info:bmrb/26721
type: datablock
references: doi:10.13018/BMR26721
alternative label: bmr26721
title: RXFP1-LDLa linker
datablock name: 26721
has assembly category: assemblyCategory
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atom chem shift.val: 172.680

1,26721,119
type: atom chem shift
of datablock: info:bmrb/26721
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 55.578

1,26721,120
type: atom chem shift
of datablock: info:bmrb/26721
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 28.303

1,26721,121
type: atom chem shift
of datablock: info:bmrb/26721
atom chem shift.assigned chem shift list id: 1
atom chem shift.entry id: 26721
atom chem shift.id: 121
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atom chem shift.atom id: N
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atom chem shift.comp id: HIS
atom chem shift.comp index id: 24
atom chem shift.entity assembly id: 1
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atom chem shift.val: 126.692

1,26721,122
type: atom chem shift
of datablock: info:bmrb/26721
atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 8.770

1,26721,123
type: atom chem shift
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atom chem shift.val: 4.611

1,26721,124
type: atom chem shift
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atom chem shift.val: 172.831

1,26721,125
type: atom chem shift
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atom chem shift.val: 55.975

1,26721,126
type: atom chem shift
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atom chem shift.val: 43.874

1,26721,127
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: CYS
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atom chem shift.val: 124.684

1,26721,128
type: atom chem shift
of datablock: info:bmrb/26721
atom chem shift.assigned chem shift list id: 1
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atom chem shift.comp id: ASN
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atom chem shift.val: 9.581

1,26721,129
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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atom chem shift.val: 4.921

1,26721,130
type: atom chem shift
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atom chem shift.assigned chem shift list id: 1
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1,26721,131
type: atom chem shift
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1,26721,132
type: atom chem shift
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atom chem shift.val: 38.840

1,26721,133
type: atom chem shift
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atom chem shift.val: 119.493

1,26721,134
type: atom chem shift
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1,26721,135
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1,26721,136
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1,26721,137
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1,26721,138
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1,26721,139
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1,26721,140
type: atom chem shift
of datablock: info:bmrb/26721
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1,26721,141
type: atom chem shift
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1,26721,142
type: atom chem shift
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1,26721,143
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1,26721,144
type: atom chem shift
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1,26721,145
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1,26721,146
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1,26721,147
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1,26721,148
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1,26721,149
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1,26721,150
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1,26721,151
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1,26721,152
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1,26721,153
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1,26721,154
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1,26721,155
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1,26721,156
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1,26721,157
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1,26721,158
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1,26721,199
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1,26721,200
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1,26721,201
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1,26721,202
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1,26721,203
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1,26721,204
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1,26721,205
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1,26721,206
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1,26721,207
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1,26721,208
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1,26721,209
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1,26721,210
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1,26721,211
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1,26721,212
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1,26721,213
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1,26721,214
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1,26721,215
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1,26721,216
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1,26721,217
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1,26721,218
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1,26721,219
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1,26721,367
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1,26721,368
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1,26721,369
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1,26721,370
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1,26721,371
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1,26721,372
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1,26721,373
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1,26721,374
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1,26721,375
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1,26721,376
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1,26721,377
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1,26721,378
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1,26721,379
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1,26721,380
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1,26721,381
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1,26721,382
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1,26721,383
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1,26721,384
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1,26721,388
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1,26721,389
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1,26721,393
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26721,CA
type: chem comp
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reference to entry: entry
chem comp.entry id: 26721
chem comp.id: CA
chem comp.ambiguous flag: no
chem comp.aromatic: no
chem comp.formal charge: 2+
chem comp.formula: Ca
chem comp.formula weight: 40.078
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1S/Ca/q+2
chem comp.initial date: 2012-11-19Z
chem comp.model coordinates missing flag: no
chem comp.modified date: 2012-11-19Z
chem comp.name: CALCIUM ION
chem comp.number atoms all: 1
chem comp.number atoms nh: 1
chem comp.pdb code: CA
chem comp.processing site: RCSB
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_CA
chem comp.three letter code: CA
chem comp.type: NON-POLYMER

info:pdb-ccd/CA

pdb-ccd:CA

info:pdb.ligand/CA

pdb.ligand:CA

CA,CA,26721
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chem comp atom.charge: 2
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chem comp atom.model cartn x ideal: 0.000
chem comp atom.model cartn y: 0.000
chem comp atom.model cartn y ideal: 0.000
chem comp atom.model cartn z: 0.000
chem comp atom.model cartn z ideal: 0.000
chem comp atom.pdb atom id: CA
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: CA

CA,BHPQYMZQTOCNFJ-UHFFFAOYSA-N,26721,na,1.03,INCHI
type: chem comp descriptor
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chem comp descriptor.descriptor: BHPQYMZQTOCNFJ-UHFFFAOYSA-N
chem comp descriptor.entry id: 26721
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

http://bmrbpub.pdbj.org/rdf/bmr26721/chem_comp_descriptor/CA,InChI%3D1S%2FCa%2Fq%2B2,26721,na,1.03,INCHI
type: chem comp descriptor
of datablock: info:bmrb/26721
chem comp descriptor.comp id: CA
chem comp descriptor.descriptor: InChI=1S/Ca/q+2
chem comp descriptor.entry id: 26721
chem comp descriptor.program: na
chem comp descriptor.program version: 1.03
chem comp descriptor.type: INCHI

CA,[Ca++],26721,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/26721
chem comp descriptor.comp id: CA
chem comp descriptor.descriptor: [Ca++]
chem comp descriptor.entry id: 26721
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

CA,[Ca++],26721,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/26721
chem comp descriptor.comp id: CA
chem comp descriptor.descriptor: [Ca++]
chem comp descriptor.entry id: 26721
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

CA,[Ca+2],26721,ACD,10.04,SMILES
type: chem comp descriptor
of datablock: info:bmrb/26721
chem comp descriptor.comp id: CA
chem comp descriptor.descriptor: [Ca+2]
chem comp descriptor.entry id: 26721
chem comp descriptor.program: ACD
chem comp descriptor.program version: 10.04
chem comp descriptor.type: SMILES

CA,[Ca+2],26721,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/26721
chem comp descriptor.comp id: CA
chem comp descriptor.descriptor: [Ca+2]
chem comp descriptor.entry id: 26721
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

CA,[Ca+2],26721,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/26721
chem comp descriptor.comp id: CA
chem comp descriptor.descriptor: [Ca+2]
chem comp descriptor.entry id: 26721
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

CA,26721,calcium,ACD,10.04,systematic name
type: chem comp identifier
of datablock: info:bmrb/26721
chem comp identifier.comp id: CA
chem comp identifier.entry id: 26721
chem comp identifier.identifier: calcium
chem comp identifier.program: ACD
chem comp identifier.program version: 10.04
chem comp identifier.type: systematic name

CA,26721,calcium(+2) cation,OECHEM,1.5.0,systematic name
type: chem comp identifier
of datablock: info:bmrb/26721
chem comp identifier.comp id: CA
chem comp identifier.entry id: 26721
chem comp identifier.identifier: calcium(+2) cation
chem comp identifier.program: OECHEM
chem comp identifier.program version: 1.5.0
chem comp identifier.type: systematic name

1,26721,1
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 0.286
chem shift completeness char.chem shift coverage: 0.429
chem shift completeness char.comp id: LEU
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: 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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,2
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.750
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.429
chem shift completeness char.comp id: GLN
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: 0.500
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,3
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 3
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: 0.222
chem shift completeness char.chem shift coverage: 0.333
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: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.077
chem shift completeness char.sf id: 267210301

1,26721,4
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASP
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: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,5
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 5
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: 0.200
chem shift completeness char.chem shift coverage: 0.353
chem shift completeness char.comp id: LYS
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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.083
chem shift completeness char.sf id: 267210301

1,26721,6
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 6
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: 0.250
chem shift completeness char.chem shift coverage: 0.375
chem shift completeness char.comp id: TYR
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.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.091
chem shift completeness char.sf id: 267210301

1,26721,7
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 7
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: 0.222
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: PHE
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: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.077
chem shift completeness char.sf id: 267210301

1,26721,8
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 8
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: 0.667
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: ALA
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: 0.000
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 267210301

1,26721,9
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: SER
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,10
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 1.000
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: 0.833
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: 0.125
chem shift completeness char.chem shift coverage: 0.313
chem shift completeness char.comp id: TYR
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: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.091
chem shift completeness char.sf id: 267210301

1,26721,11
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 11
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: 0.500
chem shift completeness char.bb chem shift coverage: 0.833
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: 0.125
chem shift completeness char.chem shift coverage: 0.313
chem shift completeness char.comp id: TYR
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: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.091
chem shift completeness char.sf id: 267210301

1,26721,12
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 12
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: 0.200
chem shift completeness char.chem shift coverage: 0.353
chem shift completeness char.comp id: LYS
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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.083
chem shift completeness char.sf id: 267210301

1,26721,13
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.600
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.286
chem shift completeness char.chem shift coverage: 0.462
chem shift completeness char.comp id: MET
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.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.125
chem shift completeness char.sf id: 267210301

1,26721,14
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 14
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: 0.750
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: 0.667
chem shift completeness char.comp id: THR
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: 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: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.250
chem shift completeness char.sf id: 267210301

1,26721,15
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.833
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: 0.250
chem shift completeness char.chem shift coverage: 0.625
chem shift completeness char.comp id: SER
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,16
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.786
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: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 267210301

1,26721,17
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 17
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: 0.250
chem shift completeness char.chem shift coverage: 0.375
chem shift completeness char.comp id: TYR
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 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.091
chem shift completeness char.sf id: 267210301

1,26721,18
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 18
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.400
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.167
chem shift completeness char.comp id: PRO
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.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,19
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 19
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: 0.222
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: PHE
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: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.077
chem shift completeness char.sf id: 267210301

1,26721,20
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
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: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,21
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.667
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: ALA
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 267210301

1,26721,22
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: GLU
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: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,23
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 23
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: 0.750
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: 0.667
chem shift completeness char.comp id: THR
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.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: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.250
chem shift completeness char.sf id: 267210301

1,26721,24
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 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: 267210301

1,26721,25
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 25
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: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: GLU
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: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,26
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 26
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: GLN
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 15n 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: 267210301

1,26721,27
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 27
chem shift completeness char.bb chem shift 13c coverage: 0.000
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: 0.500
chem shift completeness char.chem shift 13c coverage: 0.000
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: 0.625
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 2
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 267210301

1,26721,28
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.400
chem shift completeness char.chem shift coverage: 0.727
chem shift completeness char.comp id: VAL
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: 0.000
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 267210301

1,26721,29
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.353
chem shift completeness char.comp id: LYS
chem shift completeness char.comp index id: 4
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.083
chem shift completeness char.sf id: 267210301

1,26721,30
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: CYS
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: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,31
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: SER
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,32
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 267210301

1,26721,33
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 33
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: 8
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 267210301

1,26721,34
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 34
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: 0.250
chem shift completeness char.chem shift coverage: 0.375
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 9
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.200
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.091
chem shift completeness char.sf id: 267210301

1,26721,35
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 35
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: 0.222
chem shift completeness char.chem shift coverage: 0.333
chem shift completeness char.comp id: PHE
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.167
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.077
chem shift completeness char.sf id: 267210301

1,26721,36
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 36
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: 0.400
chem shift completeness char.chem shift 1h coverage: 0.143
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: PRO
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.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,37
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 1.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: CYS
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: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,38
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 38
chem shift completeness char.bb chem shift 13c coverage: 0.500
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: 0.500
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: 0.833
chem shift completeness char.comp id: GLY
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.sf id: 267210301

1,26721,39
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,40
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.286
chem shift completeness char.chem shift coverage: 0.429
chem shift completeness char.comp id: ILE
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: 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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,41
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 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: 0.000
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 13c coverage: 0.500
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.750
chem shift completeness char.sf id: 267210301

1,26721,42
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.200
chem shift completeness char.chem shift coverage: 0.353
chem shift completeness char.comp id: LYS
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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.083
chem shift completeness char.sf id: 267210301

1,26721,43
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 43
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: CYS
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: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,44
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.286
chem shift completeness char.chem shift coverage: 0.429
chem shift completeness char.comp id: LEU
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.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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,45
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 45
chem shift completeness char.bb chem shift 13c coverage: 0.667
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.500
chem shift completeness char.chem shift 13c coverage: 0.400
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.167
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 20
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,46
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 46
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: 0.500
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.125
chem shift completeness char.chem shift coverage: 0.357
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 21
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 13c coverage: 0.500
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,47
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 47
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: 0.500
chem shift completeness char.bb chem shift coverage: 0.667
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: 0.143
chem shift completeness char.chem shift coverage: 0.286
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: 0.000
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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,48
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 48
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: 0.286
chem shift completeness char.chem shift coverage: 0.429
chem shift completeness char.comp id: LEU
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.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: 0.250
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,49
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 0.333
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: HIS
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: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.143
chem shift completeness char.sf id: 267210301

1,26721,50
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 50
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: CYS
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: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,51
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: ASN
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 13c coverage: 1.000
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,52
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: GLY
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.sf id: 267210301

1,26721,53
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 53
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: 0.400
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: VAL
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.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: 0.333
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,54
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.bb chem shift coverage: 0.833
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: 0.250
chem shift completeness char.chem shift coverage: 0.625
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: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,55
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 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: 267210301

1,26721,56
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: CYS
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: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,57
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: GLY
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.sf id: 267210301

1,26721,58
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 58
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: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: ASN
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: 1.000
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,59
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 59
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: 0.750
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.250
chem shift completeness char.chem shift coverage: 0.429
chem shift completeness char.comp id: GLN
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 13c coverage: 0.500
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.111
chem shift completeness char.sf id: 267210301

1,26721,60
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 60
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: 0.667
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: ALA
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.methyl chem shift 13c coverage: 1.000
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift coverage: 0.500
chem shift completeness char.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 267210301

1,26721,61
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 61
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: 0.500
chem shift completeness char.bb chem shift coverage: 0.833
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: 0.250
chem shift completeness char.chem shift coverage: 0.625
chem shift completeness char.comp id: ASP
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: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,62
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 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: 0.750
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: GLU
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: 0.500
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,63
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 63
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASP
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,64
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 64
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: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: ASN
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.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: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,65
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: CYS
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,66
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: GLY
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.sf id: 267210301

1,26721,67
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASP
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.sc chem shift 13c coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721,68
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: ASN
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.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: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,69
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.333
chem shift completeness char.chem shift coverage: 0.545
chem shift completeness char.comp id: ASN
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.167
chem shift completeness char.sf id: 267210301

1,26721,70
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: GLY
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.sf id: 267210301

1,26721,71
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
chem shift completeness char.id: 71
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: 0.167
chem shift completeness char.arom chem shift coverage: 0.083
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: 0.500
chem shift completeness char.chem shift 1h coverage: 0.300
chem shift completeness char.chem shift coverage: 0.350
chem shift completeness char.comp id: TRP
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.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: 0.125
chem shift completeness char.sc chem shift coverage: 0.133
chem shift completeness char.sf id: 267210301

1,26721,72
type: chem shift completeness char
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 26721
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: 0.500
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: SER
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.333
chem shift completeness char.sf id: 267210301

1,26721
type: chem shift completeness list
of datablock: info:bmrb/26721
reference to entry: entry
chem shift completeness list.assigned chem shift list id: 1
chem shift completeness list.entry id: 26721
chem shift completeness list.arom chem shift 13c fraction: 0/47
chem shift completeness list.arom chem shift 15n fraction: 0/1
chem shift completeness list.arom chem shift 1h fraction: 1/48
chem shift completeness list.arom chem shift fraction: 1/96
chem shift completeness list.assigned residue coverage: 0.986
chem shift completeness list.bb chem shift 13c fraction: 199/210
chem shift completeness list.bb chem shift 15n fraction: 67/68
chem shift completeness list.bb chem shift 1h fraction: 135/146
chem shift completeness list.bb chem shift fraction: 401/424
chem shift completeness list.chem shift 13c fraction: 207/313
chem shift completeness list.chem shift 15n fraction: 67/80
chem shift completeness list.chem shift 1h fraction: 157/426
chem shift completeness list.chem shift fraction: 431/819
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr26721_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 13c fraction: 7/22
chem shift completeness list.methyl chem shift 1h fraction: 3/22
chem shift completeness list.methyl chem shift fraction: 10/44
chem shift completeness list.output file name: bmr26721_chem_shift_completeness.str
chem shift completeness list.queried date: 2020-07-22Z
chem shift completeness list.sc chem shift 13c fraction: 72/169
chem shift completeness list.sc chem shift 15n fraction: 0/12
chem shift completeness list.sc chem shift 1h fraction: 22/280
chem shift completeness list.sc chem shift fraction: 94/461
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: 267210301

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13,C,1,26721,DSS
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chem shift ref.atom group: methyl protons
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chem shift ref.indirect shift ratio: 0.2514495
chem shift ref.indirect shift ratio cit id: 0
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chem shift ref.ref type: indirect

1,H,1,26721,DSS
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15,N,1,26721,DSS
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chem shift ref.atom group: methyl protons
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chem shift ref.indirect shift ratio: 0.1013291
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: na
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26721,1
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26721,1
type: citation
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reference to entry: entry
citation.entry id: 26721
citation.id: 1
citation.class: entry citation
citation.doi: 10.1002/chem.201503599
citation.journal abbrev: Chemistry
citation.journal issn: 0947-6539
citation.journal issue: 3
citation.journal name full: Chemistry (Weinheim an der Bergstrasse, Germany)
citation.journal volume: 22
citation.page first: 1146
citation.page last: 1151
citation.pubmed id: 26612092
citation.sf category: citations
citation.sf framecode: entry_citation
citation.status: published
citation.title: Native Chemical Ligation to Minimize Aspartimide Formation during Chemical Synthesis of Small LDLa Protein.
citation.type: journal
citation.year: 2016

info:doi/10.1002/chem.201503599

doi:10.1002/chem.201503599

urn:ISSN:0947-6539

issn:0947-6539

info:pmid/26612092

pubmed:26612092

1,26721,1
type: citation author
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citation author.entry id: 26721
citation author.ordinal: 1
citation author.family name: Tailhades
citation author.given name: J.
citation author.pdbx name: Tailhades, J.

1,26721,2
type: citation author
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citation author.citation id: 1
citation author.entry id: 26721
citation author.ordinal: 2
citation author.family name: Sethi
citation author.given name: Ashish
citation author.pdbx name: Sethi, A.

1,26721,3
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citation author.ordinal: 3
citation author.family name: Petrie
citation author.given name: Emma
citation author.middle initials: J.
citation author.pdbx name: Petrie, E.J.

1,26721,4
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citation author.entry id: 26721
citation author.ordinal: 4
citation author.family name: Gooley
citation author.given name: Paul
citation author.middle initials: R.
citation author.pdbx name: Gooley, P.R.

1,26721,5
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citation author.ordinal: 5
citation author.family name: Bathgate
citation author.given name: Ross
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citation author.pdbx name: Bathgate, R.A.D.

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citation author.middle initials: D.
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1,26721,7
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citation author.ordinal: 7
citation author.family name: Hossain
citation author.given name: Mohammed
citation author.middle initials: A.
citation author.pdbx name: Hossain, M.A.

1,26721,GPCR
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citation keyword.citation id: 1
citation keyword.entry id: 26721
citation keyword.keyword: GPCR

1,26721,LDLa module
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citation keyword.keyword: LDLa module

1,26721,NMR
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citation keyword.keyword: NMR

1,26721,protein interaction
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citation keyword.keyword: protein interaction

1,26721,relaxin
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citation keyword.entry id: 26721
citation keyword.keyword: relaxin

26721,assigned chemical shifts
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reference to entry: entry
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data set.type: assigned_chemical_shifts
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26721,13C chemical shifts
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datum.type: 13C chemical shifts
datum.count: 198

26721,15N chemical shifts
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datum.type: 15N chemical shifts
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26721,1H chemical shifts
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datum.type: 1H chemical shifts
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26721,1
type: entity
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reference to entry: entry
entity.entry id: 26721
entity.id: 1
entity.ambiguous chem comp sites: no
entity.ambiguous conformational states: no
entity.formula weight: 8128.827
entity.fragment: LDLa module with LDLa-LRR linker of RXFP1 (relaxin receptor)
entity.name: RXFP1(1-72)
entity.nstd chirality: no
entity.nstd linkage: no
entity.nstd monomer: no
entity.number of monomers: 72
entity.paramagnetic: no
entity.parent entity id: 0
entity.polymer seq one letter code: QDVKCSLGYFPCGNITKCLPQLLHCNGVDDCGNQADEDNCGDNNGWSLQFDKYFASYYKMTSQYPFEAETPE
entity.polymer seq one letter code can: QDVKCSLGYFPCGNITKCLPQLLHCNGVDDCGNQADEDNCGDNNGWSLQFDKYFASYYKMTSQYPFEAETPE
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: RXFP1(1-72)
entity.thiol state: all disulfide bound
entity.type: polymer

26721,2
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entity.entry id: 26721
entity.id: 2
entity.bmrb code: CA
entity.formula weight: 40.078
entity.name: entity CA
entity.nonpolymer comp id: CA
entity.nonpolymer comp label: chem_comp_CA
entity.number of nonpolymer components: 1
entity.parent entity id: 2
entity.polymer seq one letter code can: (CA)
entity.sf category: entity
entity.sf framecode: entity_CA
entity.type: non-polymer

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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: RXFP1(1-72)
entity assembly.entity id: 1
entity assembly.entity label: RXFP1(1-72)
entity assembly.experimental data reported: yes
entity assembly.physical state: native

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entity assembly.id: 2
entity assembly.asym id: A
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: Calcium
entity assembly.entity id: 2
entity assembly.entity label: entity_CA
entity assembly.experimental data reported: no
entity assembly.physical state: native

LDLa-LRR linker of RXFP1 contains relaxin binding site,1,26721
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entity biological function.biological function: LDLa-LRR linker of RXFP1 contains relaxin binding site
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2,26721,CALCIUM ION,BMRB
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entity common name.name: CALCIUM ION
entity common name.type: BMRB

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http://bmrbpub.pdbj.org/rdf/bmr26721/entry/26721
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entry.id: 26721
entry.accession date: 2015-12-12Z
entry.details: RXFP1-LDLa linker
entry.experimental method: NMR
entry.experimental method subtype: solution
entry.last release date: 2016-02-11Z
entry.nmr star version: 3.1.1.97
entry.original nmr star version: 3.1
entry.original release date: 2016-02-11Z
entry.origination: author
entry.sf category: entry_information
entry.sf framecode: entry_information
entry.submission date: 2015-12-12Z
entry.title: RXFP1-LDLa linker
entry.type: macromolecule
entry.version type: original

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entry author.middle initials: R.
entry author.pdbx name: Gooley, P.R.

26721,1,1
type: experiment
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26721,1,2
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26721,1,3
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26721,1,4
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26721,1,5
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26721,1,6
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26721,1,7
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26721,40,1
type: lacs char
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26721,41,1
type: lacs char
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26721,42,1
type: lacs char
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26721,43,1
type: lacs char
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26721,44,1
type: lacs char
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26721,45,1
type: lacs char
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26721,46,1
type: lacs char
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26721,47,1
type: lacs char
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26721,48,1
type: lacs char
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26721,49,1
type: lacs char
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reference to entry: entry
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26721,50,2
type: lacs char
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reference to entry: entry
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26721,51,2
type: lacs char
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reference to entry: entry
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26721,52,2
type: lacs char
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reference to entry: entry
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26721,53,2
type: lacs char
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reference to entry: entry
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26721,54,2
type: lacs char
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reference to entry: entry
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26721,55,2
type: lacs char
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reference to entry: entry
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26721,56,2
type: lacs char
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reference to entry: entry
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26721,57,2
type: lacs char
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reference to entry: entry
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26721,58,2
type: lacs char
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reference to entry: entry
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26721,59,2
type: lacs char
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reference to entry: entry
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26721,60,2
type: lacs char
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reference to entry: entry
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26721,61,2
type: lacs char
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reference to entry: entry
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26721,62,2
type: lacs char
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reference to entry: entry
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26721,63,2
type: lacs char
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reference to entry: entry
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26721,64,2
type: lacs char
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reference to entry: entry
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26721,65,2
type: lacs char
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reference to entry: entry
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26721,66,2
type: lacs char
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reference to entry: entry
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26721,67,2
type: lacs char
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reference to entry: entry
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26721,68,2
type: lacs char
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reference to entry: entry
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26721,69,2
type: lacs char
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26721,70,2
type: lacs char
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26721,71,2
type: lacs char
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26721,72,2
type: lacs char
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26721,73,2
type: lacs char
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26721,74,2
type: lacs char
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26721,75,2
type: lacs char
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26721,76,2
type: lacs char
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26721,77,2
type: lacs char
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26721,78,2
type: lacs char
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26721,79,2
type: lacs char
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26721,80,2
type: lacs char
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26721,81,2
type: lacs char
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26721,82,2
type: lacs char
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reference to entry: entry
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26721,83,2
type: lacs char
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26721,84,2
type: lacs char
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26721,85,2
type: lacs char
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26721,86,2
type: lacs char
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26721,87,2
type: lacs char
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26721,88,2
type: lacs char
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reference to entry: entry
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26721,89,2
type: lacs char
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26721,90,2
type: lacs char
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reference to entry: entry
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26721,91,2
type: lacs char
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26721,92,2
type: lacs char
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26721,93,2
type: lacs char
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26721,94,2
type: lacs char
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26721,95,2
type: lacs char
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26721,96,2
type: lacs char
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26721,97,2
type: lacs char
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26721,98,2
type: lacs char
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26721,99,3
type: lacs char
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26721,100,3
type: lacs char
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26721,101,3
type: lacs char
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26721,102,3
type: lacs char
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26721,103,3
type: lacs char
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26721,104,3
type: lacs char
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reference to entry: entry
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26721,105,3
type: lacs char
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26721,106,3
type: lacs char
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26721,107,3
type: lacs char
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26721,108,3
type: lacs char
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26721,109,3
type: lacs char
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26721,110,3
type: lacs char
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reference to entry: entry
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26721,111,3
type: lacs char
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26721,112,3
type: lacs char
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26721,113,3
type: lacs char
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reference to entry: entry
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26721,114,3
type: lacs char
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26721,115,3
type: lacs char
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26721,116,3
type: lacs char
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26721,117,3
type: lacs char
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26721,118,3
type: lacs char
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26721,119,3
type: lacs char
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26721,120,3
type: lacs char
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26721,121,3
type: lacs char
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26721,122,3
type: lacs char
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26721,123,3
type: lacs char
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26721,124,3
type: lacs char
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26721,125,3
type: lacs char
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26721,126,3
type: lacs char
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26721,127,3
type: lacs char
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26721,128,3
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26721,129,3
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26721,130,3
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26721,131,3
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26721,132,3
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26721,133,3
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26721,134,3
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26721,138,3
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26721,139,3
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26721,140,4
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26721,150,4
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26721,157,4
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lacs char.entity id: 1
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26721,183,4
type: lacs char
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lacs char.lacs plot id: 4
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lacs char.entity id: 1
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26721,184,4
type: lacs char
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lacs char.lacs plot id: 4
lacs char.assembly id: 1
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lacs char.entity id: 1
lacs char.sf id: 267210104
lacs char.x coord val: 0.03
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26721,185,4
type: lacs char
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lacs char.entry id: 26721
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lacs char.lacs plot id: 4
lacs char.assembly id: 1
lacs char.comp id: GLU
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lacs char.entity id: 1
lacs char.sf id: 267210104
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26721,186,4
type: lacs char
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lacs char.lacs plot id: 4
lacs char.assembly id: 1
lacs char.comp id: THR
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lacs char.entity id: 1
lacs char.sf id: 267210104
lacs char.x coord val: 0.02
lacs char.y coord val: 3.23

26721,187,4
type: lacs char
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reference to entry: entry
lacs char.entry id: 26721
lacs char.id: 187
lacs char.lacs plot id: 4
lacs char.assembly id: 1
lacs char.comp id: GLU
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lacs char.designator: 1
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lacs char.entity id: 1
lacs char.sf id: 267210104
lacs char.x coord val: 0.67
lacs char.y coord val: -0.43

26721,1
type: lacs plot
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reference to entry: entry
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lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr26721_LACS.str
lacs plot.input file name: bmr26721_21.str
lacs plot.line 1 terminator val x 1: -8.85
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: -5.59
lacs plot.line 1 terminator val y 2: 0.95
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 5.18
lacs plot.line 2 terminator val y 1: -1.73
lacs plot.line 2 terminator val y 2: 2.97
lacs plot.output file name: bmr26721_LACS.str
lacs plot.queried date: 2021-09-22Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CA_output
lacs plot.sf id: 267210101
lacs plot.source release date: 2016-02-16Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: 0.34
lacs plot.y coord name: CA

26721,2
type: lacs plot
of datablock: info:bmrb/26721
reference to entry: entry
lacs plot.entry id: 26721
lacs plot.id: 2
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr26721_LACS.str
lacs plot.input file name: bmr26721_21.str
lacs plot.line 1 terminator val x 1: -8.85
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 3.26
lacs plot.line 1 terminator val y 2: -1.05
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 5.18
lacs plot.line 2 terminator val y 1: 0.27
lacs plot.line 2 terminator val y 2: -2.21
lacs plot.output file name: bmr26721_LACS.str
lacs plot.queried date: 2021-09-22Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CB_output
lacs plot.sf id: 267210102
lacs plot.source release date: 2016-02-16Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: 0.34
lacs plot.y coord name: CB

26721,3
type: lacs plot
of datablock: info:bmrb/26721
reference to entry: entry
lacs plot.entry id: 26721
lacs plot.id: 3
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr26721_LACS.str
lacs plot.input file name: bmr26721_21.str
lacs plot.line 1 terminator val x 1: -8.85
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: 0.44
lacs plot.line 1 terminator val y 2: -0.25
lacs plot.line 2 terminator val x 1: -2.00
lacs plot.line 2 terminator val x 2: 4.66
lacs plot.line 2 terminator val y 1: 0.06
lacs plot.line 2 terminator val y 2: -0.52
lacs plot.output file name: bmr26721_LACS.str
lacs plot.queried date: 2021-09-22Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_HA_output
lacs plot.sf id: 267210103
lacs plot.source release date: 2016-02-16Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: 0.12
lacs plot.y coord name: HA

26721,4
type: lacs plot
of datablock: info:bmrb/26721
reference to entry: entry
lacs plot.entry id: 26721
lacs plot.id: 4
lacs plot.electronic address: https://bmrb.pdbj.org/ftp/pub/bmrb/validation_reports/LACS/bmr26721_LACS.str
lacs plot.input file name: bmr26721_21.str
lacs plot.line 1 terminator val x 1: -8.85
lacs plot.line 1 terminator val x 2: 2.00
lacs plot.line 1 terminator val y 1: -2.24
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: 5.18
lacs plot.line 2 terminator val y 1: -1.08
lacs plot.line 2 terminator val y 2: 0.69
lacs plot.output file name: bmr26721_LACS.str
lacs plot.queried date: 2021-09-22Z
lacs plot.sf category: LACS_plot
lacs plot.sf framecode: LACS_CACB_CO_output
lacs plot.sf id: 267210104
lacs plot.source release date: 2016-02-16Z
lacs plot.x coord name: CA-CB
lacs plot.y axis chem shift offset: 0.56
lacs plot.y coord name: CO

26721,1
type: nmr spectrometer
of datablock: info:bmrb/26721
reference to entry: entry
nmr spectrometer.entry id: 26721
nmr spectrometer.id: 1
nmr spectrometer.field strength: 700
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: Avance
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: spectrometer_1

26721,1
type: nmr spectrometer list
of datablock: info:bmrb/26721
reference to entry: entry
nmr spectrometer list.entry id: 26721
nmr spectrometer list.id: 1
nmr spectrometer list.sf category: NMR_spectrometer_list
nmr spectrometer list.sf framecode: NMR_spectrometer_list

26721,1,spectrometer 1,1
type: nmr spectrometer view
of datablock: info:bmrb/26721
nmr spectrometer view.entry id: 26721
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: 700
nmr spectrometer view.manufacturer: Bruker
nmr spectrometer view.model: Avance

26721,1
type: release
of datablock: info:bmrb/26721
reference to entry: entry
release.entry id: 26721
release.release number: 1
release.author: BMRB
release.date: 2016-02-11Z
release.type: original

26721,1
type: sample
of datablock: info:bmrb/26721
reference to entry: entry
sample.entry id: 26721
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: 90% H2O/10% D2O
sample.type: solution

26721,2
type: sample
of datablock: info:bmrb/26721
reference to entry: entry
sample.entry id: 26721
sample.id: 2
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: sample_2
sample.solvent system: 90% H2O/10% D2O
sample.type: solution

26721,1,1
type: sample component
of datablock: info:bmrb/26721
sample component.entry id: 26721
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 100
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: RXFP1(1-72)
sample component.isotopic labeling: [U-100% 13C; U-100% 15N; U-80% 2H]
sample component.mol common name: RXFP1(1-72)

26721,2,1
type: sample component
of datablock: info:bmrb/26721
sample component.entry id: 26721
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 10
sample component.concentration val units: mM
sample component.entity id: 2
sample component.entity label: entity_CA
sample component.isotopic labeling: natural abundance
sample component.mol common name: calcium

26721,3,1
type: sample component
of datablock: info:bmrb/26721
sample component.entry id: 26721
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.concentration val: 50
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: imidazole

26721,4,2
type: sample component
of datablock: info:bmrb/26721
sample component.entry id: 26721
sample component.id: 4
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 100
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: RXFP1(1-72)
sample component.isotopic labeling: [U-100% 13C; U-100% 15N]
sample component.mol common name: RXFP1(1-72)

26721,5,2
type: sample component
of datablock: info:bmrb/26721
sample component.entry id: 26721
sample component.id: 5
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 10
sample component.concentration val units: mM
sample component.entity id: 2
sample component.entity label: entity_CA
sample component.isotopic labeling: natural abundance
sample component.mol common name: calcium

26721,6,2
type: sample component
of datablock: info:bmrb/26721
sample component.entry id: 26721
sample component.id: 6
sample component.sample id: 2
sample component.assembly id: 1
sample component.concentration val: 50
sample component.concentration val units: mM
sample component.entity id: 0
sample component.isotopic labeling: natural abundance
sample component.mol common name: imidazole

26721,1
type: sample condition list
of datablock: info:bmrb/26721
reference to entry: entry
sample condition list.entry id: 26721
sample condition list.id: 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

26721,2
type: sample condition list
of datablock: info:bmrb/26721
reference to entry: entry
sample condition list.entry id: 26721
sample condition list.id: 2
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_2

26721,1,ionic strength
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 1
sample condition variable.type: ionic strength
sample condition variable.val: 0
sample condition variable.val units: M

26721,1,pH
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 1
sample condition variable.type: pH
sample condition variable.val: 6.8
sample condition variable.val units: pH

26721,1,pressure
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

26721,1,temperature
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

26721,2,pH
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 2
sample condition variable.type: pH
sample condition variable.val: 6.8
sample condition variable.val units: pH

26721,2,pressure
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 2
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

26721,2,temperature
type: sample condition variable
of datablock: info:bmrb/26721
sample condition variable.entry id: 26721
sample condition variable.sample condition list id: 2
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K

26721,1
type: software
of datablock: info:bmrb/26721
reference to entry: entry
software.entry id: 26721
software.id: 1
software.name: NMRPipe
software.sf category: software
software.sf framecode: NMRPipe

26721,2
type: software
of datablock: info:bmrb/26721
reference to entry: entry
software.entry id: 26721
software.id: 2
software.name: SPARKY
software.sf category: software
software.sf framecode: SPARKY

26721,3
type: software
of datablock: info:bmrb/26721
reference to entry: entry
software.entry id: 26721
software.id: 3
software.name: TOPSPIN
software.sf category: software
software.sf framecode: TOPSPIN

26721,2,chemical shift assignment
type: task
of datablock: info:bmrb/26721
task.entry id: 26721
task.software id: 2
task.task: chemical shift assignment

26721,3,collection
type: task
of datablock: info:bmrb/26721
task.entry id: 26721
task.software id: 3
task.task: collection

26721,2,peak picking
type: task
of datablock: info:bmrb/26721
task.entry id: 26721
task.software id: 2
task.task: peak picking

26721,1,processing
type: task
of datablock: info:bmrb/26721
task.entry id: 26721
task.software id: 1
task.task: processing

26721,Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax,1
type: vendor
of datablock: info:bmrb/26721
vendor.entry id: 26721
vendor.name: Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax
vendor.software id: 1

26721,Goddard,2
type: vendor
of datablock: info:bmrb/26721
vendor.entry id: 26721
vendor.name: Goddard
vendor.software id: 2

26721,Bruker BioSpin,3
type: vendor
of datablock: info:bmrb/26721
vendor.entry id: 26721
vendor.name: Bruker BioSpin
vendor.software id: 3