom id 1: SG2
chem comp bond.atom id 2: HSG
chem comp bond.value order: SING

GSH,11249,33
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 33
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: CA3
chem comp bond.value order: SING

GSH,11249,34
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 34
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: HN3
chem comp bond.value order: SING

GSH,11249,35
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 35
chem comp bond.atom id 1: CA3
chem comp bond.atom id 2: C3
chem comp bond.value order: SING

GSH,11249,36
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 36
chem comp bond.atom id 1: CA3
chem comp bond.atom id 2: HA31
chem comp bond.value order: SING

GSH,11249,37
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 37
chem comp bond.atom id 1: CA3
chem comp bond.atom id 2: HA32
chem comp bond.value order: SING

GSH,11249,38
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 38
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: O31
chem comp bond.value order: DOUB

GSH,11249,39
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 39
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: O32
chem comp bond.value order: SING

GSH,11249,40
type: chem comp bond
of datablock: info:bmrb/11249
chem comp bond.comp id: GSH
chem comp bond.entry id: 11249
chem comp bond.id: 40
chem comp bond.atom id 1: O32
chem comp bond.atom id 2: H32
chem comp bond.value order: SING

https://bmrbpub.pdbj.org/rdf/bmr11249/chem_comp_descriptor/GSH,C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N,11249,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N
chem comp descriptor.entry id: 11249
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

https://bmrbpub.pdbj.org/rdf/bmr11249/chem_comp_descriptor/GSH,C(CC(=O)N(CaaH)(CS)C(=O)NCC(=O)O)(CaaH)(C(=O)O)N,11249,OECHEM,1.5.0,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N
chem comp descriptor.entry id: 11249
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

h12-13,15,18H,11249,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1/f/h12-13,15,18H
chem comp descriptor.entry id: 11249
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

https://bmrbpub.pdbj.org/rdf/bmr11249/chem_comp_descriptor/GSH,N(CaaH)(CCC(=O)N(CaaH)(CS)C(=O)NCC(O)=O)C(O)=O,11249,CACTVS,3.341,SMILES_CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(O)=O)C(O)=O
chem comp descriptor.entry id: 11249
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

https://bmrbpub.pdbj.org/rdf/bmr11249/chem_comp_descriptor/GSH,N(CH)(CCC(=O)N(CH)(CS)C(=O)NCC(O)=O)C(O)=O,11249,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: N[CH](CCC(=O)N[CH](CS)C(=O)NCC(O)=O)C(O)=O
chem comp descriptor.entry id: 11249
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

https://bmrbpub.pdbj.org/rdf/bmr11249/chem_comp_descriptor/GSH,O=C(NCC(=O)O)C(NC(=O)CCC(C(=O)O)N)CS,11249,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: O=C(NCC(=O)O)C(NC(=O)CCC(C(=O)O)N)CS
chem comp descriptor.entry id: 11249
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

GSH,RWSXRVCMGQZWBV-VSCBVDDUDG,11249,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: GSH
chem comp descriptor.descriptor: RWSXRVCMGQZWBV-VSCBVDDUDG
chem comp descriptor.entry id: 11249
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

FES,(Fe)1S(Fe)S1,11249,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: [Fe]1S[Fe]S1
chem comp descriptor.entry id: 11249
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

c1-3-2-4-1,11249,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: InChI=1/2Fe.2S/rFe2S2/c1-3-2-4-1
chem comp descriptor.entry id: 11249
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

FES,NIXDOXVAJZFRNF-PFILUXNYAP,11249,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: NIXDOXVAJZFRNF-PFILUXNYAP
chem comp descriptor.entry id: 11249
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

FES,S1(Fe)S(Fe)1,11249,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: S1[Fe]S[Fe]1
chem comp descriptor.entry id: 11249
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

FES,S1(Fe)S(Fe)1,11249,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: S1[Fe]S[Fe]1
chem comp descriptor.entry id: 11249
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

FES,S1(Fe)S(Fe)1,11249,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: S1[Fe]S[Fe]1
chem comp descriptor.entry id: 11249
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

FES,S1(Fe)S(Fe)1,11249,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/11249
chem comp descriptor.comp id: FES
chem comp descriptor.descriptor: S1[Fe]S[Fe]1
chem comp descriptor.entry id: 11249
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

chem comp identifierCategory
has chem comp identifier: GSH,11249,(2S)-2-amino-5-(((2R)-1-(carboxymethylamino)-1-oxo-3-sulfanyl-propan-2-yl)amino)-5-oxo-pentanoic acid,OECHEM,1.5.0,systematic name
has chem comp identifier: GSH,11249,L-gamma-glutamyl-L-cysteinylglycine,ACD,10.04,systematic name
has chem comp identifier: 11249
has chem comp identifier: 1
has chem comp identifier: 3
has chem comp identifier: FES,11249,di-mu-sulfidediiron,ACD,10.04,systematic name

GSH,11249,(2S)-2-amino-5-(((2R)-1-(carboxymethylamino)-1-oxo-3-sulfanyl-propan-2-yl)amino)-5-oxo-pentanoic acid,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/11249
chem comp identifier.comp id: GSH
chem comp identifier.entry id: 11249
chem comp identifier.identifier: (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanyl-propan-2-yl]amino]-5-oxo-pentanoic acid
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

GSH,11249,L-gamma-glutamyl-L-cysteinylglycine,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/11249
chem comp identifier.comp id: GSH
chem comp identifier.entry id: 11249
chem comp identifier.identifier: L-gamma-glutamyl-L-cysteinylglycine
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

FES,11249,di-mu-sulfidediiron,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/11249
chem comp identifier.comp id: FES
chem comp identifier.entry id: 11249
chem comp identifier.identifier: di-mu-sulfidediiron
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

1,11249,1
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 1
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.800
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 26
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 112490301

1,11249,2
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 2
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 27
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,3
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 3
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 28
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,4
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 4
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 29
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,5
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 5
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.200
chem shift completeness char.arom chem shift coverage: 0.100
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.556
chem shift completeness char.chem shift coverage: 0.444
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 30
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.429
chem shift completeness char.sc chem shift coverage: 0.308
chem shift completeness char.sf id: 112490301

1,11249,6
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 6
chem shift completeness char.bb chem shift 13c coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 13c coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 31
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 112490301

1,11249,7
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 7
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.929
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 32
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,8
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 8
chem shift completeness char.bb chem shift 13c coverage: 0.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 13c coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 112490301

1,11249,9
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 9
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 34
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: 112490301

1,11249,10
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 10
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.167
chem shift completeness char.chem shift 13c coverage: 0.125
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.056
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 35
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 112490301

1,11249,11
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 11
chem shift completeness char.bb chem shift 13c coverage: 0.333
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.375
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 36
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 112490301

1,11249,12
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 12
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.875
chem shift completeness char.chem shift coverage: 0.786
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 37
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,13
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 13
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 38
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,14
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 14
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.727
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 39
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,15
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 15
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.818
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 40
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,16
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 16
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 41
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,17
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 17
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 42
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,18
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 18
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 43
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,19
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 19
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 44
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,20
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 20
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 45
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,21
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 21
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 46
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,22
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 22
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 47
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,23
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 23
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 48
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,24
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 24
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 49
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,25
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 25
chem shift completeness char.arom chem shift 13c coverage: 0.200
chem shift completeness char.arom chem shift 1h coverage: 0.400
chem shift completeness char.arom chem shift coverage: 0.300
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.611
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 50
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.571
chem shift completeness char.sc chem shift coverage: 0.462
chem shift completeness char.sf id: 112490301

1,11249,26
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 26
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 51
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,27
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 27
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 52
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,28
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 28
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 53
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,29
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 29
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 54
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,30
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 30
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 55
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,31
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 31
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 56
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,32
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 32
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 57
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,33
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 33
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 58
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,34
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 34
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 59
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,35
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 35
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 60
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,36
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 36
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 61
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,37
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 37
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 62
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.857
chem shift completeness char.sc chem shift coverage: 0.818
chem shift completeness char.sf id: 112490301

1,11249,38
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 38
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 63
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,39
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 39
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 64
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: 112490301

1,11249,40
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 40
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 65
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,41
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 41
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 66
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,42
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 42
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 67
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,43
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 43
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.250
chem shift completeness char.arom chem shift coverage: 0.125
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.625
chem shift completeness char.chem shift coverage: 0.563
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 68
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.364
chem shift completeness char.sf id: 112490301

1,11249,44
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 44
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 69
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,45
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 45
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 70
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,46
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 46
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.400
chem shift completeness char.chem shift coverage: 0.350
chem shift completeness char.comp id: TRP
chem shift completeness char.comp index id: 71
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.250
chem shift completeness char.sc chem shift coverage: 0.200
chem shift completeness char.sf id: 112490301

1,11249,47
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 47
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.917
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 72
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,48
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 48
chem shift completeness char.bb chem shift 13c coverage: 0.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.000
chem shift completeness char.chem shift 13c coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 73
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 0.000
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.000
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 112490301

1,11249,49
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 49
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.278
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 74
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 112490301

1,11249,50
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 50
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 75
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,51
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 51
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.625
chem shift completeness char.chem shift coverage: 0.786
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 76
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 112490301

1,11249,52
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 52
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 77
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,53
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 53
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 78
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.333
chem shift completeness char.sc chem shift coverage: 0.273
chem shift completeness char.sf id: 112490301

1,11249,54
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 54
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 79
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,55
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 55
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 80
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,56
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 56
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 81
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: 112490301

1,11249,57
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 57
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 82
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,58
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 58
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.200
chem shift completeness char.arom chem shift coverage: 0.100
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.375
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.556
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 83
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.429
chem shift completeness char.sc chem shift coverage: 0.308
chem shift completeness char.sf id: 112490301

1,11249,59
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 59
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.389
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 84
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 112490301

1,11249,60
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 60
chem shift completeness char.bb chem shift 13c coverage: 0.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.167
chem shift completeness char.chem shift 13c coverage: 0.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.286
chem shift completeness char.chem shift coverage: 0.154
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 1
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.200
chem shift completeness char.sc chem shift coverage: 0.125
chem shift completeness char.sf id: 112490301

1,11249,61
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 61
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.571
chem shift completeness char.comp id: ALA
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,62
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 62
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 3
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,63
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 63
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.889
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 4
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,64
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 64
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,65
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 65
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
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 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,66
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 66
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,67
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 67
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 8
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,68
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 68
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,69
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 69
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,70
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 70
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
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 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,71
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 71
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 12
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,72
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 72
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,73
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 73
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,74
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 74
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,75
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 75
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,76
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 76
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 17
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,77
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 77
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.600
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 18
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.429
chem shift completeness char.sf id: 112490301

1,11249,78
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 78
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 19
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,79
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 79
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,80
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 80
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,81
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 81
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.833
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: LEU
chem shift completeness char.comp index id: 22
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 0.500
chem shift completeness char.methyl chem shift 1h coverage: 0.500
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 13c coverage: 0.750
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.778
chem shift completeness char.sf id: 112490301

1,11249,82
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 82
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.375
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.444
chem shift completeness char.chem shift coverage: 0.444
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 23
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.231
chem shift completeness char.sf id: 112490301

1,11249,83
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 83
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.429
chem shift completeness char.chem shift coverage: 0.615
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 24
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.667
chem shift completeness char.sc chem shift 1h coverage: 0.200
chem shift completeness char.sc chem shift coverage: 0.375
chem shift completeness char.sf id: 112490301

1,11249,84
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 84
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.882
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 25
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.750
chem shift completeness char.sc chem shift coverage: 0.833
chem shift completeness char.sf id: 112490301

1,11249,85
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 85
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 85
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: 112490301

1,11249,86
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 86
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 86
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: 112490301

1,11249,87
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 87
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.625
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 87
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,88
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 88
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 88
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,89
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 89
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ILE
chem shift completeness char.comp index id: 89
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,90
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 90
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: THR
chem shift completeness char.comp index id: 90
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,91
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 91
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.833
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 91
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,92
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 92
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 92
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,93
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 93
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 93
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,94
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 94
chem shift completeness char.arom chem shift 13c coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.250
chem shift completeness char.arom chem shift coverage: 0.125
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.429
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.625
chem shift completeness char.chem shift coverage: 0.563
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 94
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.364
chem shift completeness char.sf id: 112490301

1,11249,95
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 95
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 95
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,96
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 96
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 96
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,97
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
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chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLY
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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: 112490301

1,11249,98
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
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chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
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chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,99
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
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chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LEU
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chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,100
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 100
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 100
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,101
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 101
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 101
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,102
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 102
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 102
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,103
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 103
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 103
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,104
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 104
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 104
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,105
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 105
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 105
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,106
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 106
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 106
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,107
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 107
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 0.800
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.857
chem shift completeness char.chem shift coverage: 0.846
chem shift completeness char.comp id: MET
chem shift completeness char.comp index id: 107
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.667
chem shift completeness char.sc chem shift 1h coverage: 0.800
chem shift completeness char.sc chem shift coverage: 0.750
chem shift completeness char.sf id: 112490301

1,11249,108
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 108
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 108
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249,109
type: chem shift completeness char
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 11249
chem shift completeness char.id: 109
chem shift completeness char.bb chem shift 13c coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 13c coverage: 1.000
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 109
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 112490301

1,11249
type: chem shift completeness list
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
chem shift completeness list.assigned chem shift list id: 1
chem shift completeness list.entry id: 11249
chem shift completeness list.arom chem shift 13c fraction: 1/54
chem shift completeness list.arom chem shift 15n fraction: 0/1
chem shift completeness list.arom chem shift 1h fraction: 6/55
chem shift completeness list.arom chem shift fraction: 7/110
chem shift completeness list.assigned residue coverage: 0.972
chem shift completeness list.bb chem shift 13c fraction: 290/320
chem shift completeness list.bb chem shift 15n fraction: 91/104
chem shift completeness list.bb chem shift 1h fraction: 196/213
chem shift completeness list.bb chem shift fraction: 577/637
chem shift completeness list.chem shift 13c fraction: 418/509
chem shift completeness list.chem shift 15n fraction: 101/116
chem shift completeness list.chem shift 1h fraction: 574/671
chem shift completeness list.chem shift fraction: 1093/1296
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr11249_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 13c fraction: 61/63
chem shift completeness list.methyl chem shift 1h fraction: 61/63
chem shift completeness list.methyl chem shift fraction: 122/126
chem shift completeness list.output file name: bmr11249_chem_shift_completeness.str
chem shift completeness list.queried date: 2016-07-27Z
chem shift completeness list.sc chem shift 13c fraction: 224/291
chem shift completeness list.sc chem shift 15n fraction: 10/12
chem shift completeness list.sc chem shift 1h fraction: 378/458
chem shift completeness list.sc chem shift fraction: 612/761
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: 112490301

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type: chem shift experiment
of datablock: info:bmrb/11249
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 11249
chem shift experiment.experiment id: 2
chem shift experiment.experiment name: 3D HNCACB
chem shift experiment.sample id: 1
chem shift experiment.sample label: sample_1
chem shift experiment.sample state: isotropic

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type: chem shift experiment
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chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 11249
chem shift experiment.experiment id: 3
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chem shift experiment.sample id: 1
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chem shift experiment.sample state: isotropic

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type: chem shift experiment
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chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 11249
chem shift experiment.experiment id: 7
chem shift experiment.experiment name: 3D HCCH-COSY
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chem shift experiment.sample state: isotropic

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type: chem shift experiment
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chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 11249
chem shift experiment.experiment id: 8
chem shift experiment.experiment name: 3D CBCA(CO)NH
chem shift experiment.sample id: 1
chem shift experiment.sample label: sample_1
chem shift experiment.sample state: isotropic

13,C,1,11249,DSS
type: chem shift ref
of datablock: info:bmrb/11249
chem shift ref.atom isotope number: 13
chem shift ref.atom type: C
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 11249
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: 0.2514495
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: indirect

1,H,1,11249,DSS
type: chem shift ref
of datablock: info:bmrb/11249
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: 11249
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

15,N,1,11249,DSS
type: chem shift ref
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chem shift ref.atom isotope number: 15
chem shift ref.atom type: N
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 11249
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: 0.1013291
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
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11249,1
type: chem shift reference
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chem shift reference.entry id: 11249
chem shift reference.id: 1
chem shift reference.sf category: chem_shift_reference
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1,11249,1
type: chem shift software
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chem shift software.assigned chem shift list id: 1
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chem shift software.software id: 1
chem shift software.method id: 0
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type: chem shift software
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chem shift software.entry id: 11249
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chem shift software.method id: 0
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1,11249,3
type: chem shift software
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chem shift software.assigned chem shift list id: 1
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chem shift software.software id: 3
chem shift software.method id: 0
chem shift software.software label: xwinnmr

1,11249,4
type: chem shift software
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chem shift software.assigned chem shift list id: 1
chem shift software.entry id: 11249
chem shift software.software id: 4
chem shift software.method id: 0
chem shift software.software label: TOPSPIN

11249,1
type: citation
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
citation.entry id: 11249
citation.id: 1
citation.class: entry citation
citation.doi: 10.1007/s12104-010-9282-1
citation.journal abbrev: Biomol. NMR Assign.
citation.journal issn: 1874-2718
citation.journal issue: 1
citation.journal name full: Biomolecular NMR assignments
citation.journal volume: 5
citation.page first: 121
citation.page last: 124
citation.pubmed id: 21086077
citation.sf category: citations
citation.sf framecode: entry_citation
citation.status: published
citation.title: 1H, 13C, and 15N resonance assignments of reduced GrxS14 from Populus tremula × tremuloides.
citation.type: journal
citation.year: 2011

info:doi/10.1007/s12104-010-9282-1

urn:miriam:doi:10.1007/s12104-010-9282-1

urn:ISSN:1874-2718

urn:miriam:issn:1874-2718

info:pmid/21086077

urn:miriam:pubmed:21086077

1,11249,1
type: citation author
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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 1
citation author.family name: Wang
citation author.given name: Lei
citation author.pdbx name: Wang, L.

1,11249,2
type: citation author
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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 2
citation author.family name: Ren
citation author.given name: Xiaobai
citation author.pdbx name: Ren, X.

1,11249,3
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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 3
citation author.family name: Li
citation author.given name: Yifei
citation author.pdbx name: Li, Y.

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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 4
citation author.family name: Rouhier
citation author.given name: Nicolas
citation author.pdbx name: Rouhier, N.

1,11249,5
type: citation author
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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 5
citation author.family name: Jacquot
citation author.given name: Jean-Pierre
citation author.pdbx name: Jacquot, J.

1,11249,6
type: citation author
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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 6
citation author.family name: Jin
citation author.given name: Changwen
citation author.pdbx name: Jin, C.

1,11249,7
type: citation author
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citation author.citation id: 1
citation author.entry id: 11249
citation author.ordinal: 7
citation author.family name: Xia
citation author.given name: Bin
citation author.pdbx name: Xia, B.

1,11249,Glutaredoxin
type: citation keyword
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citation keyword.citation id: 1
citation keyword.entry id: 11249
citation keyword.keyword: Glutaredoxin

11249,assigned chemical shifts
type: data set
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data set.entry id: 11249
data set.type: assigned_chemical_shifts
data set.count: 1

11249,13C chemical shifts
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datum.entry id: 11249
datum.type: 13C chemical shifts
datum.count: 409

11249,15N chemical shifts
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datum.entry id: 11249
datum.type: 15N chemical shifts
datum.count: 97

11249,1H chemical shifts
type: datum
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reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
datum.entry id: 11249
datum.type: 1H chemical shifts
datum.count: 690

11249,1
type: entity
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reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
entity.entry id: 11249
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.db query revised last date: 2015-11-25Z
entity.formula weight: 12183.91
entity.name: apo GrxS14
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 109
entity.paramagnetic: no
entity.parent entity id: 0
entity.polymer seq one letter code: MALTPALKTTLDKVVTSHKVVLFMKGTKDFPQCGFSQTVVQILKSLNAPFESVNILENELLRQGLKEYSSWPTFPQLYIDGEFFGGCDITVEAYKSGELQEQVEKAMCS
entity.polymer seq one letter code can: MALTPALKTTLDKVVTSHKVVLFMKGTKDFPQCGFSQTVVQILKSLNAPFESVNILENELLRQGLKEYSSWPTFPQLYIDGEFFGGCDITVEAYKSGELQEQVEKAMCS
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: GrxS14
entity.thiol state: free and disulfide bound
entity.type: polymer

11249,2
type: entity
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entity.entry id: 11249
entity.id: 2
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 307.323
entity.name: GSH
entity.nonpolymer comp id: GSH
entity.nonpolymer comp label: chem_comp_GSH
entity.nstd chirality: no
entity.nstd linkage: no
entity.parent entity id: 2
entity.polymer seq one letter code can: (GSH)
entity.sf category: entity
entity.sf framecode: GSH
entity.type: non-polymer

11249,3
type: entity
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entity.entry id: 11249
entity.id: 3
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 175.820
entity.name: FES
entity.nonpolymer comp id: FES
entity.nonpolymer comp label: chem_comp_FES
entity.nstd chirality: no
entity.nstd linkage: no
entity.parent entity id: 3
entity.polymer seq one letter code can: (FES)
entity.sf category: entity
entity.sf framecode: FES
entity.type: non-polymer

1,11249,1
type: entity assembly
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entity assembly.assembly id: 1
entity assembly.entry id: 11249
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: apo GrxS14 no.1
entity assembly.entity id: 1
entity assembly.entity label: GrxS14
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,11249,2
type: entity assembly
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entity assembly.assembly id: 1
entity assembly.entry id: 11249
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: apo GrxS14 no.2
entity assembly.entity id: 1
entity assembly.entity label: GrxS14
entity assembly.experimental data reported: yes
entity assembly.physical state: native

1,11249,3
type: entity assembly
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entity assembly.assembly id: 1
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entity assembly.id: 3
entity assembly.asym id: C
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: glutathione no.1
entity assembly.entity id: 2
entity assembly.entity label: GSH
entity assembly.experimental data reported: no
entity assembly.physical state: native

1,11249,4
type: entity assembly
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entity assembly.assembly id: 1
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entity assembly.id: 4
entity assembly.asym id: D
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: glutathione no.2
entity assembly.entity id: 2
entity assembly.entity label: GSH
entity assembly.experimental data reported: no
entity assembly.physical state: native

1,11249,5
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entity assembly.id: 5
entity assembly.asym id: E
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: [2Fe-2S] cluster
entity assembly.entity id: 3
entity assembly.entity label: FES
entity assembly.experimental data reported: no
entity assembly.physical state: native

1,11249,1
type: entity comp index
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entity comp index.id: 1
entity comp index.comp id: MET

1,11249,2
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entity comp index.comp id: ALA

1,11249,3
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1,11249,4
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1,11249,5
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1,11249,6
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1,11249,7
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1,11249,8
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1,11249,9
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1,11249,10
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1,11249,11
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1,11249,12
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1,11249,13
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1,11249,14
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1,11249,15
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1,11249,16
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1,11249,17
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1,11249,18
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1,11249,19
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1,11249,20
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1,11249,21
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1,11249,23
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1,11249,25
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1,11249,30
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1,11249,31
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1,11249,34
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1,11249,36
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1,11249,38
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1,11249,42
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of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 87
entity comp index.comp id: CYS

1,11249,88
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 88
entity comp index.comp id: ASP

1,11249,89
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 89
entity comp index.comp id: ILE

1,11249,90
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 90
entity comp index.comp id: THR

1,11249,91
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 91
entity comp index.comp id: VAL

1,11249,92
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 92
entity comp index.comp id: GLU

1,11249,93
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 93
entity comp index.comp id: ALA

1,11249,94
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 94
entity comp index.comp id: TYR

1,11249,95
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 95
entity comp index.comp id: LYS

1,11249,96
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 96
entity comp index.comp id: SER

1,11249,97
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 97
entity comp index.comp id: GLY

1,11249,98
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 98
entity comp index.comp id: GLU

1,11249,99
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 99
entity comp index.comp id: LEU

1,11249,100
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 100
entity comp index.comp id: GLN

1,11249,101
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 101
entity comp index.comp id: GLU

1,11249,102
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 102
entity comp index.comp id: GLN

1,11249,103
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 103
entity comp index.comp id: VAL

1,11249,104
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 104
entity comp index.comp id: GLU

1,11249,105
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 105
entity comp index.comp id: LYS

1,11249,106
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 106
entity comp index.comp id: ALA

1,11249,107
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 107
entity comp index.comp id: MET

1,11249,108
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 108
entity comp index.comp id: CYS

1,11249,109
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 1
entity comp index.entry id: 11249
entity comp index.id: 109
entity comp index.comp id: SER

2,11249,110
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 2
entity comp index.entry id: 11249
entity comp index.id: 110
entity comp index.comp id: GSH

3,11249,111
type: entity comp index
of datablock: info:bmrb/11249
entity comp index.entity id: 3
entity comp index.entry id: 11249
entity comp index.id: 111
entity comp index.comp id: FES

2LKU,PDB,1,11249
type: entity db link
of datablock: info:bmrb/11249
entity db link.accession code: 2LKU
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 11249
entity db link.author supplied: no
entity db link.entry mol name: Solution Structure Of Reduced Poplar Apo Grxs14
entity db link.ordinal: 1
entity db link.seq homology expectation val: 2.19E-73
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 109

info:pdb/2LKU

urn:miriam:pdb:2LKU

EEE98719,GB,1,11249
type: entity db link
of datablock: info:bmrb/11249
entity db link.accession code: EEE98719
entity db link.database code: GB
entity db link.entity id: 1
entity db link.entry id: 11249
entity db link.author supplied: no
entity db link.entry mol name: hypothetical protein POPTR_0014s13760g [Populus trichocarpa]
entity db link.ordinal: 2
entity db link.seq homology expectation val: 1.76E-71
entity db link.seq identity: 98.15
entity db link.seq positive: 99.07
entity db link.seq query to submitted percent: 99.08
entity db link.seq subject length: 172

info:ddbj-embl-genbank/EEE98719

urn:miriam:ncbiprotein:EEE98719

XP 002320404,REF,1,11249
type: entity db link
of datablock: info:bmrb/11249
entity db link.accession code: XP_002320404
entity db link.database code: REF
entity db link.entity id: 1
entity db link.entry id: 11249
entity db link.author supplied: no
entity db link.entry mol name: hypothetical protein POPTR_0014s13760g [Populus trichocarpa]
entity db link.ordinal: 3
entity db link.seq homology expectation val: 1.76E-71
entity db link.seq identity: 98.15
entity db link.seq positive: 99.07
entity db link.seq query to submitted percent: 99.08
entity db link.seq subject length: 172

info:refseq/XP_002320404

urn:miriam:refseq:XP_002320404

XP 011033719,REF,1,11249
type: entity db link
of datablock: info:bmrb/11249
entity db link.accession code: XP_011033719
entity db link.database code: REF
entity db link.entity id: 1
entity db link.entry id: 11249
entity db link.author supplied: no
entity db link.entry mol name: PREDICTED: monothiol glutaredoxin-S7, chloroplastic [Populus euphratica]
entity db link.ordinal: 4
entity db link.seq homology expectation val: 6.34E-72
entity db link.seq identity: 99.07
entity db link.seq positive: 99.07
entity db link.seq query to submitted percent: 99.08
entity db link.seq subject length: 172

info:refseq/XP_011033719

urn:miriam:refseq:XP_011033719

XP 011033720,REF,1,11249
type: entity db link
of datablock: info:bmrb/11249
entity db link.accession code: XP_011033720
entity db link.database code: REF
entity db link.entity id: 1
entity db link.entry id: 11249
entity db link.author supplied: no
entity db link.entry mol name: PREDICTED: monothiol glutaredoxin-S7, chloroplastic [Populus euphratica]
entity db link.ordinal: 5
entity db link.seq homology expectation val: 6.34E-72
entity db link.seq identity: 99.07
entity db link.seq positive: 99.07
entity db link.seq query to submitted percent: 99.08
entity db link.seq subject length: 172

info:refseq/XP_011033720

urn:miriam:refseq:XP_011033720

1,11249,1
type: entity deleted atom
of datablock: info:bmrb/11249
entity deleted atom.assembly id: 1
entity deleted atom.entry id: 11249
entity deleted atom.id: 1
entity deleted atom.atom id: HG
entity deleted atom.auth atom id: HG
entity deleted atom.auth comp id: CYS
entity deleted atom.auth seq id: 33
entity deleted atom.comp id: CYS
entity deleted atom.comp index id: 33
entity deleted atom.entity assembly id: 2
entity deleted atom.entity id: 1
entity deleted atom.seq id: 33
entity deleted atom.sf id: 11982

1,11249,2
type: entity deleted atom
of datablock: info:bmrb/11249
entity deleted atom.assembly id: 1
entity deleted atom.entry id: 11249
entity deleted atom.id: 2
entity deleted atom.atom id: HSG
entity deleted atom.auth atom id: HG
entity deleted atom.comp id: GSH
entity deleted atom.comp index id: 1
entity deleted atom.entity assembly id: 4
entity deleted atom.entity id: 2
entity deleted atom.seq id: 1
entity deleted atom.sf id: 11982

1,11249,3
type: entity deleted atom
of datablock: info:bmrb/11249
entity deleted atom.assembly id: 1
entity deleted atom.entry id: 11249
entity deleted atom.id: 3
entity deleted atom.atom id: HG
entity deleted atom.auth atom id: HG
entity deleted atom.auth comp id: CYS
entity deleted atom.auth seq id: 33
entity deleted atom.comp id: CYS
entity deleted atom.comp index id: 33
entity deleted atom.entity assembly id: 1
entity deleted atom.entity id: 1
entity deleted atom.seq id: 33
entity deleted atom.sf id: 11982

1,11249,4
type: entity deleted atom
of datablock: info:bmrb/11249
entity deleted atom.assembly id: 1
entity deleted atom.entry id: 11249
entity deleted atom.id: 4
entity deleted atom.atom id: HSG
entity deleted atom.auth atom id: HG
entity deleted atom.comp id: GSH
entity deleted atom.comp index id: 1
entity deleted atom.entity assembly id: 3
entity deleted atom.entity id: 2
entity deleted atom.seq id: 1
entity deleted atom.sf id: 11982

1,11249,1
type: entity experimental src
of datablock: info:bmrb/11249
entity experimental src.entity experimental src list id: 1
entity experimental src.entry id: 11249
entity experimental src.id: 1
entity experimental src.citation id: 0
entity experimental src.entity chimera segment id: 0
entity experimental src.entity id: 1
entity experimental src.entity label: GrxS14
entity experimental src.host org genus: Escherichia
entity experimental src.host org name common: E. coli
entity experimental src.host org ncbi taxonomy id: 469008
entity experimental src.host org scientific name: Escherichia coli BL21(DE3)
entity experimental src.host org species: coli
entity experimental src.host org strain: BL21(DE3)
entity experimental src.production method: recombinant technology
entity experimental src.vector name: pET3d

info:taxonomy/469008

urn:miriam:taxonomy:469008

11249,1
type: entity experimental src list
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
entity experimental src list.entry id: 11249
entity experimental src list.id: 1
entity experimental src list.sf category: experimental_source
entity experimental src list.sf framecode: experimental_source

1,11249,1
type: entity natural src
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
entity natural src.entity natural src list id: 1
entity natural src.entry id: 11249
entity natural src.id: 1
entity natural src.citation id: 0
entity natural src.entity chimera segment id: 0
entity natural src.entity id: 1
entity natural src.entity label: GrxS14
entity natural src.genus: Populus
entity natural src.kingdom: Viridiplantae
entity natural src.ncbi taxonomy id: 3694
entity natural src.organism name common: western balsam poplar
entity natural src.organism name scientific: Populus trichocarpa
entity natural src.species: trichocarpa
entity natural src.superkingdom: Eukaryota
entity natural src.type: organism

info:taxonomy/3694

urn:miriam:taxonomy:3694

11249,1
type: entity natural src list
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
entity natural src list.entry id: 11249
entity natural src list.id: 1
entity natural src list.sf category: natural_source
entity natural src list.sf framecode: natural_source

1,11249,1
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 1
entity poly seq.comp index id: 1
entity poly seq.mon id: MET

1,11249,2
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 2
entity poly seq.comp index id: 2
entity poly seq.mon id: ALA

1,11249,3
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 3
entity poly seq.comp index id: 3
entity poly seq.mon id: LEU

1,11249,4
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 4
entity poly seq.comp index id: 4
entity poly seq.mon id: THR

1,11249,5
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 5
entity poly seq.comp index id: 5
entity poly seq.mon id: PRO

1,11249,6
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 6
entity poly seq.comp index id: 6
entity poly seq.mon id: ALA

1,11249,7
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 7
entity poly seq.comp index id: 7
entity poly seq.mon id: LEU

1,11249,8
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 8
entity poly seq.comp index id: 8
entity poly seq.mon id: LYS

1,11249,9
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 9
entity poly seq.comp index id: 9
entity poly seq.mon id: THR

1,11249,10
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 10
entity poly seq.comp index id: 10
entity poly seq.mon id: THR

1,11249,11
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 11
entity poly seq.comp index id: 11
entity poly seq.mon id: LEU

1,11249,12
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 12
entity poly seq.comp index id: 12
entity poly seq.mon id: ASP

1,11249,13
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 13
entity poly seq.comp index id: 13
entity poly seq.mon id: LYS

1,11249,14
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 14
entity poly seq.comp index id: 14
entity poly seq.mon id: VAL

1,11249,15
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 15
entity poly seq.comp index id: 15
entity poly seq.mon id: VAL

1,11249,16
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 16
entity poly seq.comp index id: 16
entity poly seq.mon id: THR

1,11249,17
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 17
entity poly seq.comp index id: 17
entity poly seq.mon id: SER

1,11249,18
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 18
entity poly seq.comp index id: 18
entity poly seq.mon id: HIS

1,11249,19
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 19
entity poly seq.comp index id: 19
entity poly seq.mon id: LYS

1,11249,20
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 20
entity poly seq.comp index id: 20
entity poly seq.mon id: VAL

1,11249,21
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 21
entity poly seq.comp index id: 21
entity poly seq.mon id: VAL

1,11249,22
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 22
entity poly seq.comp index id: 22
entity poly seq.mon id: LEU

1,11249,23
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 23
entity poly seq.comp index id: 23
entity poly seq.mon id: PHE

1,11249,24
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 24
entity poly seq.comp index id: 24
entity poly seq.mon id: MET

1,11249,25
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 25
entity poly seq.comp index id: 25
entity poly seq.mon id: LYS

1,11249,26
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 26
entity poly seq.comp index id: 26
entity poly seq.mon id: GLY

1,11249,27
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 27
entity poly seq.comp index id: 27
entity poly seq.mon id: THR

1,11249,28
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 28
entity poly seq.comp index id: 28
entity poly seq.mon id: LYS

1,11249,29
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 29
entity poly seq.comp index id: 29
entity poly seq.mon id: ASP

1,11249,30
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 30
entity poly seq.comp index id: 30
entity poly seq.mon id: PHE

1,11249,31
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 31
entity poly seq.comp index id: 31
entity poly seq.mon id: PRO

1,11249,32
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 32
entity poly seq.comp index id: 32
entity poly seq.mon id: GLN

1,11249,33
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 33
entity poly seq.comp index id: 33
entity poly seq.mon id: CYS

1,11249,34
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 34
entity poly seq.comp index id: 34
entity poly seq.mon id: GLY

1,11249,35
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 35
entity poly seq.comp index id: 35
entity poly seq.mon id: PHE

1,11249,36
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 36
entity poly seq.comp index id: 36
entity poly seq.mon id: SER

1,11249,37
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 37
entity poly seq.comp index id: 37
entity poly seq.mon id: GLN

1,11249,38
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 38
entity poly seq.comp index id: 38
entity poly seq.mon id: THR

1,11249,39
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 39
entity poly seq.comp index id: 39
entity poly seq.mon id: VAL

1,11249,40
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 40
entity poly seq.comp index id: 40
entity poly seq.mon id: VAL

1,11249,41
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 41
entity poly seq.comp index id: 41
entity poly seq.mon id: GLN

1,11249,42
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 42
entity poly seq.comp index id: 42
entity poly seq.mon id: ILE

1,11249,43
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 43
entity poly seq.comp index id: 43
entity poly seq.mon id: LEU

1,11249,44
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 44
entity poly seq.comp index id: 44
entity poly seq.mon id: LYS

1,11249,45
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 45
entity poly seq.comp index id: 45
entity poly seq.mon id: SER

1,11249,46
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 46
entity poly seq.comp index id: 46
entity poly seq.mon id: LEU

1,11249,47
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 47
entity poly seq.comp index id: 47
entity poly seq.mon id: ASN

1,11249,48
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 48
entity poly seq.comp index id: 48
entity poly seq.mon id: ALA

1,11249,49
type: entity poly seq
of datablock: info:bmrb/11249
entity poly seq.entity id: 1
entity poly seq.entry id: 11249
entity poly seq.num: 49
entity poly seq.comp index id: 49
entity poly seq.mon id: PRO

1,11249,50
type: entity poly seq
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1,11249,104
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11249,1
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11249,2
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11249,1,1
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11249,1,2
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11249,1,3
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11249,1,4
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11249,1,5
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11249,1,6
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11249,1,7
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11249,1,8
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11249,1
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11249,1,1
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11249,6,1
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11249,7,1
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11249,8,1
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11249,9,1
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11249,10,1
type: lacs char
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11249,11,1
type: lacs char
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11249,12,1
type: lacs char
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11249,13,1
type: lacs char
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11249,14,1
type: lacs char
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11249,15,1
type: lacs char
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11249,16,1
type: lacs char
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11249,17,1
type: lacs char
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11249,18,1
type: lacs char
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11249,19,1
type: lacs char
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11249,20,1
type: lacs char
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11249,21,1
type: lacs char
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11249,22,1
type: lacs char
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11249,23,1
type: lacs char
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11249,24,1
type: lacs char
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11249,25,1
type: lacs char
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11249,26,1
type: lacs char
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11249,27,1
type: lacs char
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11249,28,1
type: lacs char
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11249,29,1
type: lacs char
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11249,30,1
type: lacs char
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11249,31,1
type: lacs char
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11249,32,1
type: lacs char
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11249,33,1
type: lacs char
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11249,34,1
type: lacs char
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11249,35,1
type: lacs char
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11249,36,1
type: lacs char
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11249,37,1
type: lacs char
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11249,38,1
type: lacs char
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11249,39,1
type: lacs char
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11249,40,1
type: lacs char
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11249,41,1
type: lacs char
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11249,42,1
type: lacs char
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11249,43,1
type: lacs char
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11249,44,1
type: lacs char
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11249,45,1
type: lacs char
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11249,46,1
type: lacs char
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11249,47,1
type: lacs char
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11249,48,1
type: lacs char
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11249,49,1
type: lacs char
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11249,51,1
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11249,55,1
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11249,58,1
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11249,59,1
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11249,60,1
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11249,61,1
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11249,62,1
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11249,63,1
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11249,64,1
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11249,65,1
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11249,66,1
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11249,67,1
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11249,68,1
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11249,69,1
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11249,70,1
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11249,71,1
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11249,72,1
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11249,73,1
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11249,74,1
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11249,75,1
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11249,76,1
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11249,77,1
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11249,78,1
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11249,79,1
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11249,80,1
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11249,81,1
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11249,85,2
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11249,87,2
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11249,90,2
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11249,95,2
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11249,97,2
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11249,98,2
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11249,99,2
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11249,100,2
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11249,101,2
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11249,102,2
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11249,103,2
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11249,104,2
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11249,105,2
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11249,106,2
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11249,107,2
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11249,108,2
type: lacs char
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11249,109,2
type: lacs char
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11249,110,2
type: lacs char
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11249,111,2
type: lacs char
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11249,112,2
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11249,113,2
type: lacs char
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11249,114,2
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11249,115,2
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11249,116,2
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11249,117,2
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11249,118,2
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11249,119,2
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11249,120,2
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11249,121,2
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11249,122,2
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11249,125,2
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11249,128,2
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11249,131,2
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11249,302,4
type: lacs char
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11249,303,4
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11249,304,4
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11249,305,4
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11249,306,4
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11249,307,4
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11249,308,4
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11249,309,4
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11249,310,4
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11249,311,4
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11249,312,4
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11249,313,4
type: lacs char
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11249,314,4
type: lacs char
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11249,315,4
type: lacs char
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11249,1
type: lacs plot
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lacs plot.id: 1
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lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: -2.80
lacs plot.line 1 terminator val y 2: 1.42
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 7.10
lacs plot.line 2 terminator val y 1: -1.27
lacs plot.line 2 terminator val y 2: 5.48
lacs plot.output file name: bmr11249_LACS.str
lacs plot.queried date: 2019-08-15Z
lacs plot.sf category: LACS_plot
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lacs plot.sf id: 112490101
lacs plot.source release date: 2015-02-19Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: -0.32
lacs plot.y coord name: CA

11249,2
type: lacs plot
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lacs plot.entry id: 11249
lacs plot.id: 2
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr11249_LACS.str
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lacs plot.line 1 terminator val x 1: -6.46
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 3.66
lacs plot.line 1 terminator val y 2: -0.58
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 7.10
lacs plot.line 2 terminator val y 1: 0.73
lacs plot.line 2 terminator val y 2: -1.62
lacs plot.output file name: bmr11249_LACS.str
lacs plot.queried date: 2019-08-15Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CB_output
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lacs plot.source release date: 2015-02-19Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: -0.32
lacs plot.y coord name: CB

11249,3
type: lacs plot
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
lacs plot.entry id: 11249
lacs plot.id: 3
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr11249_LACS.str
lacs plot.input file name: bmr11249_21.str
lacs plot.line 1 terminator val x 1: -6.46
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 0.71
lacs plot.line 1 terminator val y 2: -0.15
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 7.10
lacs plot.line 2 terminator val y 1: 0.24
lacs plot.line 2 terminator val y 2: -0.66
lacs plot.output file name: bmr11249_LACS.str
lacs plot.queried date: 2019-08-15Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_HA_output
lacs plot.sf id: 112490103
lacs plot.source release date: 2015-02-19Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: -0.05
lacs plot.y coord name: HA

11249,4
type: lacs plot
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
lacs plot.entry id: 11249
lacs plot.id: 4
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr11249_LACS.str
lacs plot.input file name: bmr11249_21.str
lacs plot.line 1 terminator val x 1: -6.46
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 2.88
lacs plot.line 1 terminator val y 2: -2.28
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 6.83
lacs plot.line 2 terminator val y 1: 0.23
lacs plot.line 2 terminator val y 2: -4.66
lacs plot.output file name: bmr11249_LACS.str
lacs plot.queried date: 2019-08-15Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CO_output
lacs plot.sf id: 112490104
lacs plot.source release date: 2015-02-19Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: 0.97
lacs plot.y coord name: CO

11249,1
type: nmr spectrometer
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nmr spectrometer.entry id: 11249
nmr spectrometer.id: 1
nmr spectrometer.field strength: 500
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: Avance
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: spectrometer_1

11249,1
type: nmr spectrometer list
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nmr spectrometer list.entry id: 11249
nmr spectrometer list.id: 1
nmr spectrometer list.sf category: NMR_spectrometer_list
nmr spectrometer list.sf framecode: NMR_spectrometer_list

11249,1,spectrometer 1,1
type: nmr spectrometer view
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nmr spectrometer view.entry id: 11249
nmr spectrometer view.id: 1
nmr spectrometer view.name: spectrometer_1
nmr spectrometer view.nmr spectrometer list id: 1
nmr spectrometer view.citation id: 0
nmr spectrometer view.field strength: 500
nmr spectrometer view.manufacturer: Bruker
nmr spectrometer view.model: Avance

11071,BMRB,11249
type: related entries
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
related entries.database accession code: 11071
related entries.database name: BMRB
related entries.entry id: 11249
related entries.relationship: Assignment of Apo-form GrxS14 from Populus trichocarpa

info:bmrb/11071

11249,2
type: release
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
release.entry id: 11249
release.release number: 2
release.author: BMRB
release.date: 2011-06-01Z
release.detail: update entry citation
release.submission date: 2010-07-27Z
release.type: update

11249,1
type: release
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
release.entry id: 11249
release.release number: 1
release.author: author
release.date: 2010-11-28Z
release.detail: original release
release.submission date: 2010-07-27Z
release.type: original

11249,1
type: sample
of datablock: info:bmrb/11249
reference to entry: https://bmrbpub.pdbj.org/rdf/bmr11249/entry/11249
sample.entry id: 11249
sample.id: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: sample_1
sample.solvent system: 95% H2O/5% D2O
sample.type: solution

11249,1,1
type: sample component
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sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 0
sample component.concentration val: 1
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: GrxS14
sample component.isotopic labeling: [U-13C; U-15N]
sample component.mol common name: holo GrxS14

11249,2,1
type: sample component
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sample component.sample id: 1
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sample component.concentration val: 20
sample component.concentration val units: mM
sample component.entity id: 2
sample component.entity label: GSH
sample component.isotopic labeling: natural abundance
sample component.mol common name: glutathione

11249,3,1
type: sample component
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sample component.sample id: 1
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sample component.concentration val units: mM
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sample component.mol common name: TRIS

11249,4,1
type: sample component
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sample component.concentration val units: mM
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sample component.isotopic labeling: natural abundance
sample component.mol common name: sodium chloride

11249,5,1
type: sample component
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sample component.concentration val units: %
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sample component.mol common name: H2O

11249,6,1
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sample component.assembly id: 1
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sample component.concentration val units: %
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: D2O

11249,1
type: sample condition list
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sample condition list.id: 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

11249,1,ionic strength
type: sample condition variable
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sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 80
sample condition variable.val units: mM

11249,1,pH
type: sample condition variable
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sample condition variable.entry id: 11249
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 7.5
sample condition variable.val units: pH

11249,1,pressure
type: sample condition variable
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sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

11249,1,temperature
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sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

11249,1
type: software
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software.entry id: 11249
software.id: 1
software.name: NMRPipe
software.sf category: software
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software.version: 2.1

11249,2
type: software
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software.id: 2
software.name: NMRView
software.sf category: software
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software.version: 5

11249,3
type: software
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software.entry id: 11249
software.id: 3
software.name: xwinnmr
software.sf category: software
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software.version: 3.5

11249,4
type: software
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software.entry id: 11249
software.id: 4
software.name: TOPSPIN
software.sf category: software
software.sf framecode: TOPSPIN
software.version: 2.1

11249,3,collection
type: task
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task.entry id: 11249
task.software id: 3
task.task: collection

11249,4,collection
type: task
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task.entry id: 11249
task.software id: 4
task.task: collection

11249,2,data analysis
type: task
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task.entry id: 11249
task.software id: 2
task.task: data analysis

11249,1,processing
type: task
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task.entry id: 11249
task.software id: 1
task.task: processing

11249,Bruker Biospin,3
type: vendor
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vendor.entry id: 11249
vendor.name: Bruker Biospin
vendor.software id: 3

11249,Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax,1
type: vendor
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vendor.entry id: 11249
vendor.name: Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax
vendor.software id: 1

11249,Johnson, One Moon Scientific,2
type: vendor
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vendor.entry id: 11249
vendor.name: Johnson, One Moon Scientific
vendor.software id: 2

11249,Bruker BioSpin,4
type: vendor
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vendor.entry id: 11249
vendor.name: Bruker BioSpin
vendor.software id: 4