Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
type: datablock
alternative label: 1J4M
link to mmcif: 1J4M.cif.gz
link to pdbml: 1J4M.xml.gz
link to pdbml noatom: 1J4M-noatom.xml.gz
link to pdbml extatom: 1J4M-extatom.xml.gz
link to doi: doi:10.2210/pdb1J4M/pdb
datablock name: 1J4M-noatom
has atom sites category: atom sitesCategory
has atom type category: atom typeCategory
has audit author category: audit authorCategory
has audit conform category: audit conformCategory
has chem comp category: chem compCategory
has chem comp atom category: chem comp atomCategory
has chem comp bond category: chem comp bondCategory
has citation category: citationCategory
has citation author category: citation authorCategory
has database 2 category: database 2Category
has database PDB matrix category: database PDB matrixCategory
has diffrn category: diffrnCategory
has diffrn radiation category: diffrn radiationCategory
has diffrn radiation wavelength category: diffrn radiation wavelengthCategory
has entity category: entityCategory
has entity poly category: entity polyCategory
has entity poly seq category: entity poly seqCategory
has entry category: entryCategory
has exptl category: exptlCategory
has exptl crystal category: exptl crystalCategory
has pdbx audit revision category category: pdbx audit revision categoryCategory
has pdbx audit revision details category: pdbx audit revision detailsCategory
has pdbx audit revision group category: pdbx audit revision groupCategory
has pdbx audit revision history category: pdbx audit revision historyCategory
has pdbx audit revision item category: pdbx audit revision itemCategory
has pdbx database related category: pdbx database relatedCategory
has pdbx database status category: pdbx database statusCategory
has pdbx entity src syn category: pdbx entity src synCategory
has pdbx nmr ensemble category: pdbx nmr ensembleCategory
has pdbx nmr exptl category: pdbx nmr exptlCategory
has pdbx nmr exptl sample conditions category: pdbx nmr exptl sample conditionsCategory
has pdbx nmr refine category: pdbx nmr refineCategory
has pdbx nmr sample details category: pdbx nmr sample detailsCategory
has pdbx nmr software category: pdbx nmr softwareCategory
has pdbx nmr spectrometer category: pdbx nmr spectrometerCategory
has pdbx poly seq scheme category: pdbx poly seq schemeCategory
has pdbx struct assembly category: pdbx struct assemblyCategory
has pdbx struct assembly gen category: pdbx struct assembly genCategory
has pdbx struct oper list category: pdbx struct oper listCategory
has pdbx struct sheet hbond category: pdbx struct sheet hbondCategory
has pdbx validate close contact category: pdbx validate close contactCategory
has pdbx validate main chain plane category: pdbx validate main chain planeCategory
has pdbx validate peptide omega category: pdbx validate peptide omegaCategory
has pdbx validate planes category: pdbx validate planesCategory
has pdbx validate polymer linkage category: pdbx validate polymer linkageCategory
has pdbx validate rmsd angle category: pdbx validate rmsd angleCategory
has pdbx validate rmsd bond category: pdbx validate rmsd bondCategory
has struct category: structCategory
has struct asym category: struct asymCategory
has struct biol category: struct biolCategory
has struct keywords category: struct keywordsCategory
has struct ref category: struct refCategory
has struct ref seq category: struct ref seqCategory
has struct sheet category: struct sheetCategory
has struct sheet order category: struct sheet orderCategory
has struct sheet range category: struct sheet rangeCategory

1J4M
type: atom sites
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
atom sites.entry id: 1J4M
atom sites.fract transf matrix11: 1
atom sites.fract transf matrix12: 0
atom sites.fract transf matrix13: 0
atom sites.fract transf matrix21: 0
atom sites.fract transf matrix22: 1
atom sites.fract transf matrix23: 0
atom sites.fract transf matrix31: 0
atom sites.fract transf matrix32: 0
atom sites.fract transf matrix33: 1
atom sites.fract transf vector1: 0
atom sites.fract transf vector2: 0
atom sites.fract transf vector3: 0

1J4M
referenced by atom sites: 1J4M
referenced by database PDB matrix: 1J4M
type: entry
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
entry.id: 1J4M
referenced by exptl: 1J4M,SOLUTION NMR
referenced by struct: 1J4M
referenced by struct keywords: 1J4M
referenced by pdbx database status: 1J4M
referenced by pdbx nmr ensemble: 1J4M
referenced by pdbx nmr refine: 1J4M,1

http://rdf.wwpdb.org/pdb/1J4M/atom_type/C
type: atom type
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
atom type.symbol: C

http://rdf.wwpdb.org/pdb/1J4M/atom_type/H
type: atom type
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
atom type.symbol: H

http://rdf.wwpdb.org/pdb/1J4M/atom_type/N
type: atom type
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
atom type.symbol: N

http://rdf.wwpdb.org/pdb/1J4M/atom_type/O
type: atom type
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
atom type.symbol: O

http://rdf.wwpdb.org/pdb/1J4M/audit_author/1
type: audit author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
audit author.pdbx ordinal: 1
audit author.name: Pastor, M.T.

http://rdf.wwpdb.org/pdb/1J4M/audit_author/2
type: audit author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
audit author.pdbx ordinal: 2
audit author.name: Lopez de la Paz, M.

http://rdf.wwpdb.org/pdb/1J4M/audit_author/3
type: audit author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
audit author.pdbx ordinal: 3
audit author.name: Lacroix, E.

http://rdf.wwpdb.org/pdb/1J4M/audit_author/4
type: audit author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
audit author.pdbx ordinal: 4
audit author.name: Serrano, L.

http://rdf.wwpdb.org/pdb/1J4M/audit_author/5
type: audit author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
audit author.pdbx ordinal: 5
audit author.name: Perez-Paya, E.

mmcif pdbx.dic,5.383
type: audit conform
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
audit conform.dict name: mmcif_pdbx.dic
audit conform.dict version: 5.383
audit conform.dict location: http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic

ARG
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: ARG
chem comp.formula: C6 H15 N4 O2 1
chem comp.formula weight: 175.209
chem comp.mon nstd flag: y
chem comp.name: ARGININE
chem comp.type: L-peptide linking
link to chem comp: ARG
referenced by chem comp atom: HXT,ARG
referenced by chem comp bond: OXT,HXT,ARG
referenced by entity poly seq: 1,ARG,14
referenced by chem comp atom: N,ARG
referenced by chem comp atom: CA,ARG
referenced by chem comp atom: C,ARG
referenced by chem comp atom: O,ARG
referenced by chem comp atom: CB,ARG
referenced by chem comp atom: CG,ARG
referenced by chem comp atom: CD,ARG
referenced by chem comp atom: NE,ARG
referenced by chem comp atom: CZ,ARG
referenced by chem comp atom: NH1,ARG
referenced by chem comp atom: NH2,ARG
referenced by chem comp atom: OXT,ARG
referenced by chem comp atom: H,ARG
referenced by chem comp atom: H2,ARG
referenced by chem comp atom: HA,ARG
referenced by chem comp atom: HB2,ARG
referenced by chem comp atom: HB3,ARG
referenced by chem comp atom: HG2,ARG
referenced by chem comp atom: HG3,ARG
referenced by chem comp atom: HD2,ARG
referenced by chem comp atom: HD3,ARG
referenced by chem comp atom: HE,ARG
referenced by chem comp atom: HH11,ARG
referenced by chem comp atom: HH12,ARG
referenced by chem comp atom: HH21,ARG
referenced by chem comp atom: HH22,ARG
referenced by chem comp bond: N,CA,ARG
referenced by chem comp bond: N,H,ARG
referenced by chem comp bond: N,H2,ARG
referenced by chem comp bond: CA,C,ARG
referenced by chem comp bond: CA,CB,ARG
referenced by chem comp bond: CA,HA,ARG
referenced by chem comp bond: C,O,ARG
referenced by chem comp bond: C,OXT,ARG
referenced by chem comp bond: CB,CG,ARG
referenced by chem comp bond: CB,HB2,ARG
referenced by chem comp bond: CB,HB3,ARG
referenced by chem comp bond: CG,CD,ARG
referenced by chem comp bond: CG,HG2,ARG
referenced by chem comp bond: CG,HG3,ARG
referenced by chem comp bond: CD,NE,ARG
referenced by chem comp bond: CD,HD2,ARG
referenced by chem comp bond: CD,HD3,ARG
referenced by chem comp bond: NE,CZ,ARG
referenced by chem comp bond: NE,HE,ARG
referenced by chem comp bond: CZ,NH1,ARG
referenced by chem comp bond: CZ,NH2,ARG
referenced by chem comp bond: NH1,HH11,ARG
referenced by chem comp bond: NH1,HH12,ARG
referenced by chem comp bond: NH2,HH21,ARG
referenced by chem comp bond: NH2,HH22,ARG
referenced by entity poly seq: 1,ARG,1

ASN
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: ASN
chem comp.formula: C4 H8 N2 O3
chem comp.formula weight: 132.118
chem comp.mon nstd flag: y
chem comp.name: ASPARAGINE
chem comp.type: L-peptide linking
link to chem comp: ASN
referenced by chem comp atom: HXT,ASN
referenced by chem comp bond: OXT,HXT,ASN
referenced by entity poly seq: 1,ASN,7
referenced by chem comp atom: N,ASN
referenced by chem comp atom: CA,ASN
referenced by chem comp atom: C,ASN
referenced by chem comp atom: O,ASN
referenced by chem comp atom: CB,ASN
referenced by chem comp atom: CG,ASN
referenced by chem comp atom: OD1,ASN
referenced by chem comp atom: ND2,ASN
referenced by chem comp atom: OXT,ASN
referenced by chem comp atom: H,ASN
referenced by chem comp atom: H2,ASN
referenced by chem comp atom: HA,ASN
referenced by chem comp atom: HB2,ASN
referenced by chem comp atom: HB3,ASN
referenced by chem comp atom: HD21,ASN
referenced by chem comp atom: HD22,ASN
referenced by chem comp bond: N,CA,ASN
referenced by chem comp bond: N,H,ASN
referenced by chem comp bond: N,H2,ASN
referenced by chem comp bond: CA,C,ASN
referenced by chem comp bond: CA,CB,ASN
referenced by chem comp bond: CA,HA,ASN
referenced by chem comp bond: C,O,ASN
referenced by chem comp bond: C,OXT,ASN
referenced by chem comp bond: CB,CG,ASN
referenced by chem comp bond: CB,HB2,ASN
referenced by chem comp bond: CB,HB3,ASN
referenced by chem comp bond: CG,OD1,ASN
referenced by chem comp bond: CG,ND2,ASN
referenced by chem comp bond: ND2,HD21,ASN
referenced by chem comp bond: ND2,HD22,ASN

GLU
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: GLU
chem comp.formula: C5 H9 N O4
chem comp.formula weight: 147.129
chem comp.mon nstd flag: y
chem comp.name: GLUTAMIC ACID
chem comp.type: L-peptide linking
link to chem comp: GLU
referenced by chem comp atom: HXT,GLU
referenced by chem comp bond: OXT,HXT,GLU
referenced by entity poly seq: 1,GLU,12
referenced by chem comp atom: N,GLU
referenced by chem comp atom: CA,GLU
referenced by chem comp atom: C,GLU
referenced by chem comp atom: O,GLU
referenced by chem comp atom: CB,GLU
referenced by chem comp atom: CG,GLU
referenced by chem comp atom: CD,GLU
referenced by chem comp atom: OE1,GLU
referenced by chem comp atom: OE2,GLU
referenced by chem comp atom: OXT,GLU
referenced by chem comp atom: H,GLU
referenced by chem comp atom: H2,GLU
referenced by chem comp atom: HA,GLU
referenced by chem comp atom: HB2,GLU
referenced by chem comp atom: HB3,GLU
referenced by chem comp atom: HG2,GLU
referenced by chem comp atom: HG3,GLU
referenced by chem comp atom: HE2,GLU
referenced by chem comp bond: N,CA,GLU
referenced by chem comp bond: N,H,GLU
referenced by chem comp bond: N,H2,GLU
referenced by chem comp bond: CA,C,GLU
referenced by chem comp bond: CA,CB,GLU
referenced by chem comp bond: CA,HA,GLU
referenced by chem comp bond: C,O,GLU
referenced by chem comp bond: C,OXT,GLU
referenced by chem comp bond: CB,CG,GLU
referenced by chem comp bond: CB,HB2,GLU
referenced by chem comp bond: CB,HB3,GLU
referenced by chem comp bond: CG,CD,GLU
referenced by chem comp bond: CG,HG2,GLU
referenced by chem comp bond: CG,HG3,GLU
referenced by chem comp bond: CD,OE1,GLU
referenced by chem comp bond: CD,OE2,GLU
referenced by chem comp bond: OE2,HE2,GLU

GLY
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: GLY
chem comp.formula: C2 H5 N O2
chem comp.formula weight: 75.067
chem comp.mon nstd flag: y
chem comp.name: GLYCINE
chem comp.type: peptide linking
link to chem comp: GLY
referenced by chem comp atom: HXT,GLY
referenced by chem comp bond: OXT,HXT,GLY
referenced by entity poly seq: 1,GLY,13
referenced by chem comp atom: N,GLY
referenced by chem comp atom: CA,GLY
referenced by chem comp atom: C,GLY
referenced by chem comp atom: O,GLY
referenced by chem comp atom: OXT,GLY
referenced by chem comp atom: H,GLY
referenced by chem comp atom: H2,GLY
referenced by chem comp atom: HA2,GLY
referenced by chem comp atom: HA3,GLY
referenced by chem comp bond: N,CA,GLY
referenced by chem comp bond: N,H,GLY
referenced by chem comp bond: N,H2,GLY
referenced by chem comp bond: CA,C,GLY
referenced by chem comp bond: CA,HA2,GLY
referenced by chem comp bond: CA,HA3,GLY
referenced by chem comp bond: C,O,GLY
referenced by chem comp bond: C,OXT,GLY
referenced by entity poly seq: 1,GLY,2
referenced by entity poly seq: 1,GLY,8

ILE
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: ILE
chem comp.formula: C6 H13 N O2
chem comp.formula weight: 131.173
chem comp.mon nstd flag: y
chem comp.name: ISOLEUCINE
chem comp.type: L-peptide linking
link to chem comp: ILE
referenced by chem comp atom: HXT,ILE
referenced by chem comp bond: OXT,HXT,ILE
referenced by entity poly seq: 1,ILE,9
referenced by chem comp atom: N,ILE
referenced by chem comp atom: CA,ILE
referenced by chem comp atom: C,ILE
referenced by chem comp atom: O,ILE
referenced by chem comp atom: CB,ILE
referenced by chem comp atom: CG1,ILE
referenced by chem comp atom: CG2,ILE
referenced by chem comp atom: CD1,ILE
referenced by chem comp atom: OXT,ILE
referenced by chem comp atom: H,ILE
referenced by chem comp atom: H2,ILE
referenced by chem comp atom: HA,ILE
referenced by chem comp atom: HB,ILE
referenced by chem comp atom: HG12,ILE
referenced by chem comp atom: HG13,ILE
referenced by chem comp atom: HG21,ILE
referenced by chem comp atom: HG22,ILE
referenced by chem comp atom: HG23,ILE
referenced by chem comp atom: HD11,ILE
referenced by chem comp atom: HD12,ILE
referenced by chem comp atom: HD13,ILE
referenced by chem comp bond: N,CA,ILE
referenced by chem comp bond: N,H,ILE
referenced by chem comp bond: N,H2,ILE
referenced by chem comp bond: CA,C,ILE
referenced by chem comp bond: CA,CB,ILE
referenced by chem comp bond: CA,HA,ILE
referenced by chem comp bond: C,O,ILE
referenced by chem comp bond: C,OXT,ILE
referenced by chem comp bond: CB,CG1,ILE
referenced by chem comp bond: CB,CG2,ILE
referenced by chem comp bond: CB,HB,ILE
referenced by chem comp bond: CG1,CD1,ILE
referenced by chem comp bond: CG1,HG12,ILE
referenced by chem comp bond: CG1,HG13,ILE
referenced by chem comp bond: CG2,HG21,ILE
referenced by chem comp bond: CG2,HG22,ILE
referenced by chem comp bond: CG2,HG23,ILE
referenced by chem comp bond: CD1,HD11,ILE
referenced by chem comp bond: CD1,HD12,ILE
referenced by chem comp bond: CD1,HD13,ILE

LYS
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: LYS
chem comp.formula: C6 H15 N2 O2 1
chem comp.formula weight: 147.195
chem comp.mon nstd flag: y
chem comp.name: LYSINE
chem comp.type: L-peptide linking
link to chem comp: LYS
referenced by chem comp atom: HXT,LYS
referenced by chem comp bond: OXT,HXT,LYS
referenced by entity poly seq: 1,LYS,3
referenced by chem comp atom: N,LYS
referenced by chem comp atom: CA,LYS
referenced by chem comp atom: C,LYS
referenced by chem comp atom: O,LYS
referenced by chem comp atom: CB,LYS
referenced by chem comp atom: CG,LYS
referenced by chem comp atom: CD,LYS
referenced by chem comp atom: CE,LYS
referenced by chem comp atom: NZ,LYS
referenced by chem comp atom: OXT,LYS
referenced by chem comp atom: H,LYS
referenced by chem comp atom: H2,LYS
referenced by chem comp atom: HA,LYS
referenced by chem comp atom: HB2,LYS
referenced by chem comp atom: HB3,LYS
referenced by chem comp atom: HG2,LYS
referenced by chem comp atom: HG3,LYS
referenced by chem comp atom: HD2,LYS
referenced by chem comp atom: HD3,LYS
referenced by chem comp atom: HE2,LYS
referenced by chem comp atom: HE3,LYS
referenced by chem comp atom: HZ1,LYS
referenced by chem comp atom: HZ2,LYS
referenced by chem comp atom: HZ3,LYS
referenced by chem comp bond: N,CA,LYS
referenced by chem comp bond: N,H,LYS
referenced by chem comp bond: N,H2,LYS
referenced by chem comp bond: CA,C,LYS
referenced by chem comp bond: CA,CB,LYS
referenced by chem comp bond: CA,HA,LYS
referenced by chem comp bond: C,O,LYS
referenced by chem comp bond: C,OXT,LYS
referenced by chem comp bond: CB,CG,LYS
referenced by chem comp bond: CB,HB2,LYS
referenced by chem comp bond: CB,HB3,LYS
referenced by chem comp bond: CG,CD,LYS
referenced by chem comp bond: CG,HG2,LYS
referenced by chem comp bond: CG,HG3,LYS
referenced by chem comp bond: CD,CE,LYS
referenced by chem comp bond: CD,HD2,LYS
referenced by chem comp bond: CD,HD3,LYS
referenced by chem comp bond: CE,NZ,LYS
referenced by chem comp bond: CE,HE2,LYS
referenced by chem comp bond: CE,HE3,LYS
referenced by chem comp bond: NZ,HZ1,LYS
referenced by chem comp bond: NZ,HZ2,LYS
referenced by chem comp bond: NZ,HZ3,LYS

THR
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: THR
chem comp.formula: C4 H9 N O3
chem comp.formula weight: 119.119
chem comp.mon nstd flag: y
chem comp.name: THREONINE
chem comp.type: L-peptide linking
link to chem comp: THR
referenced by chem comp atom: HXT,THR
referenced by chem comp bond: OXT,HXT,THR
referenced by entity poly seq: 1,THR,10
referenced by chem comp atom: N,THR
referenced by chem comp atom: CA,THR
referenced by chem comp atom: C,THR
referenced by chem comp atom: O,THR
referenced by chem comp atom: CB,THR
referenced by chem comp atom: OG1,THR
referenced by chem comp atom: CG2,THR
referenced by chem comp atom: OXT,THR
referenced by chem comp atom: H,THR
referenced by chem comp atom: H2,THR
referenced by chem comp atom: HA,THR
referenced by chem comp atom: HB,THR
referenced by chem comp atom: HG1,THR
referenced by chem comp atom: HG21,THR
referenced by chem comp atom: HG22,THR
referenced by chem comp atom: HG23,THR
referenced by chem comp bond: N,CA,THR
referenced by chem comp bond: N,H,THR
referenced by chem comp bond: N,H2,THR
referenced by chem comp bond: CA,C,THR
referenced by chem comp bond: CA,CB,THR
referenced by chem comp bond: CA,HA,THR
referenced by chem comp bond: C,O,THR
referenced by chem comp bond: C,OXT,THR
referenced by chem comp bond: CB,OG1,THR
referenced by chem comp bond: CB,CG2,THR
referenced by chem comp bond: CB,HB,THR
referenced by chem comp bond: OG1,HG1,THR
referenced by chem comp bond: CG2,HG21,THR
referenced by chem comp bond: CG2,HG22,THR
referenced by chem comp bond: CG2,HG23,THR
referenced by entity poly seq: 1,THR,5

TRP
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: TRP
chem comp.formula: C11 H12 N2 O2
chem comp.formula weight: 204.225
chem comp.mon nstd flag: y
chem comp.name: TRYPTOPHAN
chem comp.type: L-peptide linking
link to chem comp: TRP
referenced by chem comp atom: HXT,TRP
referenced by chem comp bond: OXT,HXT,TRP
referenced by entity poly seq: 1,TRP,4
referenced by chem comp atom: N,TRP
referenced by chem comp atom: CA,TRP
referenced by chem comp atom: C,TRP
referenced by chem comp atom: O,TRP
referenced by chem comp atom: CB,TRP
referenced by chem comp atom: CG,TRP
referenced by chem comp atom: CD1,TRP
referenced by chem comp atom: CD2,TRP
referenced by chem comp atom: NE1,TRP
referenced by chem comp atom: CE2,TRP
referenced by chem comp atom: CE3,TRP
referenced by chem comp atom: CZ2,TRP
referenced by chem comp atom: CZ3,TRP
referenced by chem comp atom: CH2,TRP
referenced by chem comp atom: OXT,TRP
referenced by chem comp atom: H,TRP
referenced by chem comp atom: H2,TRP
referenced by chem comp atom: HA,TRP
referenced by chem comp atom: HB2,TRP
referenced by chem comp atom: HB3,TRP
referenced by chem comp atom: HD1,TRP
referenced by chem comp atom: HE1,TRP
referenced by chem comp atom: HE3,TRP
referenced by chem comp atom: HZ2,TRP
referenced by chem comp atom: HZ3,TRP
referenced by chem comp atom: HH2,TRP
referenced by chem comp bond: N,CA,TRP
referenced by chem comp bond: N,H,TRP
referenced by chem comp bond: N,H2,TRP
referenced by chem comp bond: CA,C,TRP
referenced by chem comp bond: CA,CB,TRP
referenced by chem comp bond: CA,HA,TRP
referenced by chem comp bond: C,O,TRP
referenced by chem comp bond: C,OXT,TRP
referenced by chem comp bond: CB,CG,TRP
referenced by chem comp bond: CB,HB2,TRP
referenced by chem comp bond: CB,HB3,TRP
referenced by chem comp bond: CG,CD1,TRP
referenced by chem comp bond: CG,CD2,TRP
referenced by chem comp bond: CD1,NE1,TRP
referenced by chem comp bond: CD1,HD1,TRP
referenced by chem comp bond: CD2,CE2,TRP
referenced by chem comp bond: CD2,CE3,TRP
referenced by chem comp bond: NE1,CE2,TRP
referenced by chem comp bond: NE1,HE1,TRP
referenced by chem comp bond: CE2,CZ2,TRP
referenced by chem comp bond: CE3,CZ3,TRP
referenced by chem comp bond: CE3,HE3,TRP
referenced by chem comp bond: CZ2,CH2,TRP
referenced by chem comp bond: CZ2,HZ2,TRP
referenced by chem comp bond: CZ3,CH2,TRP
referenced by chem comp bond: CZ3,HZ3,TRP
referenced by chem comp bond: CH2,HH2,TRP

TYR
type: chem comp
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
chem comp.id: TYR
chem comp.formula: C9 H11 N O3
chem comp.formula weight: 181.189
chem comp.mon nstd flag: y
chem comp.name: TYROSINE
chem comp.type: L-peptide linking
link to chem comp: TYR
referenced by chem comp atom: HXT,TYR
referenced by chem comp bond: OXT,HXT,TYR
referenced by entity poly seq: 1,TYR,11
referenced by chem comp atom: N,TYR
referenced by chem comp atom: CA,TYR
referenced by chem comp atom: C,TYR
referenced by chem comp atom: O,TYR
referenced by chem comp atom: CB,TYR
referenced by chem comp atom: CG,TYR
referenced by chem comp atom: CD1,TYR
referenced by chem comp atom: CD2,TYR
referenced by chem comp atom: CE1,TYR
referenced by chem comp atom: CE2,TYR
referenced by chem comp atom: CZ,TYR
referenced by chem comp atom: OH,TYR
referenced by chem comp atom: OXT,TYR
referenced by chem comp atom: H,TYR
referenced by chem comp atom: H2,TYR
referenced by chem comp atom: HA,TYR
referenced by chem comp atom: HB2,TYR
referenced by chem comp atom: HB3,TYR
referenced by chem comp atom: HD1,TYR
referenced by chem comp atom: HD2,TYR
referenced by chem comp atom: HE1,TYR
referenced by chem comp atom: HE2,TYR
referenced by chem comp atom: HH,TYR
referenced by chem comp bond: N,CA,TYR
referenced by chem comp bond: N,H,TYR
referenced by chem comp bond: N,H2,TYR
referenced by chem comp bond: CA,C,TYR
referenced by chem comp bond: CA,CB,TYR
referenced by chem comp bond: CA,HA,TYR
referenced by chem comp bond: C,O,TYR
referenced by chem comp bond: C,OXT,TYR
referenced by chem comp bond: CB,CG,TYR
referenced by chem comp bond: CB,HB2,TYR
referenced by chem comp bond: CB,HB3,TYR
referenced by chem comp bond: CG,CD1,TYR
referenced by chem comp bond: CG,CD2,TYR
referenced by chem comp bond: CD1,CE1,TYR
referenced by chem comp bond: CD1,HD1,TYR
referenced by chem comp bond: CD2,CE2,TYR
referenced by chem comp bond: CD2,HD2,TYR
referenced by chem comp bond: CE1,CZ,TYR
referenced by chem comp bond: CE1,HE1,TYR
referenced by chem comp bond: CE2,CZ,TYR
referenced by chem comp bond: CE2,HE2,TYR
referenced by chem comp bond: CZ,OH,TYR
referenced by chem comp bond: OH,HH,TYR
referenced by entity poly seq: 1,TYR,6

N,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: N
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 1
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,ARG
referenced by chem comp bond: N,CA,ARG
referenced by chem comp bond: N,H,ARG

CA,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: CA
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 2
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,ARG
referenced by chem comp bond: N,CA,ARG
referenced by chem comp bond: CA,C,ARG
referenced by chem comp bond: CA,CB,ARG

C,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: C
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 3
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,ARG
referenced by chem comp bond: CA,C,ARG
referenced by chem comp bond: C,O,ARG

O,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: O
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 4
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,ARG

CB,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: CB
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 5
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB3,ARG
referenced by chem comp bond: CA,CB,ARG
referenced by chem comp bond: CB,CG,ARG
referenced by chem comp bond: CB,HB2,ARG

CG,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: CG
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 6
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG,HG3,ARG
referenced by chem comp bond: CB,CG,ARG
referenced by chem comp bond: CG,CD,ARG
referenced by chem comp bond: CG,HG2,ARG

CD,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: CD
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 7
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD,HD3,ARG
referenced by chem comp bond: CG,CD,ARG
referenced by chem comp bond: CD,NE,ARG
referenced by chem comp bond: CD,HD2,ARG

NE,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: NE
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 8
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: NE,HE,ARG
referenced by chem comp bond: CD,NE,ARG
referenced by chem comp bond: NE,CZ,ARG

CZ,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: CZ
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 9
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CZ,NH2,ARG
referenced by chem comp bond: NE,CZ,ARG
referenced by chem comp bond: CZ,NH1,ARG

NH1,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: NH1
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 10
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: NH1,HH12,ARG
referenced by chem comp bond: CZ,NH1,ARG
referenced by chem comp bond: NH1,HH11,ARG

NH2,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: NH2
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 11
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: NH2,HH22,ARG
referenced by chem comp bond: CZ,NH2,ARG
referenced by chem comp bond: NH2,HH21,ARG

OXT,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: OXT
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 12
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,ARG
referenced by chem comp bond: C,OXT,ARG

H,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: H
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 13
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,ARG

H2,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: H2
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 14
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,ARG

HA,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HA
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 15
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,ARG

HB2,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HB2
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 16
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB2,ARG

HB3,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HB3
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 17
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB3,ARG

HG2,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HG2
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 18
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG,HG2,ARG

HG3,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HG3
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 19
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG,HG3,ARG

HD2,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HD2
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 20
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD,HD2,ARG

HD3,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HD3
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 21
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD,HD3,ARG

HE,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HE
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 22
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NE,HE,ARG

HH11,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HH11
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 23
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NH1,HH11,ARG

HH12,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HH12
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 24
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NH1,HH12,ARG

HH21,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HH21
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 25
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NH2,HH21,ARG

HH22,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HH22
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 26
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NH2,HH22,ARG

HXT,ARG
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
chem comp atom.atom id: HXT
chem comp atom.comp id: ARG
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 27
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,ARG

N,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: N
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 28
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,ASN
referenced by chem comp bond: N,CA,ASN
referenced by chem comp bond: N,H,ASN

CA,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: CA
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 29
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,ASN
referenced by chem comp bond: N,CA,ASN
referenced by chem comp bond: CA,C,ASN
referenced by chem comp bond: CA,CB,ASN

C,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: C
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 30
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,ASN
referenced by chem comp bond: CA,C,ASN
referenced by chem comp bond: C,O,ASN

O,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: O
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 31
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,ASN

CB,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: CB
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 32
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB3,ASN
referenced by chem comp bond: CA,CB,ASN
referenced by chem comp bond: CB,CG,ASN
referenced by chem comp bond: CB,HB2,ASN

CG,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: CG
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 33
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG,ND2,ASN
referenced by chem comp bond: CB,CG,ASN
referenced by chem comp bond: CG,OD1,ASN

OD1,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: OD1
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 34
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: CG,OD1,ASN

ND2,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: ND2
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 35
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: ND2,HD22,ASN
referenced by chem comp bond: CG,ND2,ASN
referenced by chem comp bond: ND2,HD21,ASN

OXT,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: OXT
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 36
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,ASN
referenced by chem comp bond: C,OXT,ASN

H,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: H
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 37
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,ASN

H2,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: H2
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 38
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,ASN

HA,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: HA
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 39
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,ASN

HB2,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: HB2
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 40
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB2,ASN

HB3,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: HB3
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 41
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB3,ASN

HD21,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: HD21
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 42
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: ND2,HD21,ASN

HD22,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: HD22
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 43
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: ND2,HD22,ASN

HXT,ASN
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
chem comp atom.atom id: HXT
chem comp atom.comp id: ASN
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 44
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,ASN

N,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: N
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 45
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,GLU
referenced by chem comp bond: N,CA,GLU
referenced by chem comp bond: N,H,GLU

CA,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: CA
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 46
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,GLU
referenced by chem comp bond: N,CA,GLU
referenced by chem comp bond: CA,C,GLU
referenced by chem comp bond: CA,CB,GLU

C,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: C
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 47
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,GLU
referenced by chem comp bond: CA,C,GLU
referenced by chem comp bond: C,O,GLU

O,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: O
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 48
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,GLU

CB,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: CB
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 49
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB3,GLU
referenced by chem comp bond: CA,CB,GLU
referenced by chem comp bond: CB,CG,GLU
referenced by chem comp bond: CB,HB2,GLU

CG,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: CG
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 50
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG,HG3,GLU
referenced by chem comp bond: CB,CG,GLU
referenced by chem comp bond: CG,CD,GLU
referenced by chem comp bond: CG,HG2,GLU

CD,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: CD
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 51
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD,OE2,GLU
referenced by chem comp bond: CG,CD,GLU
referenced by chem comp bond: CD,OE1,GLU

OE1,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: OE1
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 52
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: CD,OE1,GLU

OE2,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: OE2
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 53
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OE2,HE2,GLU
referenced by chem comp bond: CD,OE2,GLU

OXT,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: OXT
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 54
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,GLU
referenced by chem comp bond: C,OXT,GLU

H,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: H
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 55
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,GLU

H2,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: H2
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 56
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,GLU

HA,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HA
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 57
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,GLU

HB2,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HB2
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 58
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB2,GLU

HB3,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HB3
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 59
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB3,GLU

HG2,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HG2
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 60
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG,HG2,GLU

HG3,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HG3
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 61
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG,HG3,GLU

HE2,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HE2
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 62
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OE2,HE2,GLU

HXT,GLU
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
chem comp atom.atom id: HXT
chem comp atom.comp id: GLU
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 63
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,GLU

N,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: N
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 64
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,GLY
referenced by chem comp bond: N,CA,GLY
referenced by chem comp bond: N,H,GLY

CA,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: CA
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 65
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA3,GLY
referenced by chem comp bond: N,CA,GLY
referenced by chem comp bond: CA,C,GLY
referenced by chem comp bond: CA,HA2,GLY

C,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: C
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 66
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,GLY
referenced by chem comp bond: CA,C,GLY
referenced by chem comp bond: C,O,GLY

O,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: O
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 67
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,GLY

OXT,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: OXT
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 68
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,GLY
referenced by chem comp bond: C,OXT,GLY

H,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: H
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 69
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,GLY

H2,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: H2
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 70
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,GLY

HA2,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: HA2
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 71
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA2,GLY

HA3,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: HA3
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 72
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA3,GLY

HXT,GLY
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
chem comp atom.atom id: HXT
chem comp atom.comp id: GLY
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 73
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,GLY

N,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: N
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 74
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,ILE
referenced by chem comp bond: N,CA,ILE
referenced by chem comp bond: N,H,ILE

CA,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: CA
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 75
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,ILE
referenced by chem comp bond: N,CA,ILE
referenced by chem comp bond: CA,C,ILE
referenced by chem comp bond: CA,CB,ILE

C,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: C
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 76
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,ILE
referenced by chem comp bond: CA,C,ILE
referenced by chem comp bond: C,O,ILE

O,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: O
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 77
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,ILE

CB,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: CB
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 78
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB,ILE
referenced by chem comp bond: CA,CB,ILE
referenced by chem comp bond: CB,CG1,ILE
referenced by chem comp bond: CB,CG2,ILE

CG1,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: CG1
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 79
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG1,HG13,ILE
referenced by chem comp bond: CB,CG1,ILE
referenced by chem comp bond: CG1,CD1,ILE
referenced by chem comp bond: CG1,HG12,ILE

CG2,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: CG2
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 80
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG2,HG23,ILE
referenced by chem comp bond: CB,CG2,ILE
referenced by chem comp bond: CG2,HG21,ILE
referenced by chem comp bond: CG2,HG22,ILE

CD1,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: CD1
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 81
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD1,HD13,ILE
referenced by chem comp bond: CG1,CD1,ILE
referenced by chem comp bond: CD1,HD11,ILE
referenced by chem comp bond: CD1,HD12,ILE

OXT,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: OXT
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 82
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,ILE
referenced by chem comp bond: C,OXT,ILE

H,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: H
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 83
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,ILE

H2,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: H2
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 84
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,ILE

HA,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HA
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 85
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,ILE

HB,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HB
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 86
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB,ILE

HG12,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HG12
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 87
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG1,HG12,ILE

HG13,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HG13
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 88
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG1,HG13,ILE

HG21,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HG21
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 89
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG2,HG21,ILE

HG22,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HG22
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 90
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG2,HG22,ILE

HG23,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HG23
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 91
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG2,HG23,ILE

HD11,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HD11
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 92
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD1,HD11,ILE

HD12,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HD12
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 93
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD1,HD12,ILE

HD13,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HD13
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 94
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD1,HD13,ILE

HXT,ILE
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
chem comp atom.atom id: HXT
chem comp atom.comp id: ILE
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 95
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,ILE

N,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: N
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 96
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,LYS
referenced by chem comp bond: N,CA,LYS
referenced by chem comp bond: N,H,LYS

CA,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: CA
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 97
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,LYS
referenced by chem comp bond: N,CA,LYS
referenced by chem comp bond: CA,C,LYS
referenced by chem comp bond: CA,CB,LYS

C,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: C
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 98
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,LYS
referenced by chem comp bond: CA,C,LYS
referenced by chem comp bond: C,O,LYS

O,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: O
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 99
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,LYS

CB,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: CB
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 100
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB3,LYS
referenced by chem comp bond: CA,CB,LYS
referenced by chem comp bond: CB,CG,LYS
referenced by chem comp bond: CB,HB2,LYS

CG,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: CG
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 101
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG,HG3,LYS
referenced by chem comp bond: CB,CG,LYS
referenced by chem comp bond: CG,CD,LYS
referenced by chem comp bond: CG,HG2,LYS

CD,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: CD
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 102
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD,HD3,LYS
referenced by chem comp bond: CG,CD,LYS
referenced by chem comp bond: CD,CE,LYS
referenced by chem comp bond: CD,HD2,LYS

CE,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: CE
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 103
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CE,HE3,LYS
referenced by chem comp bond: CD,CE,LYS
referenced by chem comp bond: CE,NZ,LYS
referenced by chem comp bond: CE,HE2,LYS

NZ,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: NZ
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 104
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: NZ,HZ3,LYS
referenced by chem comp bond: CE,NZ,LYS
referenced by chem comp bond: NZ,HZ1,LYS
referenced by chem comp bond: NZ,HZ2,LYS

OXT,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: OXT
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 105
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,LYS
referenced by chem comp bond: C,OXT,LYS

H,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: H
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 106
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,LYS

H2,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: H2
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 107
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,LYS

HA,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HA
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 108
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,LYS

HB2,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HB2
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 109
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB2,LYS

HB3,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HB3
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 110
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB3,LYS

HG2,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HG2
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 111
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG,HG2,LYS

HG3,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HG3
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 112
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG,HG3,LYS

HD2,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HD2
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 113
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD,HD2,LYS

HD3,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HD3
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 114
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD,HD3,LYS

HE2,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HE2
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 115
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CE,HE2,LYS

HE3,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HE3
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 116
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CE,HE3,LYS

HZ1,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HZ1
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 117
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NZ,HZ1,LYS

HZ2,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HZ2
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 118
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NZ,HZ2,LYS

HZ3,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HZ3
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 119
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NZ,HZ3,LYS

HXT,LYS
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
chem comp atom.atom id: HXT
chem comp atom.comp id: LYS
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 120
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,LYS

N,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: N
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 121
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,THR
referenced by chem comp bond: N,CA,THR
referenced by chem comp bond: N,H,THR

CA,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: CA
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 122
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,THR
referenced by chem comp bond: N,CA,THR
referenced by chem comp bond: CA,C,THR
referenced by chem comp bond: CA,CB,THR

C,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: C
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 123
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,THR
referenced by chem comp bond: CA,C,THR
referenced by chem comp bond: C,O,THR

O,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: O
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 124
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,THR

CB,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: CB
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 125
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB,THR
referenced by chem comp bond: CA,CB,THR
referenced by chem comp bond: CB,OG1,THR
referenced by chem comp bond: CB,CG2,THR

OG1,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: OG1
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 126
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OG1,HG1,THR
referenced by chem comp bond: CB,OG1,THR

CG2,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: CG2
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 127
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG2,HG23,THR
referenced by chem comp bond: CB,CG2,THR
referenced by chem comp bond: CG2,HG21,THR
referenced by chem comp bond: CG2,HG22,THR

OXT,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: OXT
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 128
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,THR
referenced by chem comp bond: C,OXT,THR

H,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: H
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 129
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,THR

H2,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: H2
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 130
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,THR

HA,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HA
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 131
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,THR

HB,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HB
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 132
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB,THR

HG1,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HG1
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 133
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OG1,HG1,THR

HG21,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HG21
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 134
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG2,HG21,THR

HG22,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HG22
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 135
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG2,HG22,THR

HG23,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HG23
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 136
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CG2,HG23,THR

HXT,THR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
chem comp atom.atom id: HXT
chem comp atom.comp id: THR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 137
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,THR

N,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: N
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 138
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,TRP
referenced by chem comp bond: N,CA,TRP
referenced by chem comp bond: N,H,TRP

CA,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CA
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 139
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,TRP
referenced by chem comp bond: N,CA,TRP
referenced by chem comp bond: CA,C,TRP
referenced by chem comp bond: CA,CB,TRP

C,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: C
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 140
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,TRP
referenced by chem comp bond: CA,C,TRP
referenced by chem comp bond: C,O,TRP

O,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: O
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 141
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,TRP

CB,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CB
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 142
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB3,TRP
referenced by chem comp bond: CA,CB,TRP
referenced by chem comp bond: CB,CG,TRP
referenced by chem comp bond: CB,HB2,TRP

CG,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CG
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 143
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG,CD2,TRP
referenced by chem comp bond: CB,CG,TRP
referenced by chem comp bond: CG,CD1,TRP

CD1,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CD1
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 144
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD1,HD1,TRP
referenced by chem comp bond: CG,CD1,TRP
referenced by chem comp bond: CD1,NE1,TRP

CD2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CD2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 145
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD2,CE3,TRP
referenced by chem comp bond: CG,CD2,TRP
referenced by chem comp bond: CD2,CE2,TRP

NE1,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: NE1
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 146
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: NE1,HE1,TRP
referenced by chem comp bond: CD1,NE1,TRP
referenced by chem comp bond: NE1,CE2,TRP

CE2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CE2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 147
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CE2,CZ2,TRP
referenced by chem comp bond: NE1,CE2,TRP
referenced by chem comp bond: CD2,CE2,TRP

CE3,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CE3
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 148
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CE3,HE3,TRP
referenced by chem comp bond: CD2,CE3,TRP
referenced by chem comp bond: CE3,CZ3,TRP

CZ2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CZ2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 149
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CZ2,HZ2,TRP
referenced by chem comp bond: CE2,CZ2,TRP
referenced by chem comp bond: CZ2,CH2,TRP

CZ3,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CZ3
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 150
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CZ3,HZ3,TRP
referenced by chem comp bond: CE3,CZ3,TRP
referenced by chem comp bond: CZ3,CH2,TRP

CH2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: CH2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 151
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CH2,HH2,TRP
referenced by chem comp bond: CZ3,CH2,TRP
referenced by chem comp bond: CZ2,CH2,TRP

OXT,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: OXT
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 152
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,TRP
referenced by chem comp bond: C,OXT,TRP

H,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: H
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 153
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,TRP

H2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: H2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 154
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,TRP

HA,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HA
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 155
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,TRP

HB2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HB2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 156
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB2,TRP

HB3,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HB3
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 157
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB3,TRP

HD1,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HD1
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 158
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD1,HD1,TRP

HE1,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HE1
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 159
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: NE1,HE1,TRP

HE3,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HE3
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 160
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CE3,HE3,TRP

HZ2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HZ2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 161
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CZ2,HZ2,TRP

HZ3,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HZ3
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 162
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CZ3,HZ3,TRP

HH2,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HH2
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 163
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CH2,HH2,TRP

HXT,TRP
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
chem comp atom.atom id: HXT
chem comp atom.comp id: TRP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 164
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,TRP

N,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: N
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 165
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N,H2,TYR
referenced by chem comp bond: N,CA,TYR
referenced by chem comp bond: N,H,TYR

CA,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CA
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 166
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: CA,HA,TYR
referenced by chem comp bond: N,CA,TYR
referenced by chem comp bond: CA,C,TYR
referenced by chem comp bond: CA,CB,TYR

C,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: C
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 167
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C,OXT,TYR
referenced by chem comp bond: CA,C,TYR
referenced by chem comp bond: C,O,TYR

O,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: O
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 168
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C,O,TYR

CB,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CB
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 169
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CB,HB3,TYR
referenced by chem comp bond: CA,CB,TYR
referenced by chem comp bond: CB,CG,TYR
referenced by chem comp bond: CB,HB2,TYR

CG,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CG
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 170
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CG,CD2,TYR
referenced by chem comp bond: CB,CG,TYR
referenced by chem comp bond: CG,CD1,TYR

CD1,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CD1
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 171
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD1,HD1,TYR
referenced by chem comp bond: CG,CD1,TYR
referenced by chem comp bond: CD1,CE1,TYR

CD2,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CD2
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 172
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CD2,HD2,TYR
referenced by chem comp bond: CG,CD2,TYR
referenced by chem comp bond: CD2,CE2,TYR

CE1,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CE1
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 173
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CE1,HE1,TYR
referenced by chem comp bond: CD1,CE1,TYR
referenced by chem comp bond: CE1,CZ,TYR

CE2,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CE2
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 174
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CE2,HE2,TYR
referenced by chem comp bond: CD2,CE2,TYR
referenced by chem comp bond: CE2,CZ,TYR

CZ,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: CZ
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx ordinal: 175
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: CZ,OH,TYR
referenced by chem comp bond: CE2,CZ,TYR
referenced by chem comp bond: CE1,CZ,TYR

OH,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: OH
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 176
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OH,HH,TYR
referenced by chem comp bond: CZ,OH,TYR

OXT,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: OXT
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 177
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: OXT,HXT,TYR
referenced by chem comp bond: C,OXT,TYR

H,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: H
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 178
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H,TYR

H2,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: H2
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 179
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N,H2,TYR

HA,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HA
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 180
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CA,HA,TYR

HB2,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HB2
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 181
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB2,TYR

HB3,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HB3
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 182
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CB,HB3,TYR

HD1,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HD1
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 183
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD1,HD1,TYR

HD2,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HD2
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 184
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CD2,HD2,TYR

HE1,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HE1
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 185
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CE1,HE1,TYR

HE2,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HE2
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 186
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: CE2,HE2,TYR

HH,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HH
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 187
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OH,HH,TYR

HXT,TYR
type: chem comp atom
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
chem comp atom.atom id: HXT
chem comp atom.comp id: TYR
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 188
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: OXT,HXT,TYR

N,CA,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ARG
reference to chem comp atom: CA,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 1
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ARG
reference to chem comp atom: H,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 2
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ARG
reference to chem comp atom: H2,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 3
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ARG
reference to chem comp atom: C,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 4
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ARG
reference to chem comp atom: CB,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 5
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ARG
reference to chem comp atom: HA,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 6
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,ARG
reference to chem comp atom: O,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 7
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,ARG
reference to chem comp atom: OXT,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 8
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ARG
reference to chem comp atom: CG,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 9
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB2,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ARG
reference to chem comp atom: HB2,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 10
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB3,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ARG
reference to chem comp atom: HB3,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB3
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 11
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,CD,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,ARG
reference to chem comp atom: CD,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 12
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,HG2,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,ARG
reference to chem comp atom: HG2,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG2
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 13
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,HG3,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,ARG
reference to chem comp atom: HG3,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG3
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 14
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,NE,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,ARG
reference to chem comp atom: NE,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: NE
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 15
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,HD2,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,ARG
reference to chem comp atom: HD2,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: HD2
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 16
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,HD3,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,ARG
reference to chem comp atom: HD3,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: HD3
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 17
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NE,CZ,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NE,ARG
reference to chem comp atom: CZ,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: NE
chem comp bond.atom id 2: CZ
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 18
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NE,HE,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NE,ARG
reference to chem comp atom: HE,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: NE
chem comp bond.atom id 2: HE
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 19
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CZ,NH1,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ,ARG
reference to chem comp atom: NH1,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CZ
chem comp bond.atom id 2: NH1
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 20
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CZ,NH2,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ,ARG
reference to chem comp atom: NH2,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: CZ
chem comp bond.atom id 2: NH2
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 21
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

NH1,HH11,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NH1,ARG
reference to chem comp atom: HH11,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: NH1
chem comp bond.atom id 2: HH11
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 22
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NH1,HH12,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NH1,ARG
reference to chem comp atom: HH12,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: NH1
chem comp bond.atom id 2: HH12
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 23
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NH2,HH21,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NH2,ARG
reference to chem comp atom: HH21,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: NH2
chem comp bond.atom id 2: HH21
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 24
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NH2,HH22,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NH2,ARG
reference to chem comp atom: HH22,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: NH2
chem comp bond.atom id 2: HH22
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 25
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,ARG
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,ARG
reference to chem comp atom: HXT,ARG
reference to chem comp: ARG
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: ARG
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 26
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ASN
reference to chem comp atom: CA,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 27
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ASN
reference to chem comp atom: H,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 28
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ASN
reference to chem comp atom: H2,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 29
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ASN
reference to chem comp atom: C,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 30
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ASN
reference to chem comp atom: CB,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 31
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ASN
reference to chem comp atom: HA,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 32
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,ASN
reference to chem comp atom: O,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 33
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,ASN
reference to chem comp atom: OXT,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 34
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ASN
reference to chem comp atom: CG,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 35
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB2,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ASN
reference to chem comp atom: HB2,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 36
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB3,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ASN
reference to chem comp atom: HB3,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB3
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 37
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,OD1,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,ASN
reference to chem comp atom: OD1,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: OD1
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 38
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CG,ND2,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,ASN
reference to chem comp atom: ND2,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: ND2
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 39
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

ND2,HD21,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: ND2,ASN
reference to chem comp atom: HD21,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: ND2
chem comp bond.atom id 2: HD21
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 40
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

ND2,HD22,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: ND2,ASN
reference to chem comp atom: HD22,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: ND2
chem comp bond.atom id 2: HD22
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 41
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,ASN
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,ASN
reference to chem comp atom: HXT,ASN
reference to chem comp: ASN
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: ASN
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 42
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,GLU
reference to chem comp atom: CA,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 43
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,GLU
reference to chem comp atom: H,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 44
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,GLU
reference to chem comp atom: H2,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 45
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,GLU
reference to chem comp atom: C,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 46
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,GLU
reference to chem comp atom: CB,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 47
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,GLU
reference to chem comp atom: HA,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 48
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,GLU
reference to chem comp atom: O,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 49
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,GLU
reference to chem comp atom: OXT,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 50
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,GLU
reference to chem comp atom: CG,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 51
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB2,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,GLU
reference to chem comp atom: HB2,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 52
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB3,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,GLU
reference to chem comp atom: HB3,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB3
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 53
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,CD,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,GLU
reference to chem comp atom: CD,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 54
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,HG2,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,GLU
reference to chem comp atom: HG2,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG2
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 55
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,HG3,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,GLU
reference to chem comp atom: HG3,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG3
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 56
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,OE1,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,GLU
reference to chem comp atom: OE1,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: OE1
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 57
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CD,OE2,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,GLU
reference to chem comp atom: OE2,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: OE2
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 58
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OE2,HE2,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OE2,GLU
reference to chem comp atom: HE2,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: OE2
chem comp bond.atom id 2: HE2
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 59
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,GLU
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,GLU
reference to chem comp atom: HXT,GLU
reference to chem comp: GLU
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: GLU
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 60
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,GLY
reference to chem comp atom: CA,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 61
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,GLY
reference to chem comp atom: H,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 62
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,GLY
reference to chem comp atom: H2,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 63
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,GLY
reference to chem comp atom: C,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 64
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA2,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,GLY
reference to chem comp atom: HA2,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA2
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 65
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA3,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,GLY
reference to chem comp atom: HA3,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA3
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 66
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,GLY
reference to chem comp atom: O,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 67
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,GLY
reference to chem comp atom: OXT,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 68
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,GLY
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,GLY
reference to chem comp atom: HXT,GLY
reference to chem comp: GLY
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: GLY
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 69
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ILE
reference to chem comp atom: CA,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 70
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ILE
reference to chem comp atom: H,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 71
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,ILE
reference to chem comp atom: H2,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 72
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ILE
reference to chem comp atom: C,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 73
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ILE
reference to chem comp atom: CB,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 74
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,ILE
reference to chem comp atom: HA,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 75
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,ILE
reference to chem comp atom: O,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 76
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,ILE
reference to chem comp atom: OXT,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 77
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG1,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ILE
reference to chem comp atom: CG1,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG1
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 78
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG2,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ILE
reference to chem comp atom: CG2,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG2
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 79
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,ILE
reference to chem comp atom: HB,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 80
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG1,CD1,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG1,ILE
reference to chem comp atom: CD1,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CG1
chem comp bond.atom id 2: CD1
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 81
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG1,HG12,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG1,ILE
reference to chem comp atom: HG12,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CG1
chem comp bond.atom id 2: HG12
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 82
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG1,HG13,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG1,ILE
reference to chem comp atom: HG13,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CG1
chem comp bond.atom id 2: HG13
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 83
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG2,HG21,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG2,ILE
reference to chem comp atom: HG21,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CG2
chem comp bond.atom id 2: HG21
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 84
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG2,HG22,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG2,ILE
reference to chem comp atom: HG22,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CG2
chem comp bond.atom id 2: HG22
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 85
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG2,HG23,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG2,ILE
reference to chem comp atom: HG23,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CG2
chem comp bond.atom id 2: HG23
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 86
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,HD11,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,ILE
reference to chem comp atom: HD11,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: HD11
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 87
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,HD12,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,ILE
reference to chem comp atom: HD12,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: HD12
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 88
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,HD13,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,ILE
reference to chem comp atom: HD13,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: HD13
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 89
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,ILE
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,ILE
reference to chem comp atom: HXT,ILE
reference to chem comp: ILE
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: ILE
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 90
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,LYS
reference to chem comp atom: CA,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 91
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,LYS
reference to chem comp atom: H,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 92
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,LYS
reference to chem comp atom: H2,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 93
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,LYS
reference to chem comp atom: C,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 94
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,LYS
reference to chem comp atom: CB,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 95
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,LYS
reference to chem comp atom: HA,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 96
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,LYS
reference to chem comp atom: O,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 97
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,LYS
reference to chem comp atom: OXT,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 98
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,LYS
reference to chem comp atom: CG,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 99
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB2,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,LYS
reference to chem comp atom: HB2,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 100
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB3,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,LYS
reference to chem comp atom: HB3,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB3
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 101
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,CD,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,LYS
reference to chem comp atom: CD,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 102
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,HG2,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,LYS
reference to chem comp atom: HG2,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG2
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 103
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,HG3,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,LYS
reference to chem comp atom: HG3,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: HG3
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 104
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,CE,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,LYS
reference to chem comp atom: CE,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: CE
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 105
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,HD2,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,LYS
reference to chem comp atom: HD2,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: HD2
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 106
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD,HD3,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD,LYS
reference to chem comp atom: HD3,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CD
chem comp bond.atom id 2: HD3
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 107
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE,NZ,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE,LYS
reference to chem comp atom: NZ,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CE
chem comp bond.atom id 2: NZ
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 108
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE,HE2,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE,LYS
reference to chem comp atom: HE2,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CE
chem comp bond.atom id 2: HE2
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 109
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE,HE3,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE,LYS
reference to chem comp atom: HE3,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: CE
chem comp bond.atom id 2: HE3
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 110
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NZ,HZ1,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NZ,LYS
reference to chem comp atom: HZ1,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: NZ
chem comp bond.atom id 2: HZ1
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 111
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NZ,HZ2,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NZ,LYS
reference to chem comp atom: HZ2,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: NZ
chem comp bond.atom id 2: HZ2
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 112
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NZ,HZ3,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NZ,LYS
reference to chem comp atom: HZ3,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: NZ
chem comp bond.atom id 2: HZ3
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 113
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,LYS
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,LYS
reference to chem comp atom: HXT,LYS
reference to chem comp: LYS
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: LYS
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 114
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,THR
reference to chem comp atom: CA,THR
reference to chem comp: THR
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 115
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,THR
reference to chem comp atom: H,THR
reference to chem comp: THR
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 116
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,THR
reference to chem comp atom: H2,THR
reference to chem comp: THR
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 117
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,THR
reference to chem comp atom: C,THR
reference to chem comp: THR
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 118
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,THR
reference to chem comp atom: CB,THR
reference to chem comp: THR
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 119
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,THR
reference to chem comp atom: HA,THR
reference to chem comp: THR
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 120
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,THR
reference to chem comp atom: O,THR
reference to chem comp: THR
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 121
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,THR
reference to chem comp atom: OXT,THR
reference to chem comp: THR
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 122
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,OG1,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,THR
reference to chem comp atom: OG1,THR
reference to chem comp: THR
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: OG1
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 123
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG2,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,THR
reference to chem comp atom: CG2,THR
reference to chem comp: THR
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG2
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 124
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,THR
reference to chem comp atom: HB,THR
reference to chem comp: THR
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 125
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OG1,HG1,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OG1,THR
reference to chem comp atom: HG1,THR
reference to chem comp: THR
chem comp bond.atom id 1: OG1
chem comp bond.atom id 2: HG1
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 126
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG2,HG21,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG2,THR
reference to chem comp atom: HG21,THR
reference to chem comp: THR
chem comp bond.atom id 1: CG2
chem comp bond.atom id 2: HG21
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 127
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG2,HG22,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG2,THR
reference to chem comp atom: HG22,THR
reference to chem comp: THR
chem comp bond.atom id 1: CG2
chem comp bond.atom id 2: HG22
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 128
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG2,HG23,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG2,THR
reference to chem comp atom: HG23,THR
reference to chem comp: THR
chem comp bond.atom id 1: CG2
chem comp bond.atom id 2: HG23
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 129
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,THR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,THR
reference to chem comp atom: HXT,THR
reference to chem comp: THR
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: THR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 130
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,TRP
reference to chem comp atom: CA,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 131
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,TRP
reference to chem comp atom: H,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 132
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,TRP
reference to chem comp atom: H2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 133
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,TRP
reference to chem comp atom: C,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 134
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,TRP
reference to chem comp atom: CB,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 135
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,TRP
reference to chem comp atom: HA,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 136
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,TRP
reference to chem comp atom: O,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 137
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,TRP
reference to chem comp atom: OXT,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 138
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,TRP
reference to chem comp atom: CG,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 139
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,TRP
reference to chem comp atom: HB2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 140
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB3,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,TRP
reference to chem comp atom: HB3,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB3
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 141
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,CD1,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,TRP
reference to chem comp atom: CD1,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD1
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 142
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CG,CD2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,TRP
reference to chem comp atom: CD2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 143
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,NE1,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,TRP
reference to chem comp atom: NE1,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: NE1
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 144
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,HD1,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,TRP
reference to chem comp atom: HD1,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: HD1
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 145
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD2,CE2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD2,TRP
reference to chem comp atom: CE2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CD2
chem comp bond.atom id 2: CE2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 146
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CD2,CE3,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD2,TRP
reference to chem comp atom: CE3,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CD2
chem comp bond.atom id 2: CE3
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 147
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NE1,CE2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NE1,TRP
reference to chem comp atom: CE2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: NE1
chem comp bond.atom id 2: CE2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 148
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

NE1,HE1,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: NE1,TRP
reference to chem comp atom: HE1,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: NE1
chem comp bond.atom id 2: HE1
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 149
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE2,CZ2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE2,TRP
reference to chem comp atom: CZ2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CE2
chem comp bond.atom id 2: CZ2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 150
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE3,CZ3,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE3,TRP
reference to chem comp atom: CZ3,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CE3
chem comp bond.atom id 2: CZ3
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 151
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CE3,HE3,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE3,TRP
reference to chem comp atom: HE3,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CE3
chem comp bond.atom id 2: HE3
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 152
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CZ2,CH2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ2,TRP
reference to chem comp atom: CH2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CZ2
chem comp bond.atom id 2: CH2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 153
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CZ2,HZ2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ2,TRP
reference to chem comp atom: HZ2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CZ2
chem comp bond.atom id 2: HZ2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 154
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CZ3,CH2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ3,TRP
reference to chem comp atom: CH2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CZ3
chem comp bond.atom id 2: CH2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 155
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CZ3,HZ3,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ3,TRP
reference to chem comp atom: HZ3,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CZ3
chem comp bond.atom id 2: HZ3
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 156
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CH2,HH2,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CH2,TRP
reference to chem comp atom: HH2,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: CH2
chem comp bond.atom id 2: HH2
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 157
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,TRP
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,TRP
reference to chem comp atom: HXT,TRP
reference to chem comp: TRP
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: TRP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 158
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,CA,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,TYR
reference to chem comp atom: CA,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: N
chem comp bond.atom id 2: CA
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 159
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,TYR
reference to chem comp atom: H,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 160
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N,H2,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: N,TYR
reference to chem comp atom: H2,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: N
chem comp bond.atom id 2: H2
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 161
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,C,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,TYR
reference to chem comp atom: C,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: C
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 162
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,CB,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,TYR
reference to chem comp atom: CB,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: CB
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 163
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CA,HA,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CA,TYR
reference to chem comp atom: HA,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CA
chem comp bond.atom id 2: HA
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 164
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,O,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,TYR
reference to chem comp atom: O,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: C
chem comp bond.atom id 2: O
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 165
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C,OXT,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: C,TYR
reference to chem comp atom: OXT,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: C
chem comp bond.atom id 2: OXT
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 166
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,CG,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,TYR
reference to chem comp atom: CG,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: CG
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 167
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB2,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,TYR
reference to chem comp atom: HB2,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB2
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 168
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CB,HB3,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CB,TYR
reference to chem comp atom: HB3,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CB
chem comp bond.atom id 2: HB3
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 169
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CG,CD1,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,TYR
reference to chem comp atom: CD1,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD1
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 170
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CG,CD2,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CG,TYR
reference to chem comp atom: CD2,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CG
chem comp bond.atom id 2: CD2
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 171
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,CE1,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,TYR
reference to chem comp atom: CE1,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: CE1
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 172
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD1,HD1,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD1,TYR
reference to chem comp atom: HD1,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CD1
chem comp bond.atom id 2: HD1
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 173
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CD2,CE2,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD2,TYR
reference to chem comp atom: CE2,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CD2
chem comp bond.atom id 2: CE2
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 174
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CD2,HD2,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CD2,TYR
reference to chem comp atom: HD2,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CD2
chem comp bond.atom id 2: HD2
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 175
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE1,CZ,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE1,TYR
reference to chem comp atom: CZ,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CE1
chem comp bond.atom id 2: CZ
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 176
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

CE1,HE1,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE1,TYR
reference to chem comp atom: HE1,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CE1
chem comp bond.atom id 2: HE1
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 177
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE2,CZ,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE2,TYR
reference to chem comp atom: CZ,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CE2
chem comp bond.atom id 2: CZ
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 178
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CE2,HE2,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CE2,TYR
reference to chem comp atom: HE2,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CE2
chem comp bond.atom id 2: HE2
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 179
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

CZ,OH,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: CZ,TYR
reference to chem comp atom: OH,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: CZ
chem comp bond.atom id 2: OH
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 180
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OH,HH,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OH,TYR
reference to chem comp atom: HH,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: OH
chem comp bond.atom id 2: HH
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 181
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

OXT,HXT,TYR
type: chem comp bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp atom: OXT,TYR
reference to chem comp atom: HXT,TYR
reference to chem comp: TYR
chem comp bond.atom id 1: OXT
chem comp bond.atom id 2: HXT
chem comp bond.comp id: TYR
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 182
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

primary
type: citation
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
citation.id: primary
citation.country: US
citation.journal abbrev: Proc.Natl.Acad.Sci.USA
citation.journal id ASTM: PNASA6
citation.journal id CSD: 0040
citation.journal id ISSN: 0027-8424
citation.journal volume: 99
citation.page first: 614
citation.page last: 619
citation.pdbx database id DOI: 10.1073/pnas.012583999
citation.pdbx database id pub med: 11782528
citation.title: Combinatorial approaches: a new tool to search for highly structured beta-hairpin peptides.
citation.year: 2002
link to doi: doi:10.1073/pnas.012583999
link to pubmed: pubmed:11782528
references: pubmed:11782528
referenced by citation author: primary,Perez-Paya, E.,5
referenced by citation author: primary,Pastor, M.T.,1
referenced by citation author: primary,Lopez de la Paz, M.,2
referenced by citation author: primary,Lacroix, E.,3
referenced by citation author: primary,Serrano, L.,4

primary,Pastor, M.T.,1
type: citation author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to citation: primary
citation author.citation id: primary
citation author.name: Pastor, M.T.
citation author.ordinal: 1

primary,Lopez de la Paz, M.,2
type: citation author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to citation: primary
citation author.citation id: primary
citation author.name: Lopez de la Paz, M.
citation author.ordinal: 2

primary,Lacroix, E.,3
type: citation author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to citation: primary
citation author.citation id: primary
citation author.name: Lacroix, E.
citation author.ordinal: 3

primary,Serrano, L.,4
type: citation author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to citation: primary
citation author.citation id: primary
citation author.name: Serrano, L.
citation author.ordinal: 4

primary,Perez-Paya, E.,5
type: citation author
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to citation: primary
citation author.citation id: primary
citation author.name: Perez-Paya, E.
citation author.ordinal: 5

1J4M,PDB
type: database 2
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
database 2.database code: 1J4M
database 2.database id: PDB
database 2.pdbx DOI: 10.2210/pdb1j4m/pdb
database 2.pdbx database accession: pdb_00001j4m

RCSB001606,RCSB
type: database 2
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
database 2.database code: RCSB001606
database 2.database id: RCSB

D 1000001606,WWPDB
type: database 2
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
database 2.database code: D_1000001606
database 2.database id: WWPDB

1J4M
type: database PDB matrix
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
database PDB matrix.entry id: 1J4M
database PDB matrix.origx11: 1
database PDB matrix.origx12: 0
database PDB matrix.origx13: 0
database PDB matrix.origx21: 0
database PDB matrix.origx22: 1
database PDB matrix.origx23: 0
database PDB matrix.origx31: 0
database PDB matrix.origx32: 0
database PDB matrix.origx33: 1
database PDB matrix.origx vector1: 0
database PDB matrix.origx vector2: 0
database PDB matrix.origx vector3: 0

http://rdf.wwpdb.org/pdb/1J4M/diffrn/1
type: diffrn
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to exptl crystal: http://rdf.wwpdb.org/pdb/1J4M/exptl_crystal/1
diffrn.id: 1
diffrn.crystal id: 1
referenced by diffrn radiation: http://rdf.wwpdb.org/pdb/1J4M/diffrn_radiation/1

http://rdf.wwpdb.org/pdb/1J4M/exptl_crystal/1
referenced by diffrn: http://rdf.wwpdb.org/pdb/1J4M/diffrn/1
type: exptl crystal
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
exptl crystal.id: 1

http://rdf.wwpdb.org/pdb/1J4M/diffrn_radiation/1
type: diffrn radiation
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to diffrn: http://rdf.wwpdb.org/pdb/1J4M/diffrn/1
diffrn radiation.diffrn id: 1
diffrn radiation.pdbx diffrn protocol: SINGLE WAVELENGTH
diffrn radiation.pdbx monochromatic or laue m l: M
diffrn radiation.wavelength id: 1

http://rdf.wwpdb.org/pdb/1J4M/diffrn_radiation_wavelength/1
type: diffrn radiation wavelength
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
diffrn radiation wavelength.id: 1
diffrn radiation wavelength.wt: 1

http://rdf.wwpdb.org/pdb/1J4M/entity/1
type: entity
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
entity.id: 1
entity.formula weight: 1703.877
entity.pdbx description: MBH12
entity.pdbx number of molecules: 1
entity.src method: syn
entity.type: polymer
referenced by entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
referenced by struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
referenced by struct ref: http://rdf.wwpdb.org/pdb/1J4M/struct_ref/1
referenced by pdbx entity src syn: 1,1

http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
type: entity poly
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity: http://rdf.wwpdb.org/pdb/1J4M/entity/1
entity poly.entity id: 1
entity poly.nstd linkage: no
entity poly.nstd monomer: no
entity poly.pdbx seq one letter code: RGKWTYNGITYEGR
entity poly.pdbx seq one letter code can: RGKWTYNGITYEGR
entity poly.pdbx strand id: A
entity poly.type: polypeptide(L)
referenced by entity poly seq: 1,ARG,14
referenced by entity poly seq: 1,ARG,1
referenced by entity poly seq: 1,GLY,2
referenced by entity poly seq: 1,LYS,3
referenced by entity poly seq: 1,TRP,4
referenced by entity poly seq: 1,THR,5
referenced by entity poly seq: 1,TYR,6
referenced by entity poly seq: 1,ASN,7
referenced by entity poly seq: 1,GLY,8
referenced by entity poly seq: 1,ILE,9
referenced by entity poly seq: 1,THR,10
referenced by entity poly seq: 1,TYR,11
referenced by entity poly seq: 1,GLU,12
referenced by entity poly seq: 1,GLY,13

1,ARG,1
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: ARG
entity poly seq.num: 1
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,ARG,1

1,GLY,2
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: GLY
entity poly seq.num: 2
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,GLY,2

1,LYS,3
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: LYS
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: LYS
entity poly seq.num: 3
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,LYS,3

1,TRP,4
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TRP
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: TRP
entity poly seq.num: 4
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,TRP,4

1,THR,5
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: THR
entity poly seq.num: 5
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,THR,5

1,TYR,6
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: TYR
entity poly seq.num: 6
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,TYR,6

1,ASN,7
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ASN
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: ASN
entity poly seq.num: 7
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,ASN,7

1,GLY,8
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: GLY
entity poly seq.num: 8
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,GLY,8

1,ILE,9
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ILE
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: ILE
entity poly seq.num: 9
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,ILE,9

1,THR,10
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: THR
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: THR
entity poly seq.num: 10
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,THR,10

1,TYR,11
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: TYR
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: TYR
entity poly seq.num: 11
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,TYR,11

1,GLU,12
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLU
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: GLU
entity poly seq.num: 12
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,GLU,12

1,GLY,13
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: GLY
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: GLY
entity poly seq.num: 13
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,GLY,13

1,ARG,14
type: entity poly seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to chem comp: ARG
reference to entity poly: http://rdf.wwpdb.org/pdb/1J4M/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: ARG
entity poly seq.num: 14
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,ARG,14

1J4M,SOLUTION NMR
type: exptl
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
exptl.entry id: 1J4M
exptl.method: SOLUTION NMR

Structure model,1,4
type: pdbx audit revision category
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 1
pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: database_2

Structure model,4
referenced by pdbx audit revision category: Structure model,1,4
referenced by pdbx audit revision category: Structure model,2,4
referenced by pdbx audit revision category: Structure model,3,4
referenced by pdbx audit revision category: Structure model,4,4
referenced by pdbx audit revision group: Structure model,3,4
referenced by pdbx audit revision group: Structure model,4,4
referenced by pdbx audit revision group: Structure model,5,4
type: pdbx audit revision history
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 4
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 3
pdbx audit revision history.revision date: 2022-02-23
referenced by pdbx audit revision item: Structure model,3,4
referenced by pdbx audit revision item: Structure model,1,4
referenced by pdbx audit revision item: Structure model,2,4

Structure model,2,4
type: pdbx audit revision category
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 2
pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: pdbx_nmr_software

Structure model,3,4
type: pdbx audit revision category
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 3
pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: pdbx_struct_assembly

Structure model,4,4
type: pdbx audit revision category
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 4
pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: pdbx_struct_oper_list

Structure model,5,5
type: pdbx audit revision category
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,5
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 5
pdbx audit revision category.revision ordinal: 5
pdbx audit revision category.category: chem_comp_atom

Structure model,5
referenced by pdbx audit revision category: Structure model,5,5
referenced by pdbx audit revision category: Structure model,6,5
referenced by pdbx audit revision group: Structure model,6,5
type: pdbx audit revision history
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 5
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 4
pdbx audit revision history.revision date: 2023-12-27

Structure model,6,5
type: pdbx audit revision category
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,5
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 6
pdbx audit revision category.revision ordinal: 5
pdbx audit revision category.category: chem_comp_bond

Structure model,1,1
type: pdbx audit revision details
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,1
pdbx audit revision details.data content type: Structure model
pdbx audit revision details.ordinal: 1
pdbx audit revision details.revision ordinal: 1
pdbx audit revision details.provider: repository
pdbx audit revision details.type: Initial release

Structure model,1
referenced by pdbx audit revision details: Structure model,1,1
type: pdbx audit revision history
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 1
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 0
pdbx audit revision history.revision date: 2001-10-17

Structure model,1,2
type: pdbx audit revision group
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,2
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 1
pdbx audit revision group.revision ordinal: 2
pdbx audit revision group.group: Version format compliance

Structure model,2
referenced by pdbx audit revision group: Structure model,1,2
type: pdbx audit revision history
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 2
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 1
pdbx audit revision history.revision date: 2008-04-26

Structure model,2,3
type: pdbx audit revision group
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,3
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 2
pdbx audit revision group.revision ordinal: 3
pdbx audit revision group.group: Version format compliance

Structure model,3
referenced by pdbx audit revision group: Structure model,2,3
type: pdbx audit revision history
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 3
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 2
pdbx audit revision history.revision date: 2011-07-13

Structure model,3,4
type: pdbx audit revision group
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 3
pdbx audit revision group.revision ordinal: 4
pdbx audit revision group.group: Data collection

Structure model,4,4
type: pdbx audit revision group
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 4
pdbx audit revision group.revision ordinal: 4
pdbx audit revision group.group: Database references

Structure model,5,4
type: pdbx audit revision group
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 5
pdbx audit revision group.revision ordinal: 4
pdbx audit revision group.group: Derived calculations

Structure model,6,5
type: pdbx audit revision group
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,5
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 6
pdbx audit revision group.revision ordinal: 5
pdbx audit revision group.group: Data collection

Structure model,1,4
type: pdbx audit revision item
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 1
pdbx audit revision item.revision ordinal: 4
pdbx audit revision item.item: _database_2.pdbx_DOI

Structure model,2,4
type: pdbx audit revision item
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 2
pdbx audit revision item.revision ordinal: 4
pdbx audit revision item.item: _database_2.pdbx_database_accession

Structure model,3,4
type: pdbx audit revision item
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx audit revision history: Structure model,4
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 3
pdbx audit revision item.revision ordinal: 4
pdbx audit revision item.item: _pdbx_nmr_software.name

unspecified,1K43,PDB
type: pdbx database related
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx database related.content type: unspecified
pdbx database related.db id: 1K43
pdbx database related.db name: PDB
pdbx database related.details: ensemble of 10 structures

1J4M
type: pdbx database status
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
pdbx database status.entry id: 1J4M
pdbx database status.deposit site: RCSB
pdbx database status.pdb format compatible: Y
pdbx database status.process site: RCSB
pdbx database status.recvd initial deposition date: 2001-10-10
pdbx database status.status code: REL

1,1
type: pdbx entity src syn
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity: http://rdf.wwpdb.org/pdb/1J4M/entity/1
pdbx entity src syn.entity id: 1
pdbx entity src syn.pdbx src id: 1
pdbx entity src syn.details: The peptide was chemically synthesized using Fmoc chemistry.
pdbx entity src syn.pdbx alt source flag: sample

1J4M
type: pdbx nmr ensemble
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
pdbx nmr ensemble.entry id: 1J4M
pdbx nmr ensemble.conformers submitted total number: 1

1,1,1
type: pdbx nmr exptl
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 1
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.type: 2D ROESY

1,2,2
type: pdbx nmr exptl
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 2
pdbx nmr exptl.solution id: 2
pdbx nmr exptl.type: 2D NOESY

1,3,3
type: pdbx nmr exptl
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 3
pdbx nmr exptl.solution id: 3
pdbx nmr exptl.type: 2D NOESY

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_exptl_sample_conditions/1
type: pdbx nmr exptl sample conditions
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr exptl sample conditions.conditions id: 1
pdbx nmr exptl sample conditions.ionic strength: 0
pdbx nmr exptl sample conditions.p h: 5
pdbx nmr exptl sample conditions.pressure: ambient
pdbx nmr exptl sample conditions.temperature: 283
pdbx nmr exptl sample conditions.temperature units: K

1J4M,1
type: pdbx nmr refine
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
pdbx nmr refine.entry id: 1J4M
pdbx nmr refine.software ordinal: 1
pdbx nmr refine.details: Energy minimisation of the mean structure was done with the GROMOS96 implementation of Swiss-PdbViewer.
pdbx nmr refine.method: simulated annealing combined with torsion angle dynamics (DYANA)

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_sample_details/1
type: pdbx nmr sample details
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr sample details.solution id: 1
pdbx nmr sample details.contents: 1 mM Peptide MBH12
pdbx nmr sample details.solvent system: 90% H2O/10% D2O

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_sample_details/2
type: pdbx nmr sample details
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr sample details.solution id: 2
pdbx nmr sample details.contents: 1 mM Peptide MBH12
pdbx nmr sample details.solvent system: 100% D2O

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_sample_details/3
type: pdbx nmr sample details
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr sample details.solution id: 3
pdbx nmr sample details.contents: 1 mM Peptide MBH12
pdbx nmr sample details.solvent system: 40% CD3OD, 60% H2O

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_software/1
type: pdbx nmr software
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr software.ordinal: 1
pdbx nmr software.authors: Bruker
pdbx nmr software.classification: collection
pdbx nmr software.name: XwinNMR
pdbx nmr software.version: 2.6

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_software/2
type: pdbx nmr software
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr software.ordinal: 2
pdbx nmr software.authors: Bruker
pdbx nmr software.classification: data analysis
pdbx nmr software.name: XwinNMR
pdbx nmr software.version: 2.6

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_software/3
type: pdbx nmr software
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr software.ordinal: 3
pdbx nmr software.authors: Guntert, P. et al.
pdbx nmr software.classification: structure solution
pdbx nmr software.name: DYANA
pdbx nmr software.version: 1.5

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_software/4
type: pdbx nmr software
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr software.ordinal: 4
pdbx nmr software.authors: van Gunsteren
pdbx nmr software.classification: refinement
pdbx nmr software.name: GROMOS
pdbx nmr software.version: 96

http://rdf.wwpdb.org/pdb/1J4M/pdbx_nmr_spectrometer/1
type: pdbx nmr spectrometer
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx nmr spectrometer.spectrometer id: 1
pdbx nmr spectrometer.field strength: 500
pdbx nmr spectrometer.manufacturer: Bruker
pdbx nmr spectrometer.model: DRX

A,1,ARG,1
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,ARG,1
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: ARG
pdbx poly seq scheme.seq id: 1
pdbx poly seq scheme.auth mon id: ARG
pdbx poly seq scheme.auth seq num: 1
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 1
pdbx poly seq scheme.pdb mon id: ARG
pdbx poly seq scheme.pdb seq num: 1
pdbx poly seq scheme.pdb strand id: A

http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
referenced by pdbx poly seq scheme: A,1,ARG,1
referenced by pdbx poly seq scheme: A,1,GLY,2
referenced by pdbx poly seq scheme: A,1,LYS,3
referenced by pdbx poly seq scheme: A,1,TRP,4
referenced by pdbx poly seq scheme: A,1,THR,5
referenced by pdbx poly seq scheme: A,1,TYR,6
referenced by pdbx poly seq scheme: A,1,ASN,7
referenced by pdbx poly seq scheme: A,1,GLY,8
referenced by pdbx poly seq scheme: A,1,ILE,9
referenced by pdbx poly seq scheme: A,1,THR,10
referenced by pdbx poly seq scheme: A,1,TYR,11
referenced by pdbx poly seq scheme: A,1,GLU,12
referenced by pdbx poly seq scheme: A,1,GLY,13
referenced by pdbx poly seq scheme: A,1,ARG,14
type: struct asym
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity: http://rdf.wwpdb.org/pdb/1J4M/entity/1
struct asym.id: A
struct asym.entity id: 1
struct asym.pdbx blank PDB chainid flag: N
struct asym.pdbx modified: N

A,1,GLY,2
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,GLY,2
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: GLY
pdbx poly seq scheme.seq id: 2
pdbx poly seq scheme.auth mon id: GLY
pdbx poly seq scheme.auth seq num: 2
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 2
pdbx poly seq scheme.pdb mon id: GLY
pdbx poly seq scheme.pdb seq num: 2
pdbx poly seq scheme.pdb strand id: A

A,1,LYS,3
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,LYS,3
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: LYS
pdbx poly seq scheme.seq id: 3
pdbx poly seq scheme.auth mon id: LYS
pdbx poly seq scheme.auth seq num: 3
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 3
pdbx poly seq scheme.pdb mon id: LYS
pdbx poly seq scheme.pdb seq num: 3
pdbx poly seq scheme.pdb strand id: A

A,1,TRP,4
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,TRP,4
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: TRP
pdbx poly seq scheme.seq id: 4
pdbx poly seq scheme.auth mon id: TRP
pdbx poly seq scheme.auth seq num: 4
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 4
pdbx poly seq scheme.pdb mon id: TRP
pdbx poly seq scheme.pdb seq num: 4
pdbx poly seq scheme.pdb strand id: A

A,1,THR,5
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,THR,5
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: THR
pdbx poly seq scheme.seq id: 5
pdbx poly seq scheme.auth mon id: THR
pdbx poly seq scheme.auth seq num: 5
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 5
pdbx poly seq scheme.pdb mon id: THR
pdbx poly seq scheme.pdb seq num: 5
pdbx poly seq scheme.pdb strand id: A

A,1,TYR,6
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,TYR,6
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: TYR
pdbx poly seq scheme.seq id: 6
pdbx poly seq scheme.auth mon id: TYR
pdbx poly seq scheme.auth seq num: 6
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 6
pdbx poly seq scheme.pdb mon id: TYR
pdbx poly seq scheme.pdb seq num: 6
pdbx poly seq scheme.pdb strand id: A

A,1,ASN,7
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,ASN,7
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: ASN
pdbx poly seq scheme.seq id: 7
pdbx poly seq scheme.auth mon id: ASN
pdbx poly seq scheme.auth seq num: 7
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 7
pdbx poly seq scheme.pdb mon id: ASN
pdbx poly seq scheme.pdb seq num: 7
pdbx poly seq scheme.pdb strand id: A

A,1,GLY,8
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,GLY,8
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: GLY
pdbx poly seq scheme.seq id: 8
pdbx poly seq scheme.auth mon id: GLY
pdbx poly seq scheme.auth seq num: 8
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 8
pdbx poly seq scheme.pdb mon id: GLY
pdbx poly seq scheme.pdb seq num: 8
pdbx poly seq scheme.pdb strand id: A

A,1,ILE,9
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,ILE,9
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: ILE
pdbx poly seq scheme.seq id: 9
pdbx poly seq scheme.auth mon id: ILE
pdbx poly seq scheme.auth seq num: 9
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 9
pdbx poly seq scheme.pdb mon id: ILE
pdbx poly seq scheme.pdb seq num: 9
pdbx poly seq scheme.pdb strand id: A

A,1,THR,10
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,THR,10
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: THR
pdbx poly seq scheme.seq id: 10
pdbx poly seq scheme.auth mon id: THR
pdbx poly seq scheme.auth seq num: 10
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 10
pdbx poly seq scheme.pdb mon id: THR
pdbx poly seq scheme.pdb seq num: 10
pdbx poly seq scheme.pdb strand id: A

A,1,TYR,11
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,TYR,11
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: TYR
pdbx poly seq scheme.seq id: 11
pdbx poly seq scheme.auth mon id: TYR
pdbx poly seq scheme.auth seq num: 11
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 11
pdbx poly seq scheme.pdb mon id: TYR
pdbx poly seq scheme.pdb seq num: 11
pdbx poly seq scheme.pdb strand id: A

A,1,GLU,12
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,GLU,12
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: GLU
pdbx poly seq scheme.seq id: 12
pdbx poly seq scheme.auth mon id: GLU
pdbx poly seq scheme.auth seq num: 12
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 12
pdbx poly seq scheme.pdb mon id: GLU
pdbx poly seq scheme.pdb seq num: 12
pdbx poly seq scheme.pdb strand id: A

A,1,GLY,13
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,GLY,13
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: GLY
pdbx poly seq scheme.seq id: 13
pdbx poly seq scheme.auth mon id: GLY
pdbx poly seq scheme.auth seq num: 13
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 13
pdbx poly seq scheme.pdb mon id: GLY
pdbx poly seq scheme.pdb seq num: 13
pdbx poly seq scheme.pdb strand id: A

A,1,ARG,14
type: pdbx poly seq scheme
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity poly seq: 1,ARG,14
reference to struct asym: http://rdf.wwpdb.org/pdb/1J4M/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: ARG
pdbx poly seq scheme.seq id: 14
pdbx poly seq scheme.auth mon id: ARG
pdbx poly seq scheme.auth seq num: 14
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 14
pdbx poly seq scheme.pdb mon id: ARG
pdbx poly seq scheme.pdb seq num: 14
pdbx poly seq scheme.pdb strand id: A

http://rdf.wwpdb.org/pdb/1J4M/pdbx_struct_assembly/1
type: pdbx struct assembly
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx struct assembly.id: 1
pdbx struct assembly.details: author_defined_assembly
pdbx struct assembly.oligomeric count: 1
pdbx struct assembly.oligomeric details: monomeric
referenced by pdbx struct assembly gen: 1,A,1

1,A,1
type: pdbx struct assembly gen
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to pdbx struct assembly: http://rdf.wwpdb.org/pdb/1J4M/pdbx_struct_assembly/1
pdbx struct assembly gen.assembly id: 1
pdbx struct assembly gen.asym id list: A
pdbx struct assembly gen.oper expression: 1

http://rdf.wwpdb.org/pdb/1J4M/pdbx_struct_oper_list/1
type: pdbx struct oper list
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx struct oper list.id: 1
pdbx struct oper list.matrix11: 1
pdbx struct oper list.matrix12: 0
pdbx struct oper list.matrix13: 0
pdbx struct oper list.matrix21: 0
pdbx struct oper list.matrix22: 1
pdbx struct oper list.matrix23: 0
pdbx struct oper list.matrix31: 0
pdbx struct oper list.matrix32: 0
pdbx struct oper list.matrix33: 1
pdbx struct oper list.name: 1_555
pdbx struct oper list.symmetry operation: x,y,z
pdbx struct oper list.type: identity operation
pdbx struct oper list.vector1: 0
pdbx struct oper list.vector2: 0
pdbx struct oper list.vector3: 0

1,2,A
type: pdbx struct sheet hbond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to struct sheet: http://rdf.wwpdb.org/pdb/1J4M/struct_sheet/A
pdbx struct sheet hbond.range id 1: 1
pdbx struct sheet hbond.range id 2: 2
pdbx struct sheet hbond.sheet id: A
pdbx struct sheet hbond.range 1 auth asym id: A
pdbx struct sheet hbond.range 1 auth atom id: N
pdbx struct sheet hbond.range 1 auth comp id: TRP
pdbx struct sheet hbond.range 1 auth seq id: 4
pdbx struct sheet hbond.range 1 label asym id: A
pdbx struct sheet hbond.range 1 label atom id: N
pdbx struct sheet hbond.range 1 label comp id: TRP
pdbx struct sheet hbond.range 1 label seq id: 4
pdbx struct sheet hbond.range 2 auth asym id: A
pdbx struct sheet hbond.range 2 auth atom id: O
pdbx struct sheet hbond.range 2 auth comp id: TYR
pdbx struct sheet hbond.range 2 auth seq id: 11
pdbx struct sheet hbond.range 2 label asym id: A
pdbx struct sheet hbond.range 2 label atom id: O
pdbx struct sheet hbond.range 2 label comp id: TYR
pdbx struct sheet hbond.range 2 label seq id: 11

http://rdf.wwpdb.org/pdb/1J4M/struct_sheet/A
referenced by pdbx struct sheet hbond: 1,2,A
type: struct sheet
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
struct sheet.id: A
struct sheet.number strands: 2
referenced by struct sheet order: 1,2,A
referenced by struct sheet range: 2,A
referenced by struct sheet range: 1,A

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_close_contact/1
type: pdbx validate close contact
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate close contact.id: 1
pdbx validate close contact.pdb model num: 1
pdbx validate close contact.auth asym id 1: A
pdbx validate close contact.auth asym id 2: A
pdbx validate close contact.auth atom id 1: HA
pdbx validate close contact.auth atom id 2: H
pdbx validate close contact.auth comp id 1: ARG
pdbx validate close contact.auth comp id 2: GLY
pdbx validate close contact.auth seq id 1: 1
pdbx validate close contact.auth seq id 2: 2
pdbx validate close contact.dist: 0.67

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_close_contact/2
type: pdbx validate close contact
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate close contact.id: 2
pdbx validate close contact.pdb model num: 1
pdbx validate close contact.auth asym id 1: A
pdbx validate close contact.auth asym id 2: A
pdbx validate close contact.auth atom id 1: HA
pdbx validate close contact.auth atom id 2: N
pdbx validate close contact.auth comp id 1: ARG
pdbx validate close contact.auth comp id 2: GLY
pdbx validate close contact.auth seq id 1: 1
pdbx validate close contact.auth seq id 2: 2
pdbx validate close contact.dist: 1.36

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_close_contact/3
type: pdbx validate close contact
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate close contact.id: 3
pdbx validate close contact.pdb model num: 1
pdbx validate close contact.auth asym id 1: A
pdbx validate close contact.auth asym id 2: A
pdbx validate close contact.auth atom id 1: CA
pdbx validate close contact.auth atom id 2: H
pdbx validate close contact.auth comp id 1: ARG
pdbx validate close contact.auth comp id 2: GLY
pdbx validate close contact.auth seq id 1: 1
pdbx validate close contact.auth seq id 2: 2
pdbx validate close contact.dist: 1.48

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_close_contact/4
type: pdbx validate close contact
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate close contact.id: 4
pdbx validate close contact.pdb model num: 1
pdbx validate close contact.auth asym id 1: A
pdbx validate close contact.auth asym id 2: A
pdbx validate close contact.auth atom id 1: CA
pdbx validate close contact.auth atom id 2: N
pdbx validate close contact.auth comp id 1: ARG
pdbx validate close contact.auth comp id 2: GLY
pdbx validate close contact.auth seq id 1: 1
pdbx validate close contact.auth seq id 2: 2
pdbx validate close contact.dist: 1.55

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_main_chain_plane/1
type: pdbx validate main chain plane
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate main chain plane.id: 1
pdbx validate main chain plane.pdb model num: 1
pdbx validate main chain plane.auth asym id: A
pdbx validate main chain plane.auth comp id: ARG
pdbx validate main chain plane.auth seq id: 1
pdbx validate main chain plane.improper torsion angle: -15.32

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_main_chain_plane/2
type: pdbx validate main chain plane
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate main chain plane.id: 2
pdbx validate main chain plane.pdb model num: 1
pdbx validate main chain plane.auth asym id: A
pdbx validate main chain plane.auth comp id: GLY
pdbx validate main chain plane.auth seq id: 2
pdbx validate main chain plane.improper torsion angle: -18.87

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_peptide_omega/1
type: pdbx validate peptide omega
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate peptide omega.id: 1
pdbx validate peptide omega.pdb model num: 1
pdbx validate peptide omega.auth asym id 1: A
pdbx validate peptide omega.auth asym id 2: A
pdbx validate peptide omega.auth comp id 1: GLY
pdbx validate peptide omega.auth comp id 2: LYS
pdbx validate peptide omega.auth seq id 1: 2
pdbx validate peptide omega.auth seq id 2: 3
pdbx validate peptide omega.omega: 149.56

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_planes/1
type: pdbx validate planes
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate planes.id: 1
pdbx validate planes.pdb model num: 1
pdbx validate planes.auth asym id: A
pdbx validate planes.auth comp id: ARG
pdbx validate planes.auth seq id: 1
pdbx validate planes.rmsd: 0.222
pdbx validate planes.type: SIDE CHAIN

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_polymer_linkage/1
type: pdbx validate polymer linkage
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate polymer linkage.id: 1
pdbx validate polymer linkage.pdb model num: 1
pdbx validate polymer linkage.auth asym id 1: A
pdbx validate polymer linkage.auth asym id 2: A
pdbx validate polymer linkage.auth atom id 1: C
pdbx validate polymer linkage.auth atom id 2: N
pdbx validate polymer linkage.auth comp id 1: ARG
pdbx validate polymer linkage.auth comp id 2: GLY
pdbx validate polymer linkage.auth seq id 1: 1
pdbx validate polymer linkage.auth seq id 2: 2
pdbx validate polymer linkage.dist: 1.18

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/1
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 1
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 32.76
pdbx validate rmsd angle.angle standard deviation: 2
pdbx validate rmsd angle.angle target value: 110.4
pdbx validate rmsd angle.angle value: 143.16
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CA
pdbx validate rmsd angle.auth atom id 3: C
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/2
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 2
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -10.8
pdbx validate rmsd angle.angle standard deviation: 1.8
pdbx validate rmsd angle.angle target value: 110.6
pdbx validate rmsd angle.angle value: 99.8
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: N
pdbx validate rmsd angle.auth atom id 2: CA
pdbx validate rmsd angle.auth atom id 3: CB
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/3
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 3
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -19.11
pdbx validate rmsd angle.angle standard deviation: 2.2
pdbx validate rmsd angle.angle target value: 113.4
pdbx validate rmsd angle.angle value: 94.29
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CA
pdbx validate rmsd angle.auth atom id 2: CB
pdbx validate rmsd angle.auth atom id 3: CG
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/4
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 4
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -26.46
pdbx validate rmsd angle.angle standard deviation: 2.6
pdbx validate rmsd angle.angle target value: 111.6
pdbx validate rmsd angle.angle value: 85.14
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/5
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 5
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -28.36
pdbx validate rmsd angle.angle standard deviation: 2.1
pdbx validate rmsd angle.angle target value: 111.8
pdbx validate rmsd angle.angle value: 83.44
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD
pdbx validate rmsd angle.auth atom id 3: NE
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/6
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 6
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -48.47
pdbx validate rmsd angle.angle standard deviation: 1.1
pdbx validate rmsd angle.angle target value: 119.4
pdbx validate rmsd angle.angle value: 70.93
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: NH1
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: NH2
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/7
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 7
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 24.21
pdbx validate rmsd angle.angle standard deviation: 0.5
pdbx validate rmsd angle.angle target value: 120.3
pdbx validate rmsd angle.angle value: 144.51
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: NE
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: NH1
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/8
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 8
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 24.21
pdbx validate rmsd angle.angle standard deviation: 0.5
pdbx validate rmsd angle.angle target value: 120.3
pdbx validate rmsd angle.angle value: 144.51
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: NE
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: NH2
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 1
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/9
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 9
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -40.6
pdbx validate rmsd angle.angle standard deviation: 2
pdbx validate rmsd angle.angle target value: 116.2
pdbx validate rmsd angle.angle value: 75.6
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CA
pdbx validate rmsd angle.auth atom id 2: C
pdbx validate rmsd angle.auth atom id 3: N
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: GLY
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 2
pdbx validate rmsd angle.linker flag: Y

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/10
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 10
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 16.44
pdbx validate rmsd angle.angle standard deviation: 1.7
pdbx validate rmsd angle.angle target value: 123.2
pdbx validate rmsd angle.angle value: 139.64
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: O
pdbx validate rmsd angle.auth atom id 2: C
pdbx validate rmsd angle.auth atom id 3: N
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: GLY
pdbx validate rmsd angle.auth seq id 1: 1
pdbx validate rmsd angle.auth seq id 2: 1
pdbx validate rmsd angle.auth seq id 3: 2
pdbx validate rmsd angle.linker flag: Y

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/11
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 11
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -26.69
pdbx validate rmsd angle.angle standard deviation: 1.8
pdbx validate rmsd angle.angle target value: 120.6
pdbx validate rmsd angle.angle value: 93.91
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CA
pdbx validate rmsd angle.auth atom id 2: C
pdbx validate rmsd angle.auth atom id 3: O
pdbx validate rmsd angle.auth comp id 1: GLY
pdbx validate rmsd angle.auth comp id 2: GLY
pdbx validate rmsd angle.auth comp id 3: GLY
pdbx validate rmsd angle.auth seq id 1: 2
pdbx validate rmsd angle.auth seq id 2: 2
pdbx validate rmsd angle.auth seq id 3: 2
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/12
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 12
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 16.62
pdbx validate rmsd angle.angle standard deviation: 1.6
pdbx validate rmsd angle.angle target value: 122.7
pdbx validate rmsd angle.angle value: 139.32
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: O
pdbx validate rmsd angle.auth atom id 2: C
pdbx validate rmsd angle.auth atom id 3: N
pdbx validate rmsd angle.auth comp id 1: GLY
pdbx validate rmsd angle.auth comp id 2: GLY
pdbx validate rmsd angle.auth comp id 3: LYS
pdbx validate rmsd angle.auth seq id 1: 2
pdbx validate rmsd angle.auth seq id 2: 2
pdbx validate rmsd angle.auth seq id 3: 3
pdbx validate rmsd angle.linker flag: Y

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/13
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 13
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -7.91
pdbx validate rmsd angle.angle standard deviation: 1.3
pdbx validate rmsd angle.angle target value: 127
pdbx validate rmsd angle.angle value: 119.09
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD1
pdbx validate rmsd angle.auth comp id 1: TRP
pdbx validate rmsd angle.auth comp id 2: TRP
pdbx validate rmsd angle.auth comp id 3: TRP
pdbx validate rmsd angle.auth seq id 1: 4
pdbx validate rmsd angle.auth seq id 2: 4
pdbx validate rmsd angle.auth seq id 3: 4
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/14
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 14
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 6.69
pdbx validate rmsd angle.angle standard deviation: 0.9
pdbx validate rmsd angle.angle target value: 109
pdbx validate rmsd angle.angle value: 115.69
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CD1
pdbx validate rmsd angle.auth atom id 2: NE1
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TRP
pdbx validate rmsd angle.auth comp id 2: TRP
pdbx validate rmsd angle.auth comp id 3: TRP
pdbx validate rmsd angle.auth seq id 1: 4
pdbx validate rmsd angle.auth seq id 2: 4
pdbx validate rmsd angle.auth seq id 3: 4
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/15
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 15
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -10.11
pdbx validate rmsd angle.angle standard deviation: 1.2
pdbx validate rmsd angle.angle target value: 121.6
pdbx validate rmsd angle.angle value: 111.49
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CZ3
pdbx validate rmsd angle.auth atom id 2: CH2
pdbx validate rmsd angle.auth atom id 3: CZ2
pdbx validate rmsd angle.auth comp id 1: TRP
pdbx validate rmsd angle.auth comp id 2: TRP
pdbx validate rmsd angle.auth comp id 3: TRP
pdbx validate rmsd angle.auth seq id 1: 4
pdbx validate rmsd angle.auth seq id 2: 4
pdbx validate rmsd angle.auth seq id 3: 4
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/16
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 16
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 6.18
pdbx validate rmsd angle.angle standard deviation: 1
pdbx validate rmsd angle.angle target value: 117.4
pdbx validate rmsd angle.angle value: 123.58
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CH2
pdbx validate rmsd angle.auth atom id 2: CZ2
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TRP
pdbx validate rmsd angle.auth comp id 2: TRP
pdbx validate rmsd angle.auth comp id 3: TRP
pdbx validate rmsd angle.auth seq id 1: 4
pdbx validate rmsd angle.auth seq id 2: 4
pdbx validate rmsd angle.auth seq id 3: 4
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/17
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 17
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -12.78
pdbx validate rmsd angle.angle standard deviation: 1.8
pdbx validate rmsd angle.angle target value: 110.6
pdbx validate rmsd angle.angle value: 97.82
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: N
pdbx validate rmsd angle.auth atom id 2: CA
pdbx validate rmsd angle.auth atom id 3: CB
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/18
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 18
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 5.53
pdbx validate rmsd angle.angle standard deviation: 0.6
pdbx validate rmsd angle.angle target value: 121
pdbx validate rmsd angle.angle value: 126.53
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/19
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 19
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -35.35
pdbx validate rmsd angle.angle standard deviation: 1.1
pdbx validate rmsd angle.angle target value: 117.9
pdbx validate rmsd angle.angle value: 82.55
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CD1
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/20
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 20
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 29.51
pdbx validate rmsd angle.angle standard deviation: 0.6
pdbx validate rmsd angle.angle target value: 121
pdbx validate rmsd angle.angle value: 150.51
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD1
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/21
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 21
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 25.5
pdbx validate rmsd angle.angle standard deviation: 0.8
pdbx validate rmsd angle.angle target value: 121.3
pdbx validate rmsd angle.angle value: 146.8
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD1
pdbx validate rmsd angle.auth atom id 3: CE1
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/22
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 22
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 10.63
pdbx validate rmsd angle.angle standard deviation: 0.8
pdbx validate rmsd angle.angle target value: 121.3
pdbx validate rmsd angle.angle value: 131.93
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD2
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/23
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 23
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 10.28
pdbx validate rmsd angle.angle standard deviation: 0.9
pdbx validate rmsd angle.angle target value: 119.8
pdbx validate rmsd angle.angle value: 130.08
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CD1
pdbx validate rmsd angle.auth atom id 2: CE1
pdbx validate rmsd angle.auth atom id 3: CZ
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/24
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 24
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 24.12
pdbx validate rmsd angle.angle standard deviation: 2.7
pdbx validate rmsd angle.angle target value: 120.1
pdbx validate rmsd angle.angle value: 144.22
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: OH
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/25
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 25
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -32.58
pdbx validate rmsd angle.angle standard deviation: 1.6
pdbx validate rmsd angle.angle target value: 119.8
pdbx validate rmsd angle.angle value: 87.22
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CE1
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/26
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 26
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 21.62
pdbx validate rmsd angle.angle standard deviation: 0.9
pdbx validate rmsd angle.angle target value: 119.8
pdbx validate rmsd angle.angle value: 141.42
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CZ
pdbx validate rmsd angle.auth atom id 2: CE2
pdbx validate rmsd angle.auth atom id 3: CD2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 6
pdbx validate rmsd angle.auth seq id 2: 6
pdbx validate rmsd angle.auth seq id 3: 6
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/27
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 27
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 10.62
pdbx validate rmsd angle.angle standard deviation: 0.6
pdbx validate rmsd angle.angle target value: 121
pdbx validate rmsd angle.angle value: 131.62
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/28
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 28
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -24.52
pdbx validate rmsd angle.angle standard deviation: 1.1
pdbx validate rmsd angle.angle target value: 117.9
pdbx validate rmsd angle.angle value: 93.38
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CD1
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/29
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 29
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 13.98
pdbx validate rmsd angle.angle standard deviation: 0.6
pdbx validate rmsd angle.angle target value: 121
pdbx validate rmsd angle.angle value: 134.98
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD1
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/30
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 30
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 14.13
pdbx validate rmsd angle.angle standard deviation: 0.8
pdbx validate rmsd angle.angle target value: 121.3
pdbx validate rmsd angle.angle value: 135.43
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD1
pdbx validate rmsd angle.auth atom id 3: CE1
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/31
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 31
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 10.01
pdbx validate rmsd angle.angle standard deviation: 0.8
pdbx validate rmsd angle.angle target value: 121.3
pdbx validate rmsd angle.angle value: 131.31
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD2
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/32
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 32
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 11.04
pdbx validate rmsd angle.angle standard deviation: 0.9
pdbx validate rmsd angle.angle target value: 119.8
pdbx validate rmsd angle.angle value: 130.84
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CD1
pdbx validate rmsd angle.auth atom id 2: CE1
pdbx validate rmsd angle.auth atom id 3: CZ
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/33
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 33
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -25.84
pdbx validate rmsd angle.angle standard deviation: 1.6
pdbx validate rmsd angle.angle target value: 119.8
pdbx validate rmsd angle.angle value: 93.96
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CE1
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: CE2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/34
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 34
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 15.28
pdbx validate rmsd angle.angle standard deviation: 0.9
pdbx validate rmsd angle.angle target value: 119.8
pdbx validate rmsd angle.angle value: 135.08
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CZ
pdbx validate rmsd angle.auth atom id 2: CE2
pdbx validate rmsd angle.auth atom id 3: CD2
pdbx validate rmsd angle.auth comp id 1: TYR
pdbx validate rmsd angle.auth comp id 2: TYR
pdbx validate rmsd angle.auth comp id 3: TYR
pdbx validate rmsd angle.auth seq id 1: 11
pdbx validate rmsd angle.auth seq id 2: 11
pdbx validate rmsd angle.auth seq id 3: 11
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/35
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 35
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -25.88
pdbx validate rmsd angle.angle standard deviation: 2.7
pdbx validate rmsd angle.angle target value: 114.2
pdbx validate rmsd angle.angle value: 88.32
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD
pdbx validate rmsd angle.auth comp id 1: GLU
pdbx validate rmsd angle.auth comp id 2: GLU
pdbx validate rmsd angle.auth comp id 3: GLU
pdbx validate rmsd angle.auth seq id 1: 12
pdbx validate rmsd angle.auth seq id 2: 12
pdbx validate rmsd angle.auth seq id 3: 12
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/36
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 36
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -15.98
pdbx validate rmsd angle.angle standard deviation: 1.2
pdbx validate rmsd angle.angle target value: 123.3
pdbx validate rmsd angle.angle value: 107.32
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: OE1
pdbx validate rmsd angle.auth atom id 2: CD
pdbx validate rmsd angle.auth atom id 3: OE2
pdbx validate rmsd angle.auth comp id 1: GLU
pdbx validate rmsd angle.auth comp id 2: GLU
pdbx validate rmsd angle.auth comp id 3: GLU
pdbx validate rmsd angle.auth seq id 1: 12
pdbx validate rmsd angle.auth seq id 2: 12
pdbx validate rmsd angle.auth seq id 3: 12
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/37
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 37
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 26.06
pdbx validate rmsd angle.angle standard deviation: 2
pdbx validate rmsd angle.angle target value: 118.3
pdbx validate rmsd angle.angle value: 144.36
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD
pdbx validate rmsd angle.auth atom id 3: OE1
pdbx validate rmsd angle.auth comp id 1: GLU
pdbx validate rmsd angle.auth comp id 2: GLU
pdbx validate rmsd angle.auth comp id 3: GLU
pdbx validate rmsd angle.auth seq id 1: 12
pdbx validate rmsd angle.auth seq id 2: 12
pdbx validate rmsd angle.auth seq id 3: 12
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/38
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 38
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -12.47
pdbx validate rmsd angle.angle standard deviation: 2
pdbx validate rmsd angle.angle target value: 118.3
pdbx validate rmsd angle.angle value: 105.83
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD
pdbx validate rmsd angle.auth atom id 3: OE2
pdbx validate rmsd angle.auth comp id 1: GLU
pdbx validate rmsd angle.auth comp id 2: GLU
pdbx validate rmsd angle.auth comp id 3: GLU
pdbx validate rmsd angle.auth seq id 1: 12
pdbx validate rmsd angle.auth seq id 2: 12
pdbx validate rmsd angle.auth seq id 3: 12
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/39
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 39
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -12.46
pdbx validate rmsd angle.angle standard deviation: 2
pdbx validate rmsd angle.angle target value: 110.4
pdbx validate rmsd angle.angle value: 97.94
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CA
pdbx validate rmsd angle.auth atom id 3: C
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/40
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 40
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -37.7
pdbx validate rmsd angle.angle standard deviation: 2.2
pdbx validate rmsd angle.angle target value: 113.4
pdbx validate rmsd angle.angle value: 75.7
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CA
pdbx validate rmsd angle.auth atom id 2: CB
pdbx validate rmsd angle.auth atom id 3: CG
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/41
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 41
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -34.01
pdbx validate rmsd angle.angle standard deviation: 2.6
pdbx validate rmsd angle.angle target value: 111.6
pdbx validate rmsd angle.angle value: 77.59
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CB
pdbx validate rmsd angle.auth atom id 2: CG
pdbx validate rmsd angle.auth atom id 3: CD
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/42
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 42
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -37.62
pdbx validate rmsd angle.angle standard deviation: 2.1
pdbx validate rmsd angle.angle target value: 111.8
pdbx validate rmsd angle.angle value: 74.18
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: CG
pdbx validate rmsd angle.auth atom id 2: CD
pdbx validate rmsd angle.auth atom id 3: NE
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/43
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 43
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: -25.92
pdbx validate rmsd angle.angle standard deviation: 1.1
pdbx validate rmsd angle.angle target value: 119.4
pdbx validate rmsd angle.angle value: 93.48
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: NH1
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: NH2
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/44
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 44
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 14.58
pdbx validate rmsd angle.angle standard deviation: 0.5
pdbx validate rmsd angle.angle target value: 120.3
pdbx validate rmsd angle.angle value: 134.88
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: NE
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: NH1
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_angle/45
type: pdbx validate rmsd angle
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd angle.id: 45
pdbx validate rmsd angle.pdb model num: 1
pdbx validate rmsd angle.angle deviation: 10.32
pdbx validate rmsd angle.angle standard deviation: 0.5
pdbx validate rmsd angle.angle target value: 120.3
pdbx validate rmsd angle.angle value: 130.62
pdbx validate rmsd angle.auth asym id 1: A
pdbx validate rmsd angle.auth asym id 2: A
pdbx validate rmsd angle.auth asym id 3: A
pdbx validate rmsd angle.auth atom id 1: NE
pdbx validate rmsd angle.auth atom id 2: CZ
pdbx validate rmsd angle.auth atom id 3: NH2
pdbx validate rmsd angle.auth comp id 1: ARG
pdbx validate rmsd angle.auth comp id 2: ARG
pdbx validate rmsd angle.auth comp id 3: ARG
pdbx validate rmsd angle.auth seq id 1: 14
pdbx validate rmsd angle.auth seq id 2: 14
pdbx validate rmsd angle.auth seq id 3: 14
pdbx validate rmsd angle.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/1
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 1
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: N
pdbx validate rmsd bond.auth atom id 2: CA
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.26
pdbx validate rmsd bond.bond standard deviation: 0.02
pdbx validate rmsd bond.bond target value: 1.459
pdbx validate rmsd bond.bond value: 1.199
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/2
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 2
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CA
pdbx validate rmsd bond.auth atom id 2: CB
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.204
pdbx validate rmsd bond.bond standard deviation: 0.022
pdbx validate rmsd bond.bond target value: 1.535
pdbx validate rmsd bond.bond value: 1.331
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/3
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 3
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CG
pdbx validate rmsd bond.auth atom id 2: CD
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.186
pdbx validate rmsd bond.bond standard deviation: 0.025
pdbx validate rmsd bond.bond target value: 1.515
pdbx validate rmsd bond.bond value: 1.329
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/4
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 4
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: NE
pdbx validate rmsd bond.auth atom id 2: CZ
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.345
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.326
pdbx validate rmsd bond.bond value: 0.981
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/5
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 5
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: NH1
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.554
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.326
pdbx validate rmsd bond.bond value: 0.772
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/6
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 6
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: NH2
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.488
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.326
pdbx validate rmsd bond.bond value: 0.838
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/7
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 7
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CA
pdbx validate rmsd bond.auth atom id 2: C
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 1
pdbx validate rmsd bond.bond deviation: -0.181
pdbx validate rmsd bond.bond standard deviation: 0.026
pdbx validate rmsd bond.bond target value: 1.525
pdbx validate rmsd bond.bond value: 1.344
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/8
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 8
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: C
pdbx validate rmsd bond.auth atom id 2: N
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: GLY
pdbx validate rmsd bond.auth seq id 1: 1
pdbx validate rmsd bond.auth seq id 2: 2
pdbx validate rmsd bond.bond deviation: -0.156
pdbx validate rmsd bond.bond standard deviation: 0.023
pdbx validate rmsd bond.bond target value: 1.336
pdbx validate rmsd bond.bond value: 1.18
pdbx validate rmsd bond.linker flag: Y

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/9
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 9
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: N
pdbx validate rmsd bond.auth atom id 2: CA
pdbx validate rmsd bond.auth comp id 1: GLY
pdbx validate rmsd bond.auth comp id 2: GLY
pdbx validate rmsd bond.auth seq id 1: 2
pdbx validate rmsd bond.auth seq id 2: 2
pdbx validate rmsd bond.bond deviation: -0.24
pdbx validate rmsd bond.bond standard deviation: 0.015
pdbx validate rmsd bond.bond target value: 1.456
pdbx validate rmsd bond.bond value: 1.216
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/10
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 10
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CA
pdbx validate rmsd bond.auth atom id 2: C
pdbx validate rmsd bond.auth comp id 1: GLY
pdbx validate rmsd bond.auth comp id 2: GLY
pdbx validate rmsd bond.auth seq id 1: 2
pdbx validate rmsd bond.auth seq id 2: 2
pdbx validate rmsd bond.bond deviation: -0.273
pdbx validate rmsd bond.bond standard deviation: 0.016
pdbx validate rmsd bond.bond target value: 1.514
pdbx validate rmsd bond.bond value: 1.241
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/11
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 11
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CE2
pdbx validate rmsd bond.auth atom id 2: CD2
pdbx validate rmsd bond.auth comp id 1: TRP
pdbx validate rmsd bond.auth comp id 2: TRP
pdbx validate rmsd bond.auth seq id 1: 4
pdbx validate rmsd bond.auth seq id 2: 4
pdbx validate rmsd bond.bond deviation: -0.079
pdbx validate rmsd bond.bond standard deviation: 0.012
pdbx validate rmsd bond.bond target value: 1.409
pdbx validate rmsd bond.bond value: 1.33
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/12
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 12
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CB
pdbx validate rmsd bond.auth atom id 2: CG
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.115
pdbx validate rmsd bond.bond standard deviation: 0.015
pdbx validate rmsd bond.bond target value: 1.512
pdbx validate rmsd bond.bond value: 1.397
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/13
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 13
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CG
pdbx validate rmsd bond.auth atom id 2: CD2
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.252
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.387
pdbx validate rmsd bond.bond value: 1.135
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/14
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 14
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CG
pdbx validate rmsd bond.auth atom id 2: CD1
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.227
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.387
pdbx validate rmsd bond.bond value: 1.16
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/15
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 15
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CD1
pdbx validate rmsd bond.auth atom id 2: CE1
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.143
pdbx validate rmsd bond.bond standard deviation: 0.015
pdbx validate rmsd bond.bond target value: 1.389
pdbx validate rmsd bond.bond value: 1.246
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/16
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 16
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CE1
pdbx validate rmsd bond.auth atom id 2: CZ
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.306
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.381
pdbx validate rmsd bond.bond value: 1.075
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/17
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 17
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: OH
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.136
pdbx validate rmsd bond.bond standard deviation: 0.017
pdbx validate rmsd bond.bond target value: 1.374
pdbx validate rmsd bond.bond value: 1.238
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/18
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 18
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: CE2
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.223
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.381
pdbx validate rmsd bond.bond value: 1.158
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/19
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 19
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CE2
pdbx validate rmsd bond.auth atom id 2: CD2
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 6
pdbx validate rmsd bond.auth seq id 2: 6
pdbx validate rmsd bond.bond deviation: -0.14
pdbx validate rmsd bond.bond standard deviation: 0.015
pdbx validate rmsd bond.bond target value: 1.389
pdbx validate rmsd bond.bond value: 1.249
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/20
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 20
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CG
pdbx validate rmsd bond.auth atom id 2: CD2
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 11
pdbx validate rmsd bond.auth seq id 2: 11
pdbx validate rmsd bond.bond deviation: -0.157
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.387
pdbx validate rmsd bond.bond value: 1.23
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/21
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 21
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CG
pdbx validate rmsd bond.auth atom id 2: CD1
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 11
pdbx validate rmsd bond.auth seq id 2: 11
pdbx validate rmsd bond.bond deviation: -0.141
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.387
pdbx validate rmsd bond.bond value: 1.246
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/22
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 22
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CE1
pdbx validate rmsd bond.auth atom id 2: CZ
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 11
pdbx validate rmsd bond.auth seq id 2: 11
pdbx validate rmsd bond.bond deviation: -0.153
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.381
pdbx validate rmsd bond.bond value: 1.228
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/23
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 23
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: CE2
pdbx validate rmsd bond.auth comp id 1: TYR
pdbx validate rmsd bond.auth comp id 2: TYR
pdbx validate rmsd bond.auth seq id 1: 11
pdbx validate rmsd bond.auth seq id 2: 11
pdbx validate rmsd bond.bond deviation: -0.14
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.381
pdbx validate rmsd bond.bond value: 1.241
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/24
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 24
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CG
pdbx validate rmsd bond.auth atom id 2: CD
pdbx validate rmsd bond.auth comp id 1: GLU
pdbx validate rmsd bond.auth comp id 2: GLU
pdbx validate rmsd bond.auth seq id 1: 12
pdbx validate rmsd bond.auth seq id 2: 12
pdbx validate rmsd bond.bond deviation: -0.107
pdbx validate rmsd bond.bond standard deviation: 0.015
pdbx validate rmsd bond.bond target value: 1.515
pdbx validate rmsd bond.bond value: 1.408
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/25
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 25
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CD
pdbx validate rmsd bond.auth atom id 2: OE1
pdbx validate rmsd bond.auth comp id 1: GLU
pdbx validate rmsd bond.auth comp id 2: GLU
pdbx validate rmsd bond.auth seq id 1: 12
pdbx validate rmsd bond.auth seq id 2: 12
pdbx validate rmsd bond.bond deviation: -0.092
pdbx validate rmsd bond.bond standard deviation: 0.011
pdbx validate rmsd bond.bond target value: 1.252
pdbx validate rmsd bond.bond value: 1.16
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/26
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 26
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CD
pdbx validate rmsd bond.auth atom id 2: OE2
pdbx validate rmsd bond.auth comp id 1: GLU
pdbx validate rmsd bond.auth comp id 2: GLU
pdbx validate rmsd bond.auth seq id 1: 12
pdbx validate rmsd bond.auth seq id 2: 12
pdbx validate rmsd bond.bond deviation: -0.202
pdbx validate rmsd bond.bond standard deviation: 0.011
pdbx validate rmsd bond.bond target value: 1.252
pdbx validate rmsd bond.bond value: 1.05
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/27
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 27
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: NE
pdbx validate rmsd bond.auth atom id 2: CZ
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 14
pdbx validate rmsd bond.auth seq id 2: 14
pdbx validate rmsd bond.bond deviation: -0.233
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.326
pdbx validate rmsd bond.bond value: 1.093
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/28
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 28
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: NH1
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 14
pdbx validate rmsd bond.auth seq id 2: 14
pdbx validate rmsd bond.bond deviation: -0.619
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.326
pdbx validate rmsd bond.bond value: 0.707
pdbx validate rmsd bond.linker flag: N

http://rdf.wwpdb.org/pdb/1J4M/pdbx_validate_rmsd_bond/29
type: pdbx validate rmsd bond
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
pdbx validate rmsd bond.id: 29
pdbx validate rmsd bond.pdb model num: 1
pdbx validate rmsd bond.auth asym id 1: A
pdbx validate rmsd bond.auth asym id 2: A
pdbx validate rmsd bond.auth atom id 1: CZ
pdbx validate rmsd bond.auth atom id 2: NH2
pdbx validate rmsd bond.auth comp id 1: ARG
pdbx validate rmsd bond.auth comp id 2: ARG
pdbx validate rmsd bond.auth seq id 1: 14
pdbx validate rmsd bond.auth seq id 2: 14
pdbx validate rmsd bond.bond deviation: -0.513
pdbx validate rmsd bond.bond standard deviation: 0.013
pdbx validate rmsd bond.bond target value: 1.326
pdbx validate rmsd bond.bond value: 0.813
pdbx validate rmsd bond.linker flag: N

1J4M
type: struct
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
struct.entry id: 1J4M
struct.title: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)

http://rdf.wwpdb.org/pdb/1J4M/struct_biol/1
type: struct biol
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
struct biol.id: 1

1J4M
type: struct keywords
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entry: 1J4M
struct keywords.entry id: 1J4M
struct keywords.pdbx keywords: DE NOVO PROTEIN
struct keywords.text: beta-hairpin, DE NOVO PROTEIN

http://rdf.wwpdb.org/pdb/1J4M/struct_ref/1
type: struct ref
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to entity: http://rdf.wwpdb.org/pdb/1J4M/entity/1
struct ref.id: 1
struct ref.db code: 1J4M
struct ref.db name: PDB
struct ref.entity id: 1
struct ref.pdbx db accession: 1J4M
referenced by struct ref seq: http://rdf.wwpdb.org/pdb/1J4M/struct_ref_seq/1

http://rdf.wwpdb.org/pdb/1J4M/struct_ref_seq/1
type: struct ref seq
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to struct ref: http://rdf.wwpdb.org/pdb/1J4M/struct_ref/1
struct ref seq.align id: 1
struct ref seq.db align beg: 1
struct ref seq.db align end: 14
struct ref seq.pdbx PDB id code: 1J4M
struct ref seq.pdbx auth seq align beg: 1
struct ref seq.pdbx auth seq align end: 14
struct ref seq.pdbx db accession: 1J4M
struct ref seq.pdbx strand id: A
struct ref seq.ref id: 1
struct ref seq.seq align beg: 1
struct ref seq.seq align end: 14

1,2,A
type: struct sheet order
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to struct sheet: http://rdf.wwpdb.org/pdb/1J4M/struct_sheet/A
struct sheet order.range id 1: 1
struct sheet order.range id 2: 2
struct sheet order.sheet id: A
struct sheet order.sense: anti-parallel

1,A
type: struct sheet range
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to struct sheet: http://rdf.wwpdb.org/pdb/1J4M/struct_sheet/A
struct sheet range.id: 1
struct sheet range.sheet id: A
struct sheet range.beg auth asym id: A
struct sheet range.beg auth comp id: TRP
struct sheet range.beg auth seq id: 4
struct sheet range.beg label asym id: A
struct sheet range.beg label comp id: TRP
struct sheet range.beg label seq id: 4
struct sheet range.end auth asym id: A
struct sheet range.end auth comp id: TYR
struct sheet range.end auth seq id: 6
struct sheet range.end label asym id: A
struct sheet range.end label comp id: TYR
struct sheet range.end label seq id: 6

2,A
type: struct sheet range
of datablock: Minimized average structure of the 14-residue peptide RG-KWTY-NG-ITYE-GR (MBH12)
reference to struct sheet: http://rdf.wwpdb.org/pdb/1J4M/struct_sheet/A
struct sheet range.id: 2
struct sheet range.sheet id: A
struct sheet range.beg auth asym id: A
struct sheet range.beg auth comp id: ILE
struct sheet range.beg auth seq id: 9
struct sheet range.beg label asym id: A
struct sheet range.beg label comp id: ILE
struct sheet range.beg label seq id: 9
struct sheet range.end auth asym id: A
struct sheet range.end auth comp id: TYR
struct sheet range.end auth seq id: 11
struct sheet range.end label asym id: A
struct sheet range.end label comp id: TYR
struct sheet range.end label seq id: 11