info:bmrb/4042
type: datablock
references: doi:10.13018/BMR4042
alternative label: bmr4042
title: Sequence-specific Assignment of the 1H and 15N Nuclear Magnetic Resonance Spectra of the Reduced Recombinant High-potential Iron-sulfur Protein I from Ectothiorhodospira halophila
datablock name: 4042
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assembly.name: high-potential iron-sulfur protein I
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info:pdb/2HIP

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atom chem shift.assembly atom id: 0
atom chem shift.atom id: N
atom chem shift.atom isotope number: 15
atom chem shift.atom type: N
atom chem shift.comp id: SER
atom chem shift.comp index id: 73
atom chem shift.entity assembly id: 1
atom chem shift.entity id: 1
atom chem shift.seq id: 73
atom chem shift.val: 119.78

4042,SF4
type: chem comp
of datablock: info:bmrb/4042
reference to entry: entry
chem comp.entry id: 4042
chem comp.id: SF4
chem comp.ambiguous flag: yes
chem comp.aromatic: no
chem comp.formal charge: 0
chem comp.formula: Fe4 S4
chem comp.formula weight: 351.640
chem comp.ideal coordinates missing flag: no
chem comp.inchi code: InChI=1/4Fe.4S/rFe4S4/c1-5-2-6(1)4-7(1)3(5)8(2)4
chem comp.initial date: 2012-04-04Z
chem comp.model coordinates missing flag: no
chem comp.modified date: 2012-04-04Z
chem comp.name: IRON/SULFUR CLUSTER
chem comp.number atoms all: 8
chem comp.number atoms nh: 8
chem comp.pdb code: SF4
chem comp.processing site: EBI
chem comp.provenance: PDB
chem comp.release status: REL
chem comp.replaces: FS4
chem comp.sf category: chem_comp
chem comp.sf framecode: chem_comp_SF4
chem comp.three letter code: SF4
chem comp.type: NON-POLYMER

info:pdb-ccd/SF4

pdb-ccd:SF4

info:pdb.ligand/SF4

pdb.ligand:SF4

FE1,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: FE1
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 0
chem comp atom.alt atom id: FE1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: FE1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 40.971
chem comp atom.model cartn x ideal: -0.156
chem comp atom.model cartn y: -0.019
chem comp atom.model cartn y ideal: 1.184
chem comp atom.model cartn z: 22.669
chem comp atom.model cartn z ideal: 1.474
chem comp atom.pdb atom id: FE1
chem comp atom.pdbx ordinal: 1
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

FE2,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: FE2
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 0
chem comp atom.alt atom id: FE2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: FE2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 39.556
chem comp atom.model cartn x ideal: 1.455
chem comp atom.model cartn y: 2.319
chem comp atom.model cartn y ideal: -1.182
chem comp atom.model cartn z: 22.804
chem comp atom.model cartn z ideal: 0.289
chem comp atom.pdb atom id: FE2
chem comp atom.pdbx ordinal: 2
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

FE3,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: FE3
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 0
chem comp atom.alt atom id: FE3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: FE3
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 42.077
chem comp atom.model cartn x ideal: 0.302
chem comp atom.model cartn y: 2.161
chem comp atom.model cartn y ideal: 0.999
chem comp atom.model cartn z: 23.861
chem comp atom.model cartn z ideal: -1.584
chem comp atom.pdb atom id: FE3
chem comp atom.pdbx ordinal: 3
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

FE4,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: FE4
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 0
chem comp atom.alt atom id: FE4
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: FE4
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 41.784
chem comp atom.model cartn x ideal: -1.601
chem comp atom.model cartn y: 2.135
chem comp atom.model cartn y ideal: -1.001
chem comp atom.model cartn z: 21.145
chem comp atom.model cartn z ideal: -0.180
chem comp atom.pdb atom id: FE4
chem comp atom.pdbx ordinal: 4
chem comp atom.stereo config: N
chem comp atom.type symbol: FE

S1,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: S1
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 1
chem comp atom.alt atom id: S1
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: S1
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 41.280
chem comp atom.model cartn x ideal: 0.156
chem comp atom.model cartn y: 3.945
chem comp atom.model cartn y ideal: -1.184
chem comp atom.model cartn z: 22.608
chem comp atom.model cartn z ideal: -1.474
chem comp atom.pdb atom id: S1
chem comp atom.pdbx ordinal: 5
chem comp atom.stereo config: N
chem comp atom.type symbol: S

S2,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: S2
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 1
chem comp atom.alt atom id: S2
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: S2
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 43.172
chem comp atom.model cartn x ideal: -1.455
chem comp atom.model cartn y: 0.784
chem comp atom.model cartn y ideal: 1.182
chem comp atom.model cartn z: 22.346
chem comp atom.model cartn z ideal: -0.289
chem comp atom.pdb atom id: S2
chem comp atom.pdbx ordinal: 6
chem comp atom.stereo config: N
chem comp atom.type symbol: S

S3,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: S3
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 1
chem comp atom.alt atom id: S3
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: S3
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 39.722
chem comp atom.model cartn x ideal: -0.302
chem comp atom.model cartn y: 0.875
chem comp atom.model cartn y ideal: -0.999
chem comp atom.model cartn z: 20.827
chem comp atom.model cartn z ideal: 1.584
chem comp atom.pdb atom id: S3
chem comp atom.pdbx ordinal: 7
chem comp atom.stereo config: N
chem comp atom.type symbol: S

S4,SF4,4042
type: chem comp atom
of datablock: info:bmrb/4042
reference to entry: entry
chem comp atom.atom id: S4
chem comp atom.comp id: SF4
chem comp atom.entry id: 4042
chem comp atom.align: 1
chem comp atom.alt atom id: S4
chem comp atom.aromatic flag: no
chem comp atom.bmrb code: S4
chem comp atom.charge: 0
chem comp atom.leaving atom flag: no
chem comp atom.model cartn x: 40.141
chem comp atom.model cartn x ideal: 1.601
chem comp atom.model cartn y: 1.060
chem comp atom.model cartn y ideal: 1.001
chem comp atom.model cartn z: 24.575
chem comp atom.model cartn z ideal: 0.180
chem comp atom.pdb atom id: S4
chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: S

SF4,4042,1
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 1
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE1
chem comp bond.atom id 2: S2
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,2
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 2
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE1
chem comp bond.atom id 2: S3
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,3
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 3
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE1
chem comp bond.atom id 2: S4
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,4
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 4
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE2
chem comp bond.atom id 2: S1
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,5
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 5
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE2
chem comp bond.atom id 2: S3
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,6
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 6
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE2
chem comp bond.atom id 2: S4
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,7
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 7
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE3
chem comp bond.atom id 2: S1
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,8
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE3
chem comp bond.atom id 2: S2
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,9
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 9
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE3
chem comp bond.atom id 2: S4
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,10
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 10
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE4
chem comp bond.atom id 2: S1
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,11
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 11
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE4
chem comp bond.atom id 2: S2
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.value order: SING

SF4,4042,12
type: chem comp bond
of datablock: info:bmrb/4042
chem comp bond.comp id: SF4
chem comp bond.entry id: 4042
chem comp bond.id: 12
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: FE4
chem comp bond.atom id 2: S3
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.value order: SING

http://bmrbpub.pdbj.org/rdf/bmr4042/chem_comp_descriptor/SF4,InChI%3D1%2F4Fe.4S%2FrFe4S4%2Fc1-5-2-6(1)4-7(1)3(5)8(2)4,4042,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/4042
chem comp descriptor.comp id: SF4
chem comp descriptor.descriptor: InChI=1/4Fe.4S/rFe4S4/c1-5-2-6(1)4-7(1)3(5)8(2)4
chem comp descriptor.entry id: 4042
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

SF4,LJBDFODJNLIPKO-VKOJMFJBAC,4042,na,1.02b,INCHI
type: chem comp descriptor
of datablock: info:bmrb/4042
chem comp descriptor.comp id: SF4
chem comp descriptor.descriptor: LJBDFODJNLIPKO-VKOJMFJBAC
chem comp descriptor.entry id: 4042
chem comp descriptor.program: na
chem comp descriptor.program version: 1.02b
chem comp descriptor.type: INCHI

SF4,[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45,4042,OECHEM,1.5.0,SMILES
type: chem comp descriptor
of datablock: info:bmrb/4042
chem comp descriptor.comp id: SF4
chem comp descriptor.descriptor: [S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
chem comp descriptor.entry id: 4042
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES

SF4,[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45,4042,OECHEM,1.5.0,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/4042
chem comp descriptor.comp id: SF4
chem comp descriptor.descriptor: [S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
chem comp descriptor.entry id: 4042
chem comp descriptor.program: OECHEM
chem comp descriptor.program version: 1.5.0
chem comp descriptor.type: SMILES_CANONICAL

SF4,S1|2[Fe]|3S|4[Fe]1|S5[Fe]|4S|3[Fe]|25,4042,CACTVS,3.341,SMILES
type: chem comp descriptor
of datablock: info:bmrb/4042
chem comp descriptor.comp id: SF4
chem comp descriptor.descriptor: S1|2[Fe]|3S|4[Fe]1|S5[Fe]|4S|3[Fe]|25
chem comp descriptor.entry id: 4042
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES

SF4,S1|2[Fe]|3S|4[Fe]1|S5[Fe]|4S|3[Fe]|25,4042,CACTVS,3.341,SMILES CANONICAL
type: chem comp descriptor
of datablock: info:bmrb/4042
chem comp descriptor.comp id: SF4
chem comp descriptor.descriptor: S1|2[Fe]|3S|4[Fe]1|S5[Fe]|4S|3[Fe]|25
chem comp descriptor.entry id: 4042
chem comp descriptor.program: CACTVS
chem comp descriptor.program version: 3.341
chem comp descriptor.type: SMILES_CANONICAL

1,4042,1
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 1
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.500
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,2
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 2
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 2
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,3
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 3
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 3
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,4
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 4
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 4
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,5
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 5
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: ARG
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,6
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 6
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 6
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 40420301

1,4042,7
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 7
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 7
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,8
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 8
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 8
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,9
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 9
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 40420301

1,4042,10
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 10
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.833
chem shift completeness char.chem shift coverage: 0.714
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,11
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 11
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 11
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,12
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 12
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: HIS
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,13
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 13
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 13
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,14
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 14
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
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: TYR
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,15
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 15
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
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: VAL
chem shift completeness char.comp index id: 15
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 40420301

1,4042,16
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 16
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 16
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.800
chem shift completeness char.sf id: 40420301

1,4042,17
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 17
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,18
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 18
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 18
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,19
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 19
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
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 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 40420301

1,4042,20
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 20
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 20
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,21
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 21
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 21
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,22
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 22
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 22
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,23
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 23
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 40420301

1,4042,24
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 24
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: 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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,25
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 25
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,26
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 26
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.889
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 26
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,27
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 27
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
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: TYR
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.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,28
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 28
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 28
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.857
chem shift completeness char.sf id: 40420301

1,4042,29
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 29
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,30
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 30
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 40420301

1,4042,31
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 31
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: GLN
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.857
chem shift completeness char.sf id: 40420301

1,4042,32
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 32
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,33
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 33
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420301

1,4042,34
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 34
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 34
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,35
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 35
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 35
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.800
chem shift completeness char.sf id: 40420301

1,4042,36
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 36
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 36
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420301

1,4042,37
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 37
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,38
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 38
chem shift completeness char.arom chem shift 1h coverage: 0.400
chem shift completeness char.arom chem shift coverage: 0.400
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.222
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: PHE
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 1h coverage: 0.286
chem shift completeness char.sc chem shift coverage: 0.286
chem shift completeness char.sf id: 40420301

1,4042,39
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 39
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 0.857
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: TRP
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.889
chem shift completeness char.sf id: 40420301

1,4042,40
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 40
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 40420301

1,4042,41
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 41
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 41
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,42
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 42
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 42
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 40420301

1,4042,43
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 43
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 43
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,44
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 44
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: GLN
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.857
chem shift completeness char.sf id: 40420301

1,4042,45
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 45
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 45
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,46
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 46
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 40420301

1,4042,47
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 47
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 0.857
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
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: TRP
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 0.889
chem shift completeness char.sf id: 40420301

1,4042,48
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 48
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
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.sf id: 40420301

1,4042,49
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 49
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: ARG
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,50
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 50
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: CYS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420301

1,4042,51
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 51
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: THR
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,52
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 52
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 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.167
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: HIS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420301

1,4042,53
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 53
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,54
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 54
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.500
chem shift completeness char.chem shift coverage: 0.400
chem shift completeness char.comp id: ASP
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,55
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 55
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.900
chem shift completeness char.comp id: PHE
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.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,56
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 56
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 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: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420301

1,4042,57
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 57
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 57
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,58
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 58
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
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: VAL
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,59
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 59
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.875
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,60
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 60
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.800
chem shift completeness char.chem shift coverage: 0.667
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 60
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.667
chem shift completeness char.sc chem shift coverage: 0.667
chem shift completeness char.sf id: 40420301

1,4042,61
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 61
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.909
chem shift completeness char.comp id: LYS
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.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,62
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 62
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,63
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 63
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.857
chem shift completeness char.comp id: GLU
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,64
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 64
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.750
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 64
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 40420301

1,4042,65
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 65
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.833
chem shift completeness char.arom chem shift coverage: 0.714
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.700
chem shift completeness char.chem shift coverage: 0.583
chem shift completeness char.comp id: TRP
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 15n coverage: 0.000
chem shift completeness char.sc chem shift 1h coverage: 0.875
chem shift completeness char.sc chem shift coverage: 0.778
chem shift completeness char.sf id: 40420301

1,4042,66
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 66
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 0.500
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.600
chem shift completeness char.comp id: CYS
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,67
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 67
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: SER
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,68
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 68
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: VAL
chem shift completeness char.comp index id: 68
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,69
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 69
chem shift completeness char.arom chem shift 1h coverage: 1.000
chem shift completeness char.arom chem shift coverage: 1.000
chem shift completeness char.bb chem shift 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 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: TYR
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,70
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 70
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 70
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,71
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 71
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: 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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,72
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 72
chem shift completeness char.bb chem shift 15n coverage: 0.000
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 0.667
chem shift completeness char.chem shift 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

1,4042,73
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 1
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 73
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 73
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420301

2,4042,74
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 74
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 1
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 1.000
chem shift completeness char.methyl chem shift coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,75
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 75
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 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: SER
chem shift completeness char.comp index id: 2
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,76
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 76
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 3
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,77
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 77
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 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 4
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,78
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 78
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.100
chem shift completeness char.comp id: ARG
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,79
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 79
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 6
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,80
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 80
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 7
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,81
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 81
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: ASP
chem shift completeness char.comp index id: 8
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,82
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 82
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: GLY
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.sf id: 40420302

2,4042,83
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 83
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 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: HIS
chem shift completeness char.comp index id: 10
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,84
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 84
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 11
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,85
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 85
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 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: HIS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,86
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 86
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 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: 13
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,87
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 87
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 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.111
chem shift completeness char.comp id: TYR
chem shift completeness char.comp index id: 14
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,88
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 88
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
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: VAL
chem shift completeness char.comp index id: 15
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,89
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 89
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 16
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.200
chem shift completeness char.sf id: 40420302

2,4042,90
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 90
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: GLU
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,91
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 91
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 18
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,92
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 92
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ALA
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 1h coverage: 1.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,93
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 93
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 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: 20
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,94
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 94
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 21
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,95
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 95
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 22
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,96
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 96
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: GLY
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.sf id: 40420302

2,4042,97
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 97
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 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,98
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 98
chem shift completeness char.bb chem shift 1h coverage: 1.000
chem shift completeness char.bb chem shift coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: PRO
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,99
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 99
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.100
chem shift completeness char.comp id: ARG
chem shift completeness char.comp index id: 26
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,100
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 100
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 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.111
chem shift completeness char.comp id: TYR
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,101
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 101
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
chem shift completeness char.comp index id: 28
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 1.000
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: 40420302

2,4042,102
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 102
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: GLU
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,103
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 103
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: GLY
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.sf id: 40420302

2,4042,104
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 104
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
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 15n coverage: 1.000
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: 40420302

2,4042,105
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 105
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.125
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,106
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 106
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.750
chem shift completeness char.chem shift coverage: 0.800
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 33
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,107
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 107
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.143
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 34
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,108
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 108
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.750
chem shift completeness char.comp id: ASN
chem shift completeness char.comp index id: 35
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 15n coverage: 1.000
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.600
chem shift completeness char.sf id: 40420302

2,4042,109
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 109
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 36
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,110
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 110
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,111
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 111
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 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 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: PHE
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,112
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 112
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 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 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: TRP
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 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: 40420302

2,4042,113
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 113
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: GLY
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.sf id: 40420302

2,4042,114
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 114
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.667
chem shift completeness char.chem shift coverage: 0.714
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 41
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.500
chem shift completeness char.sc chem shift coverage: 0.500
chem shift completeness char.sf id: 40420302

2,4042,115
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 115
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
chem shift completeness char.comp index id: 42
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,116
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 116
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
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: VAL
chem shift completeness char.comp index id: 43
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,117
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 117
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: GLN
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 15n coverage: 1.000
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: 40420302

2,4042,118
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 118
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 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: 45
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,119
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 119
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 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: 46
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 40420302

2,4042,120
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 120
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 0.500
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.083
chem shift completeness char.comp id: TRP
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 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: 40420302

2,4042,121
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 121
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: GLY
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.sf id: 40420302

2,4042,122
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 122
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.100
chem shift completeness char.comp id: ARG
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,123
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 123
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
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: 0.600
chem shift completeness char.comp id: CYS
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 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,124
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 124
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: THR
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,125
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 125
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 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 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: HIS
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,126
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 126
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 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 53
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,127
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 127
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 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: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,128
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 128
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 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.100
chem shift completeness char.comp id: PHE
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,129
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 129
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 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: ASP
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,130
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 130
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 57
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,131
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 131
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
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: VAL
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,132
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 132
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.125
chem shift completeness char.comp id: LEU
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,133
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 133
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
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: VAL
chem shift completeness char.comp index id: 60
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,134
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 134
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.091
chem shift completeness char.comp id: LYS
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.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,135
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 135
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,136
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 136
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: GLU
chem shift completeness char.comp index id: 63
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,137
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 137
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.250
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: GLY
chem shift completeness char.comp index id: 64
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sf id: 40420302

2,4042,138
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 138
chem shift completeness char.arom chem shift 15n coverage: 0.000
chem shift completeness char.arom chem shift 1h coverage: 0.000
chem shift completeness char.arom chem shift coverage: 0.000
chem shift completeness char.bb chem shift 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 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: TRP
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 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: 40420302

2,4042,139
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 139
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 15n coverage: 0.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: CYS
chem shift completeness char.comp index id: 66
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,140
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 140
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 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 1.000
chem shift completeness char.chem shift coverage: 1.000
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 67
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 1.000
chem shift completeness char.sc chem shift coverage: 1.000
chem shift completeness char.sf id: 40420302

2,4042,141
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 141
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
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: VAL
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,142
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 142
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 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 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: TYR
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 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,143
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 143
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
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 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,144
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 144
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 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.000
chem shift completeness char.comp id: PRO
chem shift completeness char.comp index id: 71
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

2,4042,145
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 145
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.250
chem shift completeness char.comp id: ALA
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.methyl chem shift 1h coverage: 0.000
chem shift completeness char.methyl chem shift 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: 40420302

2,4042,146
type: chem shift completeness char
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness char.assigned chem shift list id: 2
chem shift completeness char.entry id: 4042
chem shift completeness char.id: 146
chem shift completeness char.bb chem shift 15n coverage: 1.000
chem shift completeness char.bb chem shift 1h coverage: 0.000
chem shift completeness char.bb chem shift coverage: 0.333
chem shift completeness char.chem shift 15n coverage: 1.000
chem shift completeness char.chem shift 1h coverage: 0.000
chem shift completeness char.chem shift coverage: 0.200
chem shift completeness char.comp id: SER
chem shift completeness char.comp index id: 73
chem shift completeness char.entity assembly id: 1
chem shift completeness char.entity id: 1
chem shift completeness char.sc chem shift 1h coverage: 0.000
chem shift completeness char.sc chem shift coverage: 0.000
chem shift completeness char.sf id: 40420302

1,4042
type: chem shift completeness list
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness list.assigned chem shift list id: 1
chem shift completeness list.entry id: 4042
chem shift completeness list.arom chem shift 15n fraction: 0/3
chem shift completeness list.arom chem shift 1h fraction: 42/48
chem shift completeness list.arom chem shift fraction: 42/51
chem shift completeness list.assigned residue coverage: 0.959
chem shift completeness list.bb chem shift 15n fraction: 8/69
chem shift completeness list.bb chem shift 1h fraction: 130/149
chem shift completeness list.bb chem shift fraction: 138/218
chem shift completeness list.chem shift 15n fraction: 8/77
chem shift completeness list.chem shift 1h fraction: 360/398
chem shift completeness list.chem shift fraction: 368/475
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr4042_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 1h fraction: 26/26
chem shift completeness list.methyl chem shift fraction: 26/26
chem shift completeness list.output file name: bmr4042_chem_shift_completeness.str
chem shift completeness list.queried date: 2020-07-22Z
chem shift completeness list.sc chem shift 15n fraction: 0/8
chem shift completeness list.sc chem shift 1h fraction: 230/249
chem shift completeness list.sc chem shift fraction: 230/257
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: 40420301

2,4042
type: chem shift completeness list
of datablock: info:bmrb/4042
reference to entry: entry
chem shift completeness list.assigned chem shift list id: 2
chem shift completeness list.entry id: 4042
chem shift completeness list.arom chem shift 15n fraction: 0/6
chem shift completeness list.arom chem shift 1h fraction: 42/96
chem shift completeness list.arom chem shift fraction: 42/102
chem shift completeness list.assigned residue coverage: 0.822
chem shift completeness list.bb chem shift 15n fraction: 67/138
chem shift completeness list.bb chem shift 1h fraction: 154/298
chem shift completeness list.bb chem shift fraction: 221/436
chem shift completeness list.chem shift 15n fraction: 72/154
chem shift completeness list.chem shift 1h fraction: 416/796
chem shift completeness list.chem shift fraction: 488/950
chem shift completeness list.electronic address: https://bmrbpub.pdbj.org/archive/cs_complete/bmr4042_chem_shift_completeness.str
chem shift completeness list.entity polymer type: polypeptide(L)
chem shift completeness list.methyl chem shift 1h fraction: 28/52
chem shift completeness list.methyl chem shift fraction: 28/52
chem shift completeness list.output file name: bmr4042_chem_shift_completeness.str
chem shift completeness list.queried date: 2020-07-22Z
chem shift completeness list.sc chem shift 15n fraction: 5/16
chem shift completeness list.sc chem shift 1h fraction: 262/498
chem shift completeness list.sc chem shift fraction: 267/514
chem shift completeness list.sf category: chem_shift_completeness_list
chem shift completeness list.sf framecode: chem_shift_completeness_list_2
chem shift completeness list.sf id: 40420302

1,4042,1
type: chem shift experiment
of datablock: info:bmrb/4042
chem shift experiment.assigned chem shift list id: 1
chem shift experiment.entry id: 4042
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: na
chem shift experiment.sample id: 1
chem shift experiment.sample label: sample_one
chem shift experiment.sample state: isotropic

2,4042,1
type: chem shift experiment
of datablock: info:bmrb/4042
chem shift experiment.assigned chem shift list id: 2
chem shift experiment.entry id: 4042
chem shift experiment.experiment id: 1
chem shift experiment.experiment name: na
chem shift experiment.sample id: 1
chem shift experiment.sample label: sample_one
chem shift experiment.sample state: isotropic

1,H,1,4042,DSS
type: chem shift ref
of datablock: info:bmrb/4042
chem shift ref.atom isotope number: 1
chem shift ref.atom type: H
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 4042
chem shift ref.mol common name: DSS
chem shift ref.atom group: methyl protons
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 4.93
chem shift ref.correction val cit id: 1
chem shift ref.correction val cit label: entry_citation
chem shift ref.indirect shift ratio cit id: 1
chem shift ref.indirect shift ratio cit label: entry_citation

15,N,1,4042,(NH4)2SO4
type: chem shift ref
of datablock: info:bmrb/4042
chem shift ref.atom isotope number: 15
chem shift ref.atom type: N
chem shift ref.chem shift reference id: 1
chem shift ref.entry id: 4042
chem shift ref.mol common name: (NH4)2SO4
chem shift ref.atom group: nitrogen
chem shift ref.chem shift units: ppm
chem shift ref.chem shift val: 21.6
chem shift ref.correction val cit id: 1
chem shift ref.correction val cit label: entry_citation
chem shift ref.indirect shift ratio cit id: 1
chem shift ref.indirect shift ratio cit label: entry_citation

4042,1
type: chem shift reference
of datablock: info:bmrb/4042
reference to entry: entry
chem shift reference.entry id: 4042
chem shift reference.id: 1
chem shift reference.sf category: chem_shift_reference
chem shift reference.sf framecode: chemical_shift_reference_one

4042,1
type: citation
of datablock: info:bmrb/4042
reference to entry: entry
citation.entry id: 4042
citation.id: 1
citation.class: entry citation
citation.full citation: Bertini, I., Felli, I. C., Kastrau, D. H.W., Luchinat, C., Piccioli, M., and Viezzoli, M. S., "Sequence-specific assignment of the 1H and 15N nuclear magnetic resonance spectra of the reduced recombinant high potential iron-sulfur protein I from Ectothiorhodospira halophila," European Journal of Biochemistry 225, 703-714 (1994).
citation.journal abbrev: Eur. J. Biochem.
citation.journal issn: 0014-2956
citation.journal issue: 2
citation.journal name full: European journal of biochemistry / FEBS
citation.journal volume: 225
citation.medline ui code: 95045521
citation.page first: 703
citation.page last: 714
citation.pubmed id: 7957186
citation.sf category: citations
citation.sf framecode: entry_citation
citation.status: published
citation.title: Sequence-specific assignment of the 1H and 15N nuclear magnetic resonance spectra of the reduced recombinant high-potential iron-sulfur protein I from Ectothiorhodospira halophila.
citation.type: journal
citation.year: 1994

urn:ISSN:0014-2956

issn:0014-2956

info:pmid/7957186

pubmed:7957186

1,4042,1
type: citation author
of datablock: info:bmrb/4042
citation author.citation id: 1
citation author.entry id: 4042
citation author.ordinal: 1
citation author.family name: Bertini
citation author.given name: Ivano
citation author.pdbx name: Bertini, I.

1,4042,2
type: citation author
of datablock: info:bmrb/4042
citation author.citation id: 1
citation author.entry id: 4042
citation author.ordinal: 2
citation author.family name: Felli
citation author.given name: Isabella
citation author.middle initials: Caterina
citation author.pdbx name: Felli, I.CATERINA.

1,4042,3
type: citation author
of datablock: info:bmrb/4042
citation author.citation id: 1
citation author.entry id: 4042
citation author.ordinal: 3
citation author.family name: Kastrau
citation author.given name: Dieter
citation author.middle initials: H.W.
citation author.pdbx name: Kastrau, D.H.W.

1,4042,4
type: citation author
of datablock: info:bmrb/4042
citation author.citation id: 1
citation author.entry id: 4042
citation author.ordinal: 4
citation author.family name: Luchinat
citation author.given name: Claudio
citation author.pdbx name: Luchinat, C.

1,4042,5
type: citation author
of datablock: info:bmrb/4042
citation author.citation id: 1
citation author.entry id: 4042
citation author.ordinal: 5
citation author.family name: Piccioli
citation author.given name: Mario
citation author.pdbx name: Piccioli, M.

1,4042,6
type: citation author
of datablock: info:bmrb/4042
citation author.citation id: 1
citation author.entry id: 4042
citation author.ordinal: 6
citation author.family name: Viezzoli
citation author.given name: Maria
citation author.middle initials: Silvia
citation author.pdbx name: Viezzoli, M.SILVIA.

1,4042,Ectothiorhodospira halophila
type: citation keyword
of datablock: info:bmrb/4042
citation keyword.citation id: 1
citation keyword.entry id: 4042
citation keyword.keyword: Ectothiorhodospira halophila

1,4042,[Fe4S4]2+ cluster
type: citation keyword
of datablock: info:bmrb/4042
citation keyword.citation id: 1
citation keyword.entry id: 4042
citation keyword.keyword: [Fe4S4]2+ cluster

1,4042,HiPIP (high-potential iron-sulfur protein) I
type: citation keyword
of datablock: info:bmrb/4042
citation keyword.citation id: 1
citation keyword.entry id: 4042
citation keyword.keyword: HiPIP (high-potential iron-sulfur protein) I

1,4042,NMR
type: citation keyword
of datablock: info:bmrb/4042
citation keyword.citation id: 1
citation keyword.entry id: 4042
citation keyword.keyword: NMR

1,4042,Nuclear Magnetic Resonance
type: citation keyword
of datablock: info:bmrb/4042
citation keyword.citation id: 1
citation keyword.entry id: 4042
citation keyword.keyword: Nuclear Magnetic Resonance

4042,assigned chemical shifts
type: data set
of datablock: info:bmrb/4042
reference to entry: entry
data set.entry id: 4042
data set.type: assigned_chemical_shifts
data set.count: 2

4042,15N chemical shifts
type: datum
of datablock: info:bmrb/4042
reference to entry: entry
datum.entry id: 4042
datum.type: 15N chemical shifts
datum.count: 66

4042,1H chemical shifts
type: datum
of datablock: info:bmrb/4042
reference to entry: entry
datum.entry id: 4042
datum.type: 1H chemical shifts
datum.count: 425

4042,1
type: entity
of datablock: info:bmrb/4042
reference to entry: entry
entity.entry id: 4042
entity.id: 1
entity.db query revised last date: 2015-11-24Z
entity.formula weight: 7995.455
entity.name: high-potential iron-sulfur protein I
entity.number of monomers: 73
entity.parent entity id: 1
entity.polymer seq one letter code: ASEPRAEDGHAHDYVNEAADASGHPRYQEGQLCENCAFWGEAVQDGWGRCTHPDFDEVLVKAEGWCSVYAPAS
entity.polymer seq one letter code can: ASEPRAEDGHAHDYVNEAADASGHPRYQEGQLCENCAFWGEAVQDGWGRCTHPDFDEVLVKAEGWCSVYAPAS
entity.polymer type: polypeptide(L)
entity.sf category: entity
entity.sf framecode: HiPIP_I_peptide
entity.thiol state: all other bound
entity.type: polymer

4042,2
type: entity
of datablock: info:bmrb/4042
reference to entry: entry
entity.entry id: 4042
entity.id: 2
entity.bmrb code: SF4
entity.formula weight: 351.640
entity.name: IRON/SULFUR CLUSTER
entity.nonpolymer comp id: SF4
entity.nonpolymer comp label: chem_comp_SF4
entity.number of nonpolymer components: 1
entity.parent entity id: 2
entity.polymer seq one letter code can: (SF4)
entity.sf category: entity
entity.sf framecode: entity_SF4
entity.type: non-polymer

1,4042,1
type: entity assembly
of datablock: info:bmrb/4042
entity assembly.assembly id: 1
entity assembly.entry id: 4042
entity assembly.id: 1
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: high-potential iron-sulfur protein I
entity assembly.entity id: 1
entity assembly.entity label: HiPIP_I_peptide
entity assembly.physical state: native

1,4042,2
type: entity assembly
of datablock: info:bmrb/4042
entity assembly.assembly id: 1
entity assembly.entry id: 4042
entity assembly.id: 2
entity assembly.chemical exchange state: no
entity assembly.conformational isomer: no
entity assembly.entity assembly name: iron-sulfur_center
entity assembly.entity id: 2
entity assembly.entity label: entity_SF4
entity assembly.physical state: native

2,4042,1
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 1
entity atom list.atom id: FE1
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,2
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 2
entity atom list.atom id: FE2
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,3
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 3
entity atom list.atom id: FE3
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,4
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 4
entity atom list.atom id: FE4
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,5
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 5
entity atom list.atom id: S1
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,6
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 6
entity atom list.atom id: S2
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,7
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 7
entity atom list.atom id: S3
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

2,4042,8
type: entity atom list
of datablock: info:bmrb/4042
entity atom list.entity id: 2
entity atom list.entry id: 4042
entity atom list.id: 8
entity atom list.atom id: S4
entity atom list.comp id: SF4
entity atom list.comp index id: 1
entity atom list.sf id: 198415

1,4042,high-potential iron-sulfur protein I,common
type: entity common name
of datablock: info:bmrb/4042
entity common name.entity id: 1
entity common name.entry id: 4042
entity common name.name: high-potential iron-sulfur protein I
entity common name.type: common

1,4042,HiPIP I,abbreviation
type: entity common name
of datablock: info:bmrb/4042
entity common name.entity id: 1
entity common name.entry id: 4042
entity common name.name: HiPIP_I
entity common name.type: abbreviation

2,4042,IRON/SULFUR CLUSTER,BMRB
type: entity common name
of datablock: info:bmrb/4042
entity common name.entity id: 2
entity common name.entry id: 4042
entity common name.name: IRON/SULFUR CLUSTER
entity common name.type: BMRB

1,4042,1
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 1
entity comp index.auth seq id: 1
entity comp index.comp id: ALA

1,4042,2
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 2
entity comp index.auth seq id: 2
entity comp index.comp id: SER

1,4042,3
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 3
entity comp index.auth seq id: 3
entity comp index.comp id: GLU

1,4042,4
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 4
entity comp index.auth seq id: 4
entity comp index.comp id: PRO

1,4042,5
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 5
entity comp index.auth seq id: 5
entity comp index.comp id: ARG

1,4042,6
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 6
entity comp index.auth seq id: 6
entity comp index.comp id: ALA

1,4042,7
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 7
entity comp index.auth seq id: 7
entity comp index.comp id: GLU

1,4042,8
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 8
entity comp index.auth seq id: 8
entity comp index.comp id: ASP

1,4042,9
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 9
entity comp index.auth seq id: 9
entity comp index.comp id: GLY

1,4042,10
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 10
entity comp index.auth seq id: 10
entity comp index.comp id: HIS

1,4042,11
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 11
entity comp index.auth seq id: 11
entity comp index.comp id: ALA

1,4042,12
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 12
entity comp index.auth seq id: 12
entity comp index.comp id: HIS

1,4042,13
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 13
entity comp index.auth seq id: 13
entity comp index.comp id: ASP

1,4042,14
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 14
entity comp index.auth seq id: 14
entity comp index.comp id: TYR

1,4042,15
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 15
entity comp index.auth seq id: 15
entity comp index.comp id: VAL

1,4042,16
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 16
entity comp index.auth seq id: 16
entity comp index.comp id: ASN

1,4042,17
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 17
entity comp index.auth seq id: 17
entity comp index.comp id: GLU

1,4042,18
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 18
entity comp index.auth seq id: 18
entity comp index.comp id: ALA

1,4042,19
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 19
entity comp index.auth seq id: 19
entity comp index.comp id: ALA

1,4042,20
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 20
entity comp index.auth seq id: 20
entity comp index.comp id: ASP

1,4042,21
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 21
entity comp index.auth seq id: 21
entity comp index.comp id: ALA

1,4042,22
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 22
entity comp index.auth seq id: 22
entity comp index.comp id: SER

1,4042,23
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 23
entity comp index.auth seq id: 23
entity comp index.comp id: GLY

1,4042,24
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 24
entity comp index.auth seq id: 24
entity comp index.comp id: HIS

1,4042,25
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 25
entity comp index.auth seq id: 25
entity comp index.comp id: PRO

1,4042,26
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 26
entity comp index.auth seq id: 26
entity comp index.comp id: ARG

1,4042,27
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 27
entity comp index.auth seq id: 27
entity comp index.comp id: TYR

1,4042,28
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 28
entity comp index.auth seq id: 28
entity comp index.comp id: GLN

1,4042,29
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 29
entity comp index.auth seq id: 29
entity comp index.comp id: GLU

1,4042,30
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 30
entity comp index.auth seq id: 30
entity comp index.comp id: GLY

1,4042,31
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 31
entity comp index.auth seq id: 31
entity comp index.comp id: GLN

1,4042,32
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 32
entity comp index.auth seq id: 32
entity comp index.comp id: LEU

1,4042,33
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 33
entity comp index.auth seq id: 33
entity comp index.comp id: CYS

1,4042,34
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 34
entity comp index.auth seq id: 34
entity comp index.comp id: GLU

1,4042,35
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 35
entity comp index.auth seq id: 35
entity comp index.comp id: ASN

1,4042,36
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 36
entity comp index.auth seq id: 36
entity comp index.comp id: CYS

1,4042,37
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 37
entity comp index.auth seq id: 37
entity comp index.comp id: ALA

1,4042,38
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 38
entity comp index.auth seq id: 38
entity comp index.comp id: PHE

1,4042,39
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 39
entity comp index.auth seq id: 39
entity comp index.comp id: TRP

1,4042,40
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 40
entity comp index.auth seq id: 40
entity comp index.comp id: GLY

1,4042,41
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 41
entity comp index.auth seq id: 41
entity comp index.comp id: GLU

1,4042,42
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 42
entity comp index.auth seq id: 42
entity comp index.comp id: ALA

1,4042,43
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 43
entity comp index.auth seq id: 43
entity comp index.comp id: VAL

1,4042,44
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 44
entity comp index.auth seq id: 44
entity comp index.comp id: GLN

1,4042,45
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 45
entity comp index.auth seq id: 45
entity comp index.comp id: ASP

1,4042,46
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 46
entity comp index.auth seq id: 46
entity comp index.comp id: GLY

1,4042,47
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 47
entity comp index.auth seq id: 47
entity comp index.comp id: TRP

1,4042,48
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 48
entity comp index.auth seq id: 48
entity comp index.comp id: GLY

1,4042,49
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 49
entity comp index.auth seq id: 49
entity comp index.comp id: ARG

1,4042,50
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 50
entity comp index.auth seq id: 50
entity comp index.comp id: CYS

1,4042,51
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 51
entity comp index.auth seq id: 51
entity comp index.comp id: THR

1,4042,52
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 52
entity comp index.auth seq id: 52
entity comp index.comp id: HIS

1,4042,53
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 53
entity comp index.auth seq id: 53
entity comp index.comp id: PRO

1,4042,54
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 54
entity comp index.auth seq id: 54
entity comp index.comp id: ASP

1,4042,55
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 55
entity comp index.auth seq id: 55
entity comp index.comp id: PHE

1,4042,56
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 56
entity comp index.auth seq id: 56
entity comp index.comp id: ASP

1,4042,57
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 57
entity comp index.auth seq id: 57
entity comp index.comp id: GLU

1,4042,58
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 58
entity comp index.auth seq id: 58
entity comp index.comp id: VAL

1,4042,59
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 59
entity comp index.auth seq id: 59
entity comp index.comp id: LEU

1,4042,60
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 60
entity comp index.auth seq id: 60
entity comp index.comp id: VAL

1,4042,61
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 61
entity comp index.auth seq id: 61
entity comp index.comp id: LYS

1,4042,62
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 62
entity comp index.auth seq id: 62
entity comp index.comp id: ALA

1,4042,63
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 63
entity comp index.auth seq id: 63
entity comp index.comp id: GLU

1,4042,64
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 64
entity comp index.auth seq id: 64
entity comp index.comp id: GLY

1,4042,65
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 65
entity comp index.auth seq id: 65
entity comp index.comp id: TRP

1,4042,66
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 66
entity comp index.auth seq id: 66
entity comp index.comp id: CYS

1,4042,67
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 67
entity comp index.auth seq id: 67
entity comp index.comp id: SER

1,4042,68
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 68
entity comp index.auth seq id: 68
entity comp index.comp id: VAL

1,4042,69
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 69
entity comp index.auth seq id: 69
entity comp index.comp id: TYR

1,4042,70
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 70
entity comp index.auth seq id: 70
entity comp index.comp id: ALA

1,4042,71
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 71
entity comp index.auth seq id: 71
entity comp index.comp id: PRO

1,4042,72
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 72
entity comp index.auth seq id: 72
entity comp index.comp id: ALA

1,4042,73
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 1
entity comp index.entry id: 4042
entity comp index.id: 73
entity comp index.auth seq id: 73
entity comp index.comp id: SER

2,4042,74
type: entity comp index
of datablock: info:bmrb/4042
entity comp index.entity id: 2
entity comp index.entry id: 4042
entity comp index.id: 74
entity comp index.auth seq id: 1
entity comp index.comp id: SF4
entity comp index.comp label: chem_comp_SF4

1PIH,PDB,1,4042
type: entity db link
of datablock: info:bmrb/4042
entity db link.accession code: 1PIH
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 4042
entity db link.author supplied: no
entity db link.entry mol name: The Three Dimensional Structure Of The Paramagnetic Protein Hipip I From E.Halophila Through Nuclear Magnetic Resonance
entity db link.ordinal: 1
entity db link.seq homology expectation val: 2.48E-45
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 73

info:pdb/1PIH

pdb:1PIH

1PIJ,PDB,1,4042
type: entity db link
of datablock: info:bmrb/4042
entity db link.accession code: 1PIJ
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 4042
entity db link.author supplied: no
entity db link.entry mol name: The Three Dimensional Structure Of The Paramagnetic Protein Hipip I From E.Halophila Through Nuclear Magnetic Resonance
entity db link.ordinal: 2
entity db link.seq homology expectation val: 2.48E-45
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 100.00
entity db link.seq subject length: 73

info:pdb/1PIJ

pdb:1PIJ

2HIP,PDB,1,4042
type: entity db link
of datablock: info:bmrb/4042
entity db link.accession code: 2HIP
entity db link.database code: PDB
entity db link.entity id: 1
entity db link.entry id: 4042
entity db link.author supplied: no
entity db link.entry mol name: The Molecular Structure Of The High Potential Iron-Sulfur Protein Isolated From Ectothiorhodospira Halophila Determined At 2.5-
entity db link.ordinal: 3
entity db link.seq homology expectation val: 2.92E-44
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 97.26
entity db link.seq subject length: 72

P04168,SP,1,4042
type: entity db link
of datablock: info:bmrb/4042
entity db link.accession code: P04168
entity db link.database code: SP
entity db link.entity id: 1
entity db link.entry id: 4042
entity db link.author supplied: no
entity db link.entry mol name: RecName: Full=High-potential iron-sulfur protein isozyme I; AltName: Full=HiPIP 1; AltName: Full=High-redox-potential ferredoxi
entity db link.ordinal: 4
entity db link.seq homology expectation val: 4.11E-44
entity db link.seq identity: 100.00
entity db link.seq positive: 100.00
entity db link.seq query to submitted percent: 97.26
entity db link.seq subject length: 71

info:uniprot/P04168

uniprot:P04168

1,4042,1
type: entity experimental src
of datablock: info:bmrb/4042
entity experimental src.entity experimental src list id: 1
entity experimental src.entry id: 4042
entity experimental src.id: 1
entity experimental src.citation id: 0
entity experimental src.entity chimera segment id: 0
entity experimental src.entity id: 1
entity experimental src.entity label: HiPIP_I_peptide
entity experimental src.host org genus: Escherichia
entity experimental src.host org name common: E. coli
entity experimental src.host org ncbi taxonomy id: 562
entity experimental src.host org scientific name: Escherichia coli
entity experimental src.host org species: coli
entity experimental src.production method: recombinant technology

info:taxonomy/562

taxonomy:562

4042,1
type: entity experimental src list
of datablock: info:bmrb/4042
reference to entry: entry
entity experimental src list.entry id: 4042
entity experimental src list.id: 1
entity experimental src list.sf category: experimental_source
entity experimental src list.sf framecode: experimental_source

1,4042,1
type: entity natural src
of datablock: info:bmrb/4042
reference to entry: entry
entity natural src.entity natural src list id: 1
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entity natural src.entity label: HiPIP_I_peptide
entity natural src.genus: Halorhodospira
entity natural src.kingdom: Not applicable
entity natural src.ncbi taxonomy id: 1053
entity natural src.organism name common: E. halophila
entity natural src.organism name scientific: Halorhodospira halophila
entity natural src.species: halophila
entity natural src.superkingdom: Bacteria

info:taxonomy/1053

taxonomy:1053

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2,4042,BMRB
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2,4042,Three letter code
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http://bmrbpub.pdbj.org/rdf/bmr4042/entry/4042
type: entry
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entry.id: 4042
entry.accession date: 1997-07-01Z
entry.experimental method: NMR
entry.last release date: 1999-10-09Z
entry.nmr star version: 3.1.1.61
entry.original nmr star version: 2.1
entry.original release date: 1999-10-09Z
entry.origination: BMRB
entry.sf category: entry_information
entry.sf framecode: entry_information
entry.submission date: 1997-07-01Z
entry.title: Sequence-specific Assignment of the 1H and 15N Nuclear Magnetic Resonance Spectra of the Reduced Recombinant High-potential Iron-sulfur Protein I from Ectothiorhodospira halophila
entry.type: macromolecule
entry.version type: update

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entry author.given name: Isabella
entry author.middle initials: Caterina
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entry author.given name: Maria
entry author.middle initials: Silvia
entry author.pdbx name: Viezzoli, M.SILVIA.

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4042,1
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release.release number: 1
release.author: BMRB
release.date: 1999-10-09Z
release.detail: Format updated to NMR-STAR version 2.1
release.type: reformat

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sample component.assembly id: 1
sample component.concentration val max: 6
sample component.concentration val min: 0.15
sample component.concentration val units: mM
sample component.entity id: 0
sample component.mol common name: sodium isoascorbate buffer

4042,1
type: sample condition list
of datablock: info:bmrb/4042
reference to entry: entry
sample condition list.entry id: 4042
sample condition list.id: 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_one

4042,2
type: sample condition list
of datablock: info:bmrb/4042
reference to entry: entry
sample condition list.entry id: 4042
sample condition list.id: 2
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_two

4042,1,pH
type: sample condition variable
of datablock: info:bmrb/4042
sample condition variable.entry id: 4042
sample condition variable.sample condition list id: 1
sample condition variable.type: pH

4042,1,temperature
type: sample condition variable
of datablock: info:bmrb/4042
sample condition variable.entry id: 4042
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 288
sample condition variable.val units: K

4042,2,pH
type: sample condition variable
of datablock: info:bmrb/4042
sample condition variable.entry id: 4042
sample condition variable.sample condition list id: 2
sample condition variable.type: pH

4042,2,temperature
type: sample condition variable
of datablock: info:bmrb/4042
sample condition variable.entry id: 4042
sample condition variable.sample condition list id: 2
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val units: K