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1t29.pdb
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1t29.pdb
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HEADER SIGNALING PROTEIN 20-APR-04 1T29
TITLE CRYSTAL STRUCTURE OF THE BRCA1 BRCT REPEATS BOUND TO A
TITLE 2 PHOSPHORYLATED BACH1 PEPTIDE
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: BREAST CANCER TYPE 1 SUSCEPTIBILITY PROTEIN;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: BRCT REPEATS OF BRCA1 (RESIDUES 1646-1859);
COMPND 5 ENGINEERED: YES;
COMPND 6 MOL_ID: 2;
COMPND 7 MOLECULE: BACH1 PHOSPHORYLATED PEPTIDE;
COMPND 8 CHAIN: B;
COMPND 9 FRAGMENT: RESIDUES 985-998;
COMPND 10 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 3 ORGANISM_COMMON: HUMAN;
SOURCE 4 ORGANISM_TAXID: 9606;
SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);
SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008;
SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET3A;
SOURCE 10 MOL_ID: 2;
SOURCE 11 SYNTHETIC: YES;
SOURCE 12 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE
SOURCE 13 SEQUENCE OF THE PEPTIDE OCCURS NATURALLY IN HUMANS
KEYWDS BRCA1, BRCT REPEATS, BACH1, PHOSPHOPEPTIDE RECOGNITION,
KEYWDS 2 BREAST CANCER, SIGNALING PROTEIN
EXPDTA X-RAY DIFFRACTION
AUTHOR E.N.SHIOZAKI,L.GU,N.YAN,Y.SHI
REVDAT 3 24-FEB-09 1T29 1 VERSN
REVDAT 2 01-MAR-05 1T29 1 JRNL
REVDAT 1 11-MAY-04 1T29 0
JRNL AUTH E.N.SHIOZAKI,L.GU,N.YAN,Y.SHI
JRNL TITL STRUCTURE OF THE BRCT REPEATS OF BRCA1 BOUND TO A
JRNL TITL 2 BACH1 PHOSPHOPEPTIDE: IMPLICATIONS FOR SIGNALING.
JRNL REF MOL.CELL V. 14 405 2004
JRNL REFN ISSN 1097-2765
JRNL PMID 15125843
JRNL DOI 10.1016/S1097-2765(04)00238-2
REMARK 1
REMARK 2
REMARK 2 RESOLUTION. 2.30 ANGSTROMS.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : CNS
REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE-
REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,
REMARK 3 : READ,RICE,SIMONSON,WARREN
REMARK 3
REMARK 3 REFINEMENT TARGET : ENGH & HUBER
REMARK 3
REMARK 3 DATA USED IN REFINEMENT.
REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.30
REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00
REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000
REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL
REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL
REMARK 3 COMPLETENESS (WORKING+TEST) (%) : NULL
REMARK 3 NUMBER OF REFLECTIONS : 11145
REMARK 3
REMARK 3 FIT TO DATA USED IN REFINEMENT.
REMARK 3 CROSS-VALIDATION METHOD : NULL
REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM
REMARK 3 R VALUE (WORKING SET) : 0.252
REMARK 3 FREE R VALUE : 0.266
REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL
REMARK 3 FREE R VALUE TEST SET COUNT : 1106
REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL
REMARK 3
REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
REMARK 3 TOTAL NUMBER OF BINS USED : NULL
REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL
REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL
REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL
REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL
REMARK 3 BIN R VALUE (WORKING SET) : NULL
REMARK 3 BIN FREE R VALUE : NULL
REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL
REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL
REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL
REMARK 3
REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
REMARK 3 PROTEIN ATOMS : 1774
REMARK 3 NUCLEIC ACID ATOMS : 0
REMARK 3 HETEROGEN ATOMS : 0
REMARK 3 SOLVENT ATOMS : 235
REMARK 3
REMARK 3 B VALUES.
REMARK 3 FROM WILSON PLOT (A**2) : NULL
REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL
REMARK 3 OVERALL ANISOTROPIC B VALUE.
REMARK 3 B11 (A**2) : -0.63400
REMARK 3 B22 (A**2) : -0.63400
REMARK 3 B33 (A**2) : 1.26800
REMARK 3 B12 (A**2) : -1.58900
REMARK 3 B13 (A**2) : 0.00000
REMARK 3 B23 (A**2) : 0.00000
REMARK 3
REMARK 3 ESTIMATED COORDINATE ERROR.
REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL
REMARK 3 ESD FROM SIGMAA (A) : NULL
REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL
REMARK 3
REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR.
REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL
REMARK 3 ESD FROM C-V SIGMAA (A) : NULL
REMARK 3
REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES.
REMARK 3 BOND LENGTHS (A) : 0.009
REMARK 3 BOND ANGLES (DEGREES) : 1.69
REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL
REMARK 3 IMPROPER ANGLES (DEGREES) : NULL
REMARK 3
REMARK 3 ISOTROPIC THERMAL MODEL : NULL
REMARK 3
REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA
REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL
REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL
REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL
REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL
REMARK 3
REMARK 3 BULK SOLVENT MODELING.
REMARK 3 METHOD USED : NULL
REMARK 3 KSOL : NULL
REMARK 3 BSOL : NULL
REMARK 3
REMARK 3 NCS MODEL : NULL
REMARK 3
REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT
REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL
REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL
REMARK 3
REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM
REMARK 3 PARAMETER FILE 2 : WATER_REP.PARAM
REMARK 3 PARAMETER FILE 3 : ION.PARAM
REMARK 3 PARAMETER FILE 4 : SEP.PAR
REMARK 3 PARAMETER FILE 5 : NULL
REMARK 3 TOPOLOGY FILE 1 : NULL
REMARK 3 TOPOLOGY FILE 2 : NULL
REMARK 3 TOPOLOGY FILE 3 : NULL
REMARK 3 TOPOLOGY FILE 4 : NULL
REMARK 3 TOPOLOGY FILE 5 : NULL
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1T29 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 21-APR-04.
REMARK 100 THE RCSB ID CODE IS RCSB022220.
REMARK 200
REMARK 200 EXPERIMENTAL DETAILS
REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
REMARK 200 DATE OF DATA COLLECTION : 30-JAN-04
REMARK 200 TEMPERATURE (KELVIN) : 100
REMARK 200 PH : 7.5
REMARK 200 NUMBER OF CRYSTALS USED : 1
REMARK 200
REMARK 200 SYNCHROTRON (Y/N) : Y
REMARK 200 RADIATION SOURCE : NSLS
REMARK 200 BEAMLINE : X25
REMARK 200 X-RAY GENERATOR MODEL : NULL
REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M
REMARK 200 WAVELENGTH OR RANGE (A) : 1.1
REMARK 200 MONOCHROMATOR : GRAPHITE
REMARK 200 OPTICS : NULL
REMARK 200
REMARK 200 DETECTOR TYPE : CCD
REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4
REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO
REMARK 200 DATA SCALING SOFTWARE : SCALEPACK
REMARK 200
REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 11209
REMARK 200 RESOLUTION RANGE HIGH (A) : 2.300
REMARK 200 RESOLUTION RANGE LOW (A) : 99.000
REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000
REMARK 200
REMARK 200 OVERALL.
REMARK 200 COMPLETENESS FOR RANGE (%) : 98.9
REMARK 200 DATA REDUNDANCY : 40.000
REMARK 200 R MERGE (I) : 0.07200
REMARK 200 R SYM (I) : 0.07200
REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL
REMARK 200
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.30
REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.40
REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0
REMARK 200 DATA REDUNDANCY IN SHELL : NULL
REMARK 200 R MERGE FOR SHELL (I) : 0.17900
REMARK 200 R SYM FOR SHELL (I) : NULL
REMARK 200 <I/SIGMA(I)> FOR SHELL : 0.179
REMARK 200
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT
REMARK 200 SOFTWARE USED: AMORE
REMARK 200 STARTING MODEL: PDB ENTRY 1JNX
REMARK 200
REMARK 200 REMARK: NULL
REMARK 280
REMARK 280 CRYSTAL
REMARK 280 SOLVENT CONTENT, VS (%): 48.90
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.43
REMARK 280
REMARK 280 CRYSTALLIZATION CONDITIONS: PEG4000, PH 7.5, VAPOR DIFFUSION,
REMARK 280 HANGING DROP, TEMPERATURE 295K
REMARK 290
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1
REMARK 290
REMARK 290 SYMOP SYMMETRY
REMARK 290 NNNMMM OPERATOR
REMARK 290 1555 X,Y,Z
REMARK 290 2555 -Y,X-Y,Z+2/3
REMARK 290 3555 -X+Y,-X,Z+1/3
REMARK 290 4555 Y,X,-Z
REMARK 290 5555 X-Y,-Y,-Z+1/3
REMARK 290 6555 -X,-X+Y,-Z+2/3
REMARK 290
REMARK 290 WHERE NNN -> OPERATOR NUMBER
REMARK 290 MMM -> TRANSLATION VECTOR
REMARK 290
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
REMARK 290 RELATED MOLECULES.
REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000
REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000
REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 70.35467
REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000
REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000
REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 35.17733
REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000
REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000
REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000
REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000
REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000
REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 35.17733
REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000
REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000
REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 70.35467
REMARK 290
REMARK 290 REMARK: NULL
REMARK 300
REMARK 300 BIOMOLECULE: 1
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
REMARK 300 BURIED SURFACE AREA.
REMARK 350
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
REMARK 350
REMARK 350 BIOMOLECULE: 1
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC
REMARK 350 SOFTWARE USED: PISA
REMARK 350 TOTAL BURIED SURFACE AREA: 1540 ANGSTROM**2
REMARK 350 SURFACE AREA OF THE COMPLEX: 11250 ANGSTROM**2
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -8.0 KCAL/MOL
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B
REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
REMARK 465
REMARK 465 MISSING RESIDUES
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE
REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)
REMARK 465
REMARK 465 M RES C SSSEQI
REMARK 465 VAL A 1646
REMARK 465 ASN A 1647
REMARK 465 LYS A 1648
REMARK 465 THR B 13
REMARK 465 LYS B 14
REMARK 470
REMARK 470 MISSING ATOM
REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER;
REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;
REMARK 470 I=INSERTION CODE):
REMARK 470 M RES CSSEQI ATOMS
REMARK 470 GLU A1682 CG CD OE1 OE2
REMARK 470 GLU A1794 CB CG CD OE1 OE2
REMARK 470 GLU A1817 CG CD OE1 OE2
REMARK 470 ASP A1818 CG OD1 OD2
REMARK 470 ASN A1819 CB CG OD1 ND2
REMARK 470 ALA A1823 CB
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT
REMARK 500
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
REMARK 500
REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE
REMARK 500 O HOH A 94 O HOH A 159 2.07
REMARK 500 O HIS A 1805 O HOH A 71 2.15
REMARK 500 O HOH A 69 O HOH A 182 2.16
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
REMARK 500
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
REMARK 500
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
REMARK 500
REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3
REMARK 500 ASP A1818 N - CA - C ANGL. DEV. = -16.6 DEGREES
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: TORSION ANGLES
REMARK 500
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
REMARK 500
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
REMARK 500
REMARK 500 M RES CSSEQI PSI PHI
REMARK 500 MET A1650 112.27 9.45
REMARK 500 THR A1681 -167.52 -117.95
REMARK 500 ARG A1726 14.33 43.86
REMARK 500 ASN A1774 -0.84 63.85
REMARK 500 PRO A1776 132.04 -38.66
REMARK 500 GLU A1794 112.87 143.80
REMARK 500 PHE A1798 148.77 -39.47
REMARK 500 THR A1802 30.79 -91.31
REMARK 500 GLN A1826 -4.90 -58.09
REMARK 500
REMARK 500 REMARK: NULL
REMARK 525
REMARK 525 SOLVENT
REMARK 525
REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT
REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST
REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT
REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE
REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER;
REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE
REMARK 525 NUMBER; I=INSERTION CODE):
REMARK 525
REMARK 525 M RES CSSEQI
REMARK 525 HOH A 145 DISTANCE = 5.52 ANGSTROMS
REMARK 525 HOH A 148 DISTANCE = 6.80 ANGSTROMS
REMARK 525 HOH A 207 DISTANCE = 7.64 ANGSTROMS
REMARK 525 HOH A 210 DISTANCE = 7.06 ANGSTROMS
REMARK 999
REMARK 999 SEQUENCE
REMARK 999 RESIDUE THR 1816 AND RESIDUE GLU 1817 CHAIN A
REMARK 999 ARE NOT LINKED. DISTANCE OF C-N BOND IS 3.29A.
DBREF 1T29 A 1646 1859 UNP P38398 BRCA1_HUMAN 1646 1859
DBREF 1T29 B 1 14 UNP Q9BX63 BRIP1_HUMAN 985 998
SEQADV 1T29 SEP B 6 UNP Q9BX63 SER 990 MODIFIED RESIDUE
SEQRES 1 A 214 VAL ASN LYS ARG MET SER MET VAL VAL SER GLY LEU THR
SEQRES 2 A 214 PRO GLU GLU PHE MET LEU VAL TYR LYS PHE ALA ARG LYS
SEQRES 3 A 214 HIS HIS ILE THR LEU THR ASN LEU ILE THR GLU GLU THR
SEQRES 4 A 214 THR HIS VAL VAL MET LYS THR ASP ALA GLU PHE VAL CYS
SEQRES 5 A 214 GLU ARG THR LEU LYS TYR PHE LEU GLY ILE ALA GLY GLY
SEQRES 6 A 214 LYS TRP VAL VAL SER TYR PHE TRP VAL THR GLN SER ILE
SEQRES 7 A 214 LYS GLU ARG LYS MET LEU ASN GLU HIS ASP PHE GLU VAL
SEQRES 8 A 214 ARG GLY ASP VAL VAL ASN GLY ARG ASN HIS GLN GLY PRO
SEQRES 9 A 214 LYS ARG ALA ARG GLU SER GLN ASP ARG LYS ILE PHE ARG
SEQRES 10 A 214 GLY LEU GLU ILE CYS CYS TYR GLY PRO PHE THR ASN MET
SEQRES 11 A 214 PRO THR ASP GLN LEU GLU TRP MET VAL GLN LEU CYS GLY
SEQRES 12 A 214 ALA SER VAL VAL LYS GLU LEU SER SER PHE THR LEU GLY
SEQRES 13 A 214 THR GLY VAL HIS PRO ILE VAL VAL VAL GLN PRO ASP ALA
SEQRES 14 A 214 TRP THR GLU ASP ASN GLY PHE HIS ALA ILE GLY GLN MET
SEQRES 15 A 214 CYS GLU ALA PRO VAL VAL THR ARG GLU TRP VAL LEU ASP
SEQRES 16 A 214 SER VAL ALA LEU TYR GLN CYS GLN GLU LEU ASP THR TYR
SEQRES 17 A 214 LEU ILE PRO GLN ILE PRO
SEQRES 1 B 14 ILE SER ARG SER THR SEP PRO THR PHE ASN LYS GLN THR
SEQRES 2 B 14 LYS
MODRES 1T29 SEP B 6 SER PHOSPHOSERINE
HET SEP B 6 10
HETNAM SEP PHOSPHOSERINE
HETSYN SEP PHOSPHONOSERINE
FORMUL 2 SEP C3 H8 N O6 P
FORMUL 3 HOH *235(H2 O)
HELIX 1 1 THR A 1658 HIS A 1673 1 16
HELIX 2 2 THR A 1700 GLY A 1709 1 10
HELIX 3 3 TYR A 1716 GLU A 1725 1 10
HELIX 4 4 ASN A 1730 GLU A 1735 5 6
HELIX 5 5 GLN A 1747 SER A 1755 1 9
HELIX 6 6 PRO A 1776 CYS A 1787 1 12
HELIX 7 7 GLU A 1794 PHE A 1798 5 5
HELIX 8 8 GLN A 1811 TRP A 1815 5 5
HELIX 9 9 ILE A 1824 CYS A 1828 5 5
HELIX 10 10 ARG A 1835 TYR A 1845 1 11
HELIX 11 11 LEU A 1850 LEU A 1854 5 5
SHEET 1 A 4 THR A1675 THR A1677 0
SHEET 2 A 4 SER A1651 SER A1655 1 N MET A1652 O THR A1677
SHEET 3 A 4 HIS A1686 MET A1689 1 O VAL A1688 N VAL A1653
SHEET 4 A 4 TRP A1712 SER A1715 1 O TRP A1712 N VAL A1687
SHEET 1 B 2 VAL A1696 CYS A1697 0
SHEET 2 B 2 GLY A1738 ASP A1739 1 O GLY A1738 N CYS A1697
SHEET 1 C 4 SER A1790 VAL A1791 0
SHEET 2 C 4 LEU A1764 CYS A1768 1 N ILE A1766 O SER A1790
SHEET 3 C 4 HIS A1805 VAL A1810 1 O ILE A1807 N GLU A1765
SHEET 4 C 4 VAL A1832 THR A1834 1 O VAL A1833 N VAL A1808
LINK C THR B 5 N SEP B 6 1555 1555 1.33
LINK C SEP B 6 N PRO B 7 1555 1555 1.34
CRYST1 63.177 63.177 105.532 90.00 90.00 120.00 P 32 2 1 6
ORIGX1 1.000000 0.000000 0.000000 0.00000
ORIGX2 0.000000 1.000000 0.000000 0.00000
ORIGX3 0.000000 0.000000 1.000000 0.00000
SCALE1 0.015829 0.009139 0.000000 0.00000
SCALE2 0.000000 0.018277 0.000000 0.00000
SCALE3 0.000000 0.000000 0.009476 0.00000
ATOM 1 N ARG A1649 49.339 31.175 26.106 1.00 66.83 N
ATOM 2 CA ARG A1649 49.654 30.257 24.970 1.00 62.37 C
ATOM 3 C ARG A1649 49.935 28.836 25.513 1.00 58.85 C
ATOM 4 O ARG A1649 49.986 28.624 26.711 1.00 59.56 O
ATOM 5 CB ARG A1649 50.858 30.763 24.208 1.00118.43 C
ATOM 6 CG ARG A1649 51.115 30.007 22.925 1.00 67.34 C
ATOM 7 CD ARG A1649 52.565 30.173 22.534 1.00 67.34 C
ATOM 8 NE ARG A1649 53.227 28.903 22.230 1.00 67.34 N
ATOM 9 CZ ARG A1649 54.125 28.298 23.010 1.00 67.34 C
ATOM 10 NH1 ARG A1649 54.491 28.840 24.166 1.00 67.34 N
ATOM 11 NH2 ARG A1649 54.656 27.141 22.631 1.00 67.34 N
ATOM 12 N MET A1650 50.035 27.872 24.602 1.00 55.14 N
ATOM 13 CA MET A1650 50.250 26.446 24.877 1.00 50.53 C
ATOM 14 C MET A1650 50.158 25.951 26.321 1.00 47.44 C
ATOM 15 O MET A1650 51.017 26.237 27.161 1.00 46.41 O
ATOM 16 CB MET A1650 51.582 26.011 24.277 1.00 51.36 C
ATOM 17 CG MET A1650 51.541 26.105 22.766 1.00 51.58 C
ATOM 18 SD MET A1650 52.838 25.288 21.854 1.00 51.14 S
ATOM 19 CE MET A1650 51.989 25.161 20.211 1.00 53.77 C
ATOM 20 N SER A1651 49.122 25.154 26.569 1.00 42.51 N
ATOM 21 CA SER A1651 48.840 24.562 27.872 1.00 39.05 C
ATOM 22 C SER A1651 48.302 23.140 27.654 1.00 36.77 C
ATOM 23 O SER A1651 47.174 22.950 27.197 1.00 35.50 O
ATOM 24 CB SER A1651 47.802 25.404 28.597 1.00 38.54 C
ATOM 25 OG SER A1651 47.648 24.941 29.923 1.00 38.99 O
ATOM 26 N MET A1652 49.131 22.161 28.000 1.00 45.69 N
ATOM 27 CA MET A1652 48.831 20.744 27.840 1.00 43.74 C
ATOM 28 C MET A1652 48.079 20.019 28.949 1.00 42.03 C
ATOM 29 O MET A1652 48.070 20.411 30.121 1.00 39.78 O
ATOM 30 CB MET A1652 50.122 19.963 27.625 1.00 66.29 C
ATOM 31 CG MET A1652 50.697 19.986 26.249 1.00 70.01 C
ATOM 32 SD MET A1652 51.803 18.584 26.211 1.00 75.17 S
ATOM 33 CE MET A1652 53.143 19.293 25.480 1.00 73.58 C
ATOM 34 N VAL A1653 47.476 18.918 28.530 1.00 33.62 N
ATOM 35 CA VAL A1653 46.753 18.014 29.397 1.00 32.33 C
ATOM 36 C VAL A1653 47.056 16.653 28.772 1.00 31.44 C
ATOM 37 O VAL A1653 47.306 16.565 27.569 1.00 31.29 O
ATOM 38 CB VAL A1653 45.247 18.350 29.407 1.00 51.42 C
ATOM 39 CG1 VAL A1653 44.431 17.215 28.823 1.00 52.08 C
ATOM 40 CG2 VAL A1653 44.817 18.665 30.832 1.00 51.22 C
ATOM 41 N VAL A1654 47.079 15.606 29.586 1.00 34.98 N
ATOM 42 CA VAL A1654 47.379 14.253 29.103 1.00 37.03 C
ATOM 43 C VAL A1654 46.251 13.274 29.455 1.00 34.19 C
ATOM 44 O VAL A1654 45.568 13.453 30.459 1.00 33.07 O
ATOM 45 CB VAL A1654 48.716 13.750 29.708 1.00 69.54 C
ATOM 46 CG1 VAL A1654 48.684 12.244 29.901 1.00 72.68 C
ATOM 47 CG2 VAL A1654 49.868 14.135 28.791 1.00 70.71 C
ATOM 48 N SER A1655 46.068 12.244 28.629 1.00 36.02 N
ATOM 49 CA SER A1655 45.012 11.256 28.852 1.00 32.94 C
ATOM 50 C SER A1655 45.422 9.869 28.344 1.00 32.56 C
ATOM 51 O SER A1655 45.838 9.719 27.194 1.00 30.05 O
ATOM 52 CB SER A1655 43.728 11.719 28.147 1.00 30.11 C
ATOM 53 OG SER A1655 42.633 10.858 28.404 1.00 34.51 O
ATOM 54 N GLY A1656 45.315 8.858 29.209 1.00 28.57 N
ATOM 55 CA GLY A1656 45.671 7.501 28.818 1.00 27.41 C
ATOM 56 C GLY A1656 47.153 7.189 28.925 1.00 30.10 C
ATOM 57 O GLY A1656 47.613 6.114 28.528 1.00 29.15 O
ATOM 58 N LEU A1657 47.919 8.134 29.453 1.00 37.42 N
ATOM 59 CA LEU A1657 49.347 7.916 29.595 1.00 40.14 C
ATOM 60 C LEU A1657 49.700 7.371 30.966 1.00 41.06 C
ATOM 61 O LEU A1657 49.097 7.737 31.980 1.00 41.26 O
ATOM 62 CB LEU A1657 50.135 9.218 29.398 1.00 41.00 C
ATOM 63 CG LEU A1657 50.145 9.950 28.054 1.00 42.29 C
ATOM 64 CD1 LEU A1657 51.172 11.080 28.143 1.00 40.55 C
ATOM 65 CD2 LEU A1657 50.505 9.005 26.919 1.00 42.88 C
ATOM 66 N THR A1658 50.688 6.492 30.989 1.00 36.39 N
ATOM 67 CA THR A1658 51.184 5.943 32.242 1.00 39.40 C
ATOM 68 C THR A1658 52.040 7.078 32.836 1.00 40.54 C
ATOM 69 O THR A1658 52.337 8.060 32.146 1.00 39.49 O
ATOM 70 CB THR A1658 52.103 4.755 31.978 1.00 42.18 C
ATOM 71 OG1 THR A1658 53.305 5.225 31.360 1.00 44.71 O
ATOM 72 CG2 THR A1658 51.446 3.769 31.045 1.00 42.68 C
ATOM 73 N PRO A1659 52.434 6.974 34.117 1.00 62.44 N
ATOM 74 CA PRO A1659 53.259 8.047 34.690 1.00 64.38 C
ATOM 75 C PRO A1659 54.518 8.230 33.839 1.00 64.37 C
ATOM 76 O PRO A1659 55.002 9.349 33.647 1.00 64.95 O
ATOM 77 CB PRO A1659 53.572 7.525 36.088 1.00 66.20 C
ATOM 78 CG PRO A1659 52.325 6.769 36.434 1.00 65.49 C
ATOM 79 CD PRO A1659 52.039 6.004 35.154 1.00 66.79 C
ATOM 80 N GLU A1660 55.021 7.107 33.330 1.00 48.90 N
ATOM 81 CA GLU A1660 56.202 7.060 32.475 1.00 48.39 C
ATOM 82 C GLU A1660 56.047 7.970 31.253 1.00 48.97 C
ATOM 83 O GLU A1660 56.849 8.874 31.034 1.00 49.47 O
ATOM 84 CB GLU A1660 56.439 5.607 32.041 1.00 64.34 C
ATOM 85 CG GLU A1660 56.948 5.399 30.617 1.00 67.83 C
ATOM 86 CD GLU A1660 58.350 5.926 30.400 1.00 69.66 C
ATOM 87 OE1 GLU A1660 58.518 7.157 30.294 1.00 72.08 O
ATOM 88 OE2 GLU A1660 59.291 5.106 30.338 1.00 71.78 O
ATOM 89 N GLU A1661 55.007 7.739 30.461 1.00 40.51 N
ATOM 90 CA GLU A1661 54.782 8.547 29.274 1.00 40.10 C
ATOM 91 C GLU A1661 54.560 9.999 29.674 1.00 40.79 C
ATOM 92 O GLU A1661 54.942 10.910 28.941 1.00 42.13 O
ATOM 93 CB GLU A1661 53.570 8.009 28.500 1.00 43.81 C
ATOM 94 CG GLU A1661 53.692 6.534 28.138 1.00 42.37 C
ATOM 95 CD GLU A1661 52.380 5.917 27.675 1.00 43.46 C
ATOM 96 OE1 GLU A1661 51.351 6.126 28.355 1.00 45.02 O
ATOM 97 OE2 GLU A1661 52.380 5.212 26.642 1.00 37.86 O
ATOM 98 N PHE A1662 53.958 10.218 30.839 1.00 43.01 N
ATOM 99 CA PHE A1662 53.706 11.580 31.296 1.00 46.29 C
ATOM 100 C PHE A1662 55.013 12.363 31.420 1.00 47.22 C
ATOM 101 O PHE A1662 55.029 13.576 31.222 1.00 47.70 O
ATOM 102 CB PHE A1662 52.975 11.594 32.648 1.00 43.76 C
ATOM 103 CG PHE A1662 52.692 12.982 33.165 1.00 44.89 C
ATOM 104 CD1 PHE A1662 51.743 13.791 32.543 1.00 45.17 C
ATOM 105 CD2 PHE A1662 53.420 13.505 34.232 1.00 43.65 C
ATOM 106 CE1 PHE A1662 51.522 15.108 32.972 1.00 47.42 C
ATOM 107 CE2 PHE A1662 53.212 14.817 34.670 1.00 46.36 C
ATOM 108 CZ PHE A1662 52.261 15.624 34.038 1.00 47.10 C
ATOM 109 N MET A1663 56.105 11.676 31.742 1.00 52.82 N
ATOM 110 CA MET A1663 57.386 12.362 31.892 1.00 55.04 C
ATOM 111 C MET A1663 57.974 12.771 30.545 1.00 54.26 C
ATOM 112 O MET A1663 58.522 13.864 30.416 1.00 56.58 O
ATOM 113 CB MET A1663 58.390 11.500 32.672 1.00 70.85 C
ATOM 114 CG MET A1663 58.857 10.242 31.967 1.00 72.03 C
ATOM 115 SD MET A1663 60.115 9.343 32.909 1.00 79.66 S
ATOM 116 CE MET A1663 59.111 8.404 34.076 1.00 72.72 C
ATOM 117 N LEU A1664 57.866 11.899 29.546 1.00 45.87 N
ATOM 118 CA LEU A1664 58.373 12.229 28.223 1.00 44.38 C
ATOM 119 C LEU A1664 57.670 13.499 27.791 1.00 43.17 C
ATOM 120 O LEU A1664 58.239 14.337 27.095 1.00 44.50 O
ATOM 121 CB LEU A1664 58.092 11.102 27.231 1.00 53.56 C
ATOM 122 CG LEU A1664 59.157 10.002 27.188 1.00 54.52 C
ATOM 123 CD1 LEU A1664 58.741 8.895 26.233 1.00 55.21 C
ATOM 124 CD2 LEU A1664 60.483 10.608 26.749 1.00 54.77 C
ATOM 125 N VAL A1665 56.423 13.645 28.220 1.00 43.56 N
ATOM 126 CA VAL A1665 55.663 14.837 27.891 1.00 40.96 C
ATOM 127 C VAL A1665 56.202 15.988 28.736 1.00 39.56 C
ATOM 128 O VAL A1665 56.412 17.084 28.223 1.00 39.28 O
ATOM 129 CB VAL A1665 54.158 14.652 28.172 1.00 36.77 C
ATOM 130 CG1 VAL A1665 53.410 15.942 27.873 1.00 35.60 C
ATOM 131 CG2 VAL A1665 53.605 13.527 27.319 1.00 36.81 C
ATOM 132 N TYR A1666 56.428 15.741 30.025 1.00 35.80 N
ATOM 133 CA TYR A1666 56.956 16.781 30.914 1.00 34.49 C
ATOM 134 C TYR A1666 58.305 17.252 30.367 1.00 32.02 C
ATOM 135 O TYR A1666 58.581 18.448 30.334 1.00 31.67 O
ATOM 136 CB TYR A1666 57.148 16.240 32.339 1.00 46.61 C
ATOM 137 CG TYR A1666 57.653 17.260 33.350 1.00 46.75 C
ATOM 138 CD1 TYR A1666 56.829 18.288 33.807 1.00 48.58 C
ATOM 139 CD2 TYR A1666 58.947 17.177 33.874 1.00 50.19 C
ATOM 140 CE1 TYR A1666 57.271 19.199 34.764 1.00 48.38 C
ATOM 141 CE2 TYR A1666 59.401 18.090 34.834 1.00 48.97 C
ATOM 142 CZ TYR A1666 58.553 19.096 35.273 1.00 50.50 C
ATOM 143 OH TYR A1666 58.972 19.993 36.229 1.00 51.60 O
ATOM 144 N LYS A1667 59.129 16.299 29.939 1.00 34.29 N
ATOM 145 CA LYS A1667 60.445 16.596 29.379 1.00 34.48 C
ATOM 146 C LYS A1667 60.270 17.407 28.103 1.00 35.20 C
ATOM 147 O LYS A1667 61.061 18.301 27.794 1.00 36.33 O
ATOM 148 CB LYS A1667 61.190 15.295 29.091 1.00 42.93 C
ATOM 149 CG LYS A1667 62.642 15.484 28.686 1.00 44.18 C
ATOM 150 CD LYS A1667 63.440 14.225 28.965 1.00 45.70 C
ATOM 151 CE LYS A1667 64.922 14.436 28.705 1.00 46.37 C
ATOM 152 NZ LYS A1667 65.724 13.279 29.190 1.00 44.70 N
ATOM 153 N PHE A1668 59.201 17.100 27.380 1.00 37.04 N
ATOM 154 CA PHE A1668 58.861 17.786 26.141 1.00 37.55 C
ATOM 155 C PHE A1668 58.266 19.170 26.435 1.00 36.37 C
ATOM 156 O PHE A1668 58.575 20.144 25.754 1.00 36.21 O
ATOM 157 CB PHE A1668 57.858 16.924 25.361 1.00 39.92 C
ATOM 158 CG PHE A1668 57.170 17.638 24.226 1.00 38.58 C
ATOM 159 CD1 PHE A1668 57.774 17.749 22.980 1.00 38.13 C
ATOM 160 CD2 PHE A1668 55.898 18.167 24.398 1.00 37.67 C
ATOM 161 CE1 PHE A1668 57.111 18.371 21.920 1.00 39.05 C
ATOM 162 CE2 PHE A1668 55.229 18.792 23.340 1.00 39.35 C
ATOM 163 CZ PHE A1668 55.836 18.893 22.102 1.00 39.93 C
ATOM 164 N ALA A1669 57.413 19.244 27.451 1.00 32.19 N
ATOM 165 CA ALA A1669 56.774 20.494 27.840 1.00 34.16 C
ATOM 166 C ALA A1669 57.812 21.442 28.440 1.00 34.41 C
ATOM 167 O ALA A1669 57.725 22.654 28.260 1.00 32.84 O
ATOM 168 CB ALA A1669 55.668 20.226 28.852 1.00 53.09 C
ATOM 169 N ARG A1670 58.778 20.864 29.150 1.00 38.13 N
ATOM 170 CA ARG A1670 59.862 21.604 29.799 1.00 42.09 C
ATOM 171 C ARG A1670 60.657 22.350 28.739 1.00 43.05 C
ATOM 172 O ARG A1670 60.719 23.578 28.732 1.00 44.66 O
ATOM 173 CB ARG A1670 60.778 20.616 30.535 1.00 54.82 C
ATOM 174 CG ARG A1670 61.715 21.221 31.572 1.00 56.27 C
ATOM 175 CD ARG A1670 62.376 20.108 32.379 1.00 57.34 C
ATOM 176 NE ARG A1670 62.858 20.563 33.682 1.00 58.91 N
ATOM 177 CZ ARG A1670 63.961 21.282 33.871 1.00 59.73 C
ATOM 178 NH1 ARG A1670 64.309 21.651 35.094 1.00 56.55 N
ATOM 179 NH2 ARG A1670 64.724 21.621 32.840 1.00 60.95 N
ATOM 180 N LYS A1671 61.259 21.585 27.839 1.00 45.60 N
ATOM 181 CA LYS A1671 62.061 22.122 26.751 1.00 45.31 C
ATOM 182 C LYS A1671 61.340 23.255 26.017 1.00 47.14 C
ATOM 183 O LYS A1671 61.812 24.392 25.985 1.00 47.53 O
ATOM 184 CB LYS A1671 62.382 20.985 25.778 1.00 42.56 C
ATOM 185 CG LYS A1671 63.348 21.306 24.656 1.00 43.26 C
ATOM 186 CD LYS A1671 63.498 20.093 23.744 1.00 45.06 C
ATOM 187 CE LYS A1671 64.502 20.321 22.624 1.00 46.55 C
ATOM 188 NZ LYS A1671 65.888 20.546 23.144 1.00 49.62 N
ATOM 189 N HIS A1672 60.177 22.945 25.456 1.00 48.15 N
ATOM 190 CA HIS A1672 59.411 23.918 24.685 1.00 50.11 C
ATOM 191 C HIS A1672 58.608 24.947 25.472 1.00 50.81 C
ATOM 192 O HIS A1672 57.910 25.769 24.884 1.00 49.93 O
ATOM 193 CB HIS A1672 58.515 23.163 23.701 1.00 43.89 C
ATOM 194 CG HIS A1672 59.282 22.265 22.778 1.00 43.39 C
ATOM 195 ND1 HIS A1672 60.171 22.746 21.844 1.00 43.46 N
ATOM 196 CD2 HIS A1672 59.332 20.914 22.680 1.00 43.99 C
ATOM 197 CE1 HIS A1672 60.738 21.735 21.210 1.00 43.84 C
ATOM 198 NE2 HIS A1672 60.246 20.612 21.700 1.00 43.62 N
ATOM 199 N HIS A1673 58.719 24.909 26.795 1.00 86.27 N
ATOM 200 CA HIS A1673 58.014 25.853 27.659 1.00 88.10 C
ATOM 201 C HIS A1673 56.500 25.826 27.517 1.00 87.89 C
ATOM 202 O HIS A1673 55.862 26.867 27.353 1.00 89.67 O
ATOM 203 CB HIS A1673 58.523 27.271 27.403 1.00 86.67 C
ATOM 204 CG HIS A1673 59.894 27.520 27.943 1.00 89.24 C
ATOM 205 ND1 HIS A1673 60.146 27.680 29.290 1.00 88.04 N
ATOM 206 CD2 HIS A1673 61.096 27.602 27.325 1.00 88.98 C
ATOM 207 CE1 HIS A1673 61.441 27.850 29.476 1.00 87.73 C
ATOM 208 NE2 HIS A1673 62.041 27.806 28.299 1.00 88.65 N
ATOM 209 N ILE A1674 55.927 24.631 27.587 1.00 38.81 N
ATOM 210 CA ILE A1674 54.487 24.472 27.484 1.00 38.41 C
ATOM 211 C ILE A1674 53.970 24.260 28.898 1.00 38.50 C
ATOM 212 O ILE A1674 54.637 23.617 29.715 1.00 38.31 O
ATOM 213 CB ILE A1674 54.120 23.236 26.633 1.00 57.41 C
ATOM 214 CG1 ILE A1674 54.816 23.317 25.275 1.00 55.82 C
ATOM 215 CG2 ILE A1674 52.610 23.157 26.453 1.00 56.24 C
ATOM 216 CD1 ILE A1674 54.721 22.056 24.455 1.00 55.70 C
ATOM 217 N THR A1675 52.796 24.803 29.196 1.00 54.50 N
ATOM 218 CA THR A1675 52.221 24.645 30.528 1.00 54.83 C
ATOM 219 C THR A1675 51.523 23.285 30.638 1.00 54.01 C
ATOM 220 O THR A1675 50.361 23.153 30.265 1.00 54.98 O
ATOM 221 CB THR A1675 51.200 25.762 30.828 1.00 41.81 C
ATOM 222 OG1 THR A1675 51.838 27.042 30.699 1.00 39.40 O
ATOM 223 CG2 THR A1675 50.643 25.604 32.237 1.00 41.93 C
ATOM 224 N LEU A1676 52.237 22.282 31.144 1.00 42.83 N
ATOM 225 CA LEU A1676 51.688 20.931 31.291 1.00 42.61 C
ATOM 226 C LEU A1676 51.071 20.686 32.663 1.00 42.58 C
ATOM 227 O LEU A1676 51.680 21.005 33.683 1.00 44.07 O
ATOM 228 CB LEU A1676 52.780 19.894 31.052 1.00 42.06 C
ATOM 229 CG LEU A1676 52.373 18.445 31.301 1.00 42.06 C
ATOM 230 CD1 LEU A1676 51.226 18.082 30.376 1.00 43.95 C
ATOM 231 CD2 LEU A1676 53.559 17.529 31.057 1.00 45.00 C
ATOM 232 N THR A1677 49.881 20.091 32.692 1.00 46.42 N
ATOM 233 CA THR A1677 49.199 19.827 33.961 1.00 47.20 C
ATOM 234 C THR A1677 48.223 18.644 33.913 1.00 45.61 C
ATOM 235 O THR A1677 48.018 18.039 32.865 1.00 44.08 O
ATOM 236 CB THR A1677 48.442 21.099 34.443 1.00 68.53 C
ATOM 237 OG1 THR A1677 47.818 20.846 35.708 1.00 71.33 O
ATOM 238 CG2 THR A1677 47.388 21.507 33.430 1.00 67.12 C
ATOM 239 N ASN A1678 47.621 18.335 35.061 1.00 50.18 N
ATOM 240 CA ASN A1678 46.685 17.220 35.197 1.00 49.33 C
ATOM 241 C ASN A1678 45.230 17.553 34.900 1.00 48.96 C
ATOM 242 O ASN A1678 44.507 16.744 34.316 1.00 47.29 O
ATOM 243 CB ASN A1678 46.749 16.656 36.617 1.00 44.32 C
ATOM 244 CG ASN A1678 47.760 17.378 37.482 1.00 43.01 C
ATOM 245 OD1 ASN A1678 48.952 17.096 37.416 1.00 46.15 O
ATOM 246 ND2 ASN A1678 47.292 18.325 38.287 1.00 40.75 N
ATOM 247 N LEU A1679 44.796 18.733 35.328 1.00 45.32 N
ATOM 248 CA LEU A1679 43.413 19.153 35.134 1.00 45.81 C
ATOM 249 C LEU A1679 43.228 19.922 33.831 1.00 45.62 C
ATOM 250 O LEU A1679 44.051 20.772 33.478 1.00 44.76 O
ATOM 251 CB LEU A1679 42.967 20.022 36.314 1.00100.17 C
ATOM 252 CG LEU A1679 43.402 19.556 37.708 1.00102.31 C
ATOM 253 CD1 LEU A1679 42.753 20.435 38.762 1.00102.01 C
ATOM 254 CD2 LEU A1679 43.014 18.104 37.921 1.00102.88 C
ATOM 255 N ILE A1680 42.149 19.616 33.116 1.00 46.54 N
ATOM 256 CA ILE A1680 41.860 20.289 31.857 1.00 46.30 C
ATOM 257 C ILE A1680 41.023 21.528 32.136 1.00 46.12 C
ATOM 258 O ILE A1680 39.938 21.429 32.697 1.00 45.16 O
ATOM 259 CB ILE A1680 41.110 19.359 30.878 1.00 52.34 C
ATOM 260 CG1 ILE A1680 40.579 20.173 29.700 1.00 51.66 C
ATOM 261 CG2 ILE A1680 39.996 18.632 31.600 1.00 52.90 C
ATOM 262 CD1 ILE A1680 40.517 19.406 28.413 1.00 27.53 C
ATOM 263 N THR A1681 41.531 22.693 31.741 1.00 46.85 N
ATOM 264 CA THR A1681 40.828 23.953 31.984 1.00 47.56 C
ATOM 265 C THR A1681 40.435 24.700 30.716 1.00 49.69 C
ATOM 266 O THR A1681 40.498 24.160 29.612 1.00 50.34 O
ATOM 267 CB THR A1681 41.684 24.912 32.854 1.00 39.14 C
ATOM 268 OG1 THR A1681 42.887 25.259 32.150 1.00 33.75 O
ATOM 269 CG2 THR A1681 42.042 24.247 34.178 1.00 38.81 C
ATOM 270 N GLU A1682 40.031 25.955 30.879 1.00 48.46 N
ATOM 271 CA GLU A1682 39.635 26.759 29.737 1.00 49.71 C
ATOM 272 C GLU A1682 40.868 27.303 29.018 1.00 49.20 C
ATOM 273 O GLU A1682 40.802 27.623 27.834 1.00 49.65 O
ATOM 274 CB GLU A1682 38.732 27.902 30.187 1.00 53.77 C
ATOM 275 N GLU A1683 41.988 27.403 29.734 1.00 42.78 N
ATOM 276 CA GLU A1683 43.233 27.906 29.145 1.00 41.09 C
ATOM 277 C GLU A1683 44.001 26.807 28.412 1.00 38.58 C
ATOM 278 O GLU A1683 44.999 27.076 27.748 1.00 35.99 O
ATOM 279 CB GLU A1683 44.161 28.497 30.212 1.00 69.05 C
ATOM 280 CG GLU A1683 43.562 29.572 31.091 1.00 73.21 C
ATOM 281 CD GLU A1683 43.053 29.017 32.406 1.00 75.32 C
ATOM 282 OE1 GLU A1683 42.009 28.333 32.402 1.00 76.80 O
ATOM 283 OE2 GLU A1683 43.707 29.258 33.444 1.00 78.05 O
ATOM 284 N THR A1684 43.557 25.565 28.558 1.00 36.39 N
ATOM 285 CA THR A1684 44.233 24.470 27.890 1.00 34.57 C
ATOM 286 C THR A1684 44.039 24.612 26.391 1.00 29.85 C
ATOM 287 O THR A1684 42.944 24.913 25.909 1.00 30.27 O
ATOM 288 CB THR A1684 43.688 23.095 28.348 1.00 48.14 C
ATOM 289 OG1 THR A1684 43.978 22.899 29.738 1.00 49.92 O
ATOM 290 CG2 THR A1684 44.339 21.979 27.556 1.00 50.45 C
ATOM 291 N THR A1685 45.114 24.394 25.657 1.00 30.01 N
ATOM 292 CA THR A1685 45.065 24.491 24.215 1.00 30.52 C
ATOM 293 C THR A1685 45.218 23.118 23.554 1.00 28.91 C
ATOM 294 O THR A1685 44.737 22.925 22.445 1.00 25.72 O
ATOM 295 CB THR A1685 46.173 25.417 23.708 1.00 35.39 C
ATOM 296 OG1 THR A1685 47.435 24.983 24.234 1.00 35.38 O
ATOM 297 CG2 THR A1685 45.897 26.856 24.156 1.00 37.95 C
ATOM 298 N HIS A1686 45.881 22.184 24.243 1.00 30.30 N
ATOM 299 CA HIS A1686 46.121 20.831 23.728 1.00 32.58 C
ATOM 300 C HIS A1686 45.760 19.704 24.693 1.00 32.18 C
ATOM 301 O HIS A1686 46.025 19.789 25.897 1.00 31.00 O
ATOM 302 CB HIS A1686 47.600 20.632 23.381 1.00 41.29 C
ATOM 303 CG HIS A1686 48.128 21.593 22.368 1.00 44.06 C
ATOM 304 ND1 HIS A1686 47.909 22.950 22.448 1.00 44.65 N
ATOM 305 CD2 HIS A1686 48.904 21.399 21.276 1.00 44.49 C
ATOM 306 CE1 HIS A1686 48.528 23.552 21.449 1.00 43.71 C
ATOM 307 NE2 HIS A1686 49.139 22.634 20.724 1.00 42.69 N
ATOM 308 N VAL A1687 45.160 18.650 24.136 1.00 27.50 N
ATOM 309 CA VAL A1687 44.806 17.439 24.875 1.00 26.73 C
ATOM 310 C VAL A1687 45.611 16.343 24.189 1.00 25.08 C
ATOM 311 O VAL A1687 45.367 16.019 23.017 1.00 25.52 O
ATOM 312 CB VAL A1687 43.309 17.113 24.768 1.00 25.57 C
ATOM 313 CG1 VAL A1687 43.046 15.683 25.301 1.00 30.26 C
ATOM 314 CG2 VAL A1687 42.506 18.129 25.567 1.00 24.66 C
ATOM 315 N VAL A1688 46.609 15.808 24.882 1.00 34.72 N
ATOM 316 CA VAL A1688 47.436 14.768 24.293 1.00 31.85 C
ATOM 317 C VAL A1688 46.875 13.403 24.666 1.00 34.35 C
ATOM 318 O VAL A1688 46.858 13.019 25.833 1.00 33.11 O
ATOM 319 CB VAL A1688 48.898 14.864 24.760 1.00 24.48 C
ATOM 320 CG1 VAL A1688 49.728 13.823 24.014 1.00 21.66 C
ATOM 321 CG2 VAL A1688 49.450 16.288 24.530 1.00 25.16 C
ATOM 322 N MET A1689 46.426 12.673 23.651 1.00 31.90 N
ATOM 323 CA MET A1689 45.818 11.367 23.846 1.00 30.01 C
ATOM 324 C MET A1689 46.715 10.186 23.513 1.00 28.79 C
ATOM 325 O MET A1689 47.440 10.201 22.529 1.00 25.22 O
ATOM 326 CB MET A1689 44.571 11.252 22.969 1.00 29.36 C
ATOM 327 CG MET A1689 43.545 12.350 23.154 1.00 28.28 C
ATOM 328 SD MET A1689 42.620 12.240 24.686 1.00 26.94 S
ATOM 329 CE MET A1689 42.258 10.408 24.776 1.00 25.44 C
ATOM 330 N LYS A1690 46.665 9.155 24.349 1.00 21.69 N
ATOM 331 CA LYS A1690 47.402 7.941 24.050 1.00 22.83 C
ATOM 332 C LYS A1690 46.593 7.366 22.876 1.00 21.23 C
ATOM 333 O LYS A1690 45.362 7.341 22.934 1.00 22.13 O
ATOM 334 CB LYS A1690 47.339 6.974 25.237 1.00 24.20 C
ATOM 335 CG LYS A1690 47.906 5.593 24.947 1.00 25.53 C
ATOM 336 CD LYS A1690 49.405 5.622 24.725 1.00 32.97 C
ATOM 337 CE LYS A1690 49.959 4.205 24.662 1.00 35.94 C
ATOM 338 NZ LYS A1690 51.423 4.186 24.387 1.00 40.19 N
ATOM 339 N THR A1691 47.262 6.942 21.807 1.00 30.81 N
ATOM 340 CA THR A1691 46.557 6.369 20.654 1.00 31.07 C
ATOM 341 C THR A1691 47.330 5.199 20.093 1.00 32.45 C
ATOM 342 O THR A1691 48.439 4.902 20.545 1.00 33.36 O
ATOM 343 CB THR A1691 46.413 7.361 19.468 1.00 19.97 C
ATOM 344 OG1 THR A1691 47.703 7.600 18.879 1.00 17.60 O
ATOM 345 CG2 THR A1691 45.785 8.674 19.927 1.00 18.97 C
ATOM 346 N ASP A1692 46.740 4.535 19.106 1.00 24.19 N
ATOM 347 CA ASP A1692 47.442 3.450 18.453 1.00 27.73 C
ATOM 348 C ASP A1692 48.169 4.111 17.284 1.00 27.66 C
ATOM 349 O ASP A1692 48.063 5.325 17.085 1.00 26.97 O
ATOM 350 CB ASP A1692 46.479 2.347 17.971 1.00 28.26 C
ATOM 351 CG ASP A1692 45.477 2.832 16.931 1.00 29.75 C
ATOM 352 OD1 ASP A1692 45.644 3.948 16.389 1.00 26.14 O
ATOM 353 OD2 ASP A1692 44.515 2.076 16.650 1.00 27.64 O
ATOM 354 N ALA A1693 48.901 3.323 16.512 1.00 36.88 N
ATOM 355 CA ALA A1693 49.661 3.846 15.385 1.00 35.88 C
ATOM 356 C ALA A1693 48.815 4.588 14.359 1.00 36.40 C
ATOM 357 O ALA A1693 49.333 5.354 13.545 1.00 35.47 O
ATOM 358 CB ALA A1693 50.397 2.722 14.717 1.00 24.30 C
ATOM 359 N GLU A1694 47.509 4.369 14.397 1.00 33.77 N
ATOM 360 CA GLU A1694 46.637 5.021 13.437 1.00 32.87 C
ATOM 361 C GLU A1694 45.909 6.223 14.036 1.00 30.67 C
ATOM 362 O GLU A1694 44.946 6.723 13.464 1.00 32.29 O
ATOM 363 CB GLU A1694 45.659 3.990 12.855 1.00 39.44 C
ATOM 364 CG GLU A1694 46.377 2.757 12.300 1.00 43.30 C
ATOM 365 CD GLU A1694 45.479 1.830 11.486 1.00 45.43 C
ATOM 366 OE1 GLU A1694 44.336 1.562 11.907 1.00 46.50 O
ATOM 367 OE2 GLU A1694 45.929 1.350 10.421 1.00 49.85 O
ATOM 368 N PHE A1695 46.383 6.678 15.195 1.00 27.03 N
ATOM 369 CA PHE A1695 45.820 7.843 15.876 1.00 25.87 C
ATOM 370 C PHE A1695 44.384 7.673 16.365 1.00 25.68 C
ATOM 371 O PHE A1695 43.598 8.622 16.349 1.00 24.76 O
ATOM 372 CB PHE A1695 45.922 9.077 14.964 1.00 28.14 C
ATOM 373 CG PHE A1695 47.331 9.429 14.571 1.00 29.44 C
ATOM 374 CD1 PHE A1695 47.577 10.238 13.459 1.00 30.91 C
ATOM 375 CD2 PHE A1695 48.413 8.954 15.301 1.00 28.75 C
ATOM 376 CE1 PHE A1695 48.880 10.565 13.084 1.00 31.86 C
ATOM 377 CE2 PHE A1695 49.732 9.277 14.931 1.00 33.68 C
ATOM 378 CZ PHE A1695 49.961 10.083 13.817 1.00 30.21 C
ATOM 379 N VAL A1696 44.039 6.466 16.801 1.00 20.14 N
ATOM 380 CA VAL A1696 42.702 6.213 17.334 1.00 18.29 C
ATOM 381 C VAL A1696 42.861 6.106 18.847 1.00 17.67 C
ATOM 382 O VAL A1696 43.768 5.437 19.349 1.00 16.17 O
ATOM 383 CB VAL A1696 42.096 4.901 16.776 1.00 26.32 C
ATOM 384 CG1 VAL A1696 40.723 4.652 17.381 1.00 24.27 C
ATOM 385 CG2 VAL A1696 42.011 4.977 15.262 1.00 29.62 C
ATOM 386 N CYS A1697 41.980 6.757 19.591 1.00 18.84 N
ATOM 387 CA CYS A1697 42.101 6.718 21.042 1.00 18.56 C
ATOM 388 C CYS A1697 40.845 6.137 21.676 1.00 15.90 C
ATOM 389 O CYS A1697 39.917 5.750 20.982 1.00 16.80 O
ATOM 390 CB CYS A1697 42.337 8.141 21.567 1.00 16.74 C
ATOM 391 SG CYS A1697 40.957 9.299 21.239 1.00 22.92 S
ATOM 392 N GLU A1698 40.832 6.059 22.998 1.00 18.65 N
ATOM 393 CA GLU A1698 39.653 5.590 23.708 1.00 20.60 C
ATOM 394 C GLU A1698 38.978 6.886 24.169 1.00 21.67 C
ATOM 395 O GLU A1698 39.638 7.931 24.231 1.00 23.29 O
ATOM 396 CB GLU A1698 40.051 4.725 24.904 1.00 23.59 C
ATOM 397 CG GLU A1698 40.800 3.465 24.495 1.00 24.38 C
ATOM 398 CD GLU A1698 40.886 2.450 25.625 1.00 26.32 C
ATOM 399 OE1 GLU A1698 42.011 2.061 26.022 1.00 25.43 O
ATOM 400 OE2 GLU A1698 39.816 2.048 26.113 1.00 28.62 O
ATOM 401 N ARG A1699 37.685 6.835 24.473 1.00 22.21 N
ATOM 402 CA ARG A1699 36.968 8.037 24.903 1.00 27.11 C
ATOM 403 C ARG A1699 37.061 8.322 26.397 1.00 26.19 C
ATOM 404 O ARG A1699 36.439 7.638 27.208 1.00 28.03 O
ATOM 405 CB ARG A1699 35.488 7.941 24.581 1.00 24.08 C
ATOM 406 CG ARG A1699 35.098 7.684 23.156 1.00 27.76 C
ATOM 407 CD ARG A1699 33.792 6.948 23.284 1.00 28.06 C
ATOM 408 NE ARG A1699 32.685 7.602 22.634 1.00 30.31 N
ATOM 409 CZ ARG A1699 31.414 7.359 22.927 1.00 29.00 C
ATOM 410 NH1 ARG A1699 31.103 6.481 23.874 1.00 29.47 N
ATOM 411 NH2 ARG A1699 30.461 7.988 22.262 1.00 29.10 N
ATOM 412 N THR A1700 37.823 9.345 26.756 1.00 20.95 N
ATOM 413 CA THR A1700 37.947 9.731 28.148 1.00 22.35 C
ATOM 414 C THR A1700 37.261 11.095 28.270 1.00 23.39 C
ATOM 415 O THR A1700 36.898 11.719 27.258 1.00 22.44 O
ATOM 416 CB THR A1700 39.430 9.866 28.575 1.00 24.34 C
ATOM 417 OG1 THR A1700 40.058 10.869 27.767 1.00 26.44 O
ATOM 418 CG2 THR A1700 40.188 8.527 28.391 1.00 20.66 C
ATOM 419 N LEU A1701 37.073 11.560 29.499 1.00 24.82 N
ATOM 420 CA LEU A1701 36.445 12.855 29.696 1.00 27.84 C
ATOM 421 C LEU A1701 37.243 13.937 28.958 1.00 27.02 C
ATOM 422 O LEU A1701 36.666 14.776 28.259 1.00 27.08 O
ATOM 423 CB LEU A1701 36.363 13.182 31.192 1.00 32.02 C
ATOM 424 CG LEU A1701 35.736 14.527 31.582 1.00 34.01 C
ATOM 425 CD1 LEU A1701 34.383 14.691 30.895 1.00 35.68 C
ATOM 426 CD2 LEU A1701 35.584 14.592 33.099 1.00 34.20 C
ATOM 427 N LYS A1702 38.570 13.906 29.101 1.00 26.65 N
ATOM 428 CA LYS A1702 39.432 14.885 28.449 1.00 25.10 C
ATOM 429 C LYS A1702 39.253 14.880 26.936 1.00 26.46 C
ATOM 430 O LYS A1702 39.302 15.939 26.311 1.00 27.78 O
ATOM 431 CB LYS A1702 40.906 14.650 28.801 1.00 19.95 C
ATOM 432 CG LYS A1702 41.238 14.932 30.281 1.00 22.24 C
ATOM 433 CD LYS A1702 42.706 14.671 30.576 1.00 22.27 C
ATOM 434 CE LYS A1702 43.049 15.035 31.998 1.00 21.56 C
ATOM 435 NZ LYS A1702 44.434 14.574 32.339 1.00 26.62 N
ATOM 436 N TYR A1703 39.048 13.698 26.355 1.00 23.50 N
ATOM 437 CA TYR A1703 38.829 13.572 24.911 1.00 22.14 C
ATOM 438 C TYR A1703 37.578 14.361 24.501 1.00 21.63 C
ATOM 439 O TYR A1703 37.605 15.142 23.552 1.00 24.38 O
ATOM 440 CB TYR A1703 38.648 12.101 24.541 1.00 19.02 C
ATOM 441 CG TYR A1703 38.272 11.839 23.094 1.00 19.75 C
ATOM 442 CD1 TYR A1703 39.188 12.048 22.059 1.00 18.74 C
ATOM 443 CD2 TYR A1703 37.019 11.317 22.767 1.00 18.08 C
ATOM 444 CE1 TYR A1703 38.872 11.731 20.731 1.00 17.93 C
ATOM 445 CE2 TYR A1703 36.698 11.000 21.443 1.00 20.92 C
ATOM 446 CZ TYR A1703 37.625 11.204 20.433 1.00 19.24 C
ATOM 447 OH TYR A1703 37.324 10.843 19.131 1.00 21.97 O
ATOM 448 N PHE A1704 36.484 14.142 25.221 1.00 20.54 N
ATOM 449 CA PHE A1704 35.226 14.826 24.956 1.00 22.36 C
ATOM 450 C PHE A1704 35.344 16.340 25.104 1.00 26.45 C
ATOM 451 O PHE A1704 34.833 17.101 24.274 1.00 24.41 O
ATOM 452 CB PHE A1704 34.134 14.321 25.905 1.00 26.58 C
ATOM 453 CG PHE A1704 33.647 12.941 25.586 1.00 27.09 C
ATOM 454 CD1 PHE A1704 33.780 11.910 26.513 1.00 24.19 C
ATOM 455 CD2 PHE A1704 33.072 12.667 24.352 1.00 26.46 C
ATOM 456 CE1 PHE A1704 33.348 10.621 26.212 1.00 26.87 C
ATOM 457 CE2 PHE A1704 32.633 11.373 24.036 1.00 27.64 C
ATOM 458 CZ PHE A1704 32.772 10.353 24.961 1.00 26.65 C
ATOM 459 N LEU A1705 36.000 16.773 26.176 1.00 35.94 N
ATOM 460 CA LEU A1705 36.169 18.195 26.448 1.00 35.66 C
ATOM 461 C LEU A1705 37.140 18.863 25.486 1.00 36.32 C
ATOM 462 O LEU A1705 36.968 20.034 25.142 1.00 36.01 O
ATOM 463 CB LEU A1705 36.612 18.399 27.904 1.00 28.23 C
ATOM 464 CG LEU A1705 35.546 17.921 28.901 1.00 26.08 C
ATOM 465 CD1 LEU A1705 36.082 17.961 30.324 1.00 27.24 C
ATOM 466 CD2 LEU A1705 34.293 18.794 28.777 1.00 25.31 C
ATOM 467 N GLY A1706 38.164 18.127 25.061 1.00 28.40 N
ATOM 468 CA GLY A1706 39.116 18.679 24.119 1.00 27.67 C
ATOM 469 C GLY A1706 38.386 18.991 22.826 1.00 30.29 C
ATOM 470 O GLY A1706 38.553 20.069 22.245 1.00 28.66 O
ATOM 471 N ILE A1707 37.566 18.044 22.377 1.00 26.65 N
ATOM 472 CA ILE A1707 36.794 18.210 21.154 1.00 27.98 C
ATOM 473 C ILE A1707 35.832 19.379 21.317 1.00 29.35 C
ATOM 474 O ILE A1707 35.858 20.313 20.529 1.00 30.06 O
ATOM 475 CB ILE A1707 35.978 16.935 20.808 1.00 27.92 C
ATOM 476 CG1 ILE A1707 36.922 15.767 20.531 1.00 28.38 C
ATOM 477 CG2 ILE A1707 35.128 17.167 19.587 1.00 28.25 C
ATOM 478 CD1 ILE A1707 38.020 16.130 19.582 1.00 34.93 C
ATOM 479 N ALA A1708 35.001 19.315 22.351 1.00 33.98 N
ATOM 480 CA ALA A1708 34.016 20.350 22.640 1.00 37.22 C
ATOM 481 C ALA A1708 34.607 21.763 22.661 1.00 37.77 C
ATOM 482 O ALA A1708 33.977 22.717 22.206 1.00 38.10 O
ATOM 483 CB ALA A1708 33.333 20.051 23.983 1.00 20.94 C
ATOM 484 N GLY A1709 35.819 21.897 23.182 1.00 33.72 N
ATOM 485 CA GLY A1709 36.429 23.211 23.263 1.00 34.75 C
ATOM 486 C GLY A1709 37.171 23.609 22.013 1.00 35.26 C
ATOM 487 O GLY A1709 37.743 24.698 21.943 1.00 34.99 O
ATOM 488 N GLY A1710 37.170 22.722 21.023 1.00 39.70 N
ATOM 489 CA GLY A1710 37.861 23.001 19.780 1.00 38.35 C
ATOM 490 C GLY A1710 39.360 23.098 19.971 1.00 36.39 C
ATOM 491 O GLY A1710 40.032 23.865 19.276 1.00 37.10 O
ATOM 492 N LYS A1711 39.895 22.314 20.904 1.00 28.75 N
ATOM 493 CA LYS A1711 41.327 22.335 21.181 1.00 28.32 C
ATOM 494 C LYS A1711 42.063 21.359 20.299 1.00 28.59 C
ATOM 495 O LYS A1711 41.455 20.644 19.510 1.00 31.14 O
ATOM 496 CB LYS A1711 41.601 21.947 22.638 1.00 36.34 C
ATOM 497 CG LYS A1711 40.833 22.746 23.660 1.00 40.89 C
ATOM 498 CD LYS A1711 41.148 22.253 25.065 1.00 42.39 C
ATOM 499 CE LYS A1711 40.306 22.966 26.102 1.00 44.57 C
ATOM 500 NZ LYS A1711 40.554 24.441 26.114 1.00 47.11 N
ATOM 501 N TRP A1712 43.384 21.340 20.420 1.00 28.23 N
ATOM 502 CA TRP A1712 44.159 20.374 19.674 1.00 28.07 C
ATOM 503 C TRP A1712 44.087 19.062 20.476 1.00 26.09 C
ATOM 504 O TRP A1712 44.531 18.989 21.621 1.00 25.16 O
ATOM 505 CB TRP A1712 45.616 20.803 19.530 1.00 34.29 C
ATOM 506 CG TRP A1712 45.856 21.803 18.441 1.00 39.29 C
ATOM 507 CD1 TRP A1712 46.183 23.122 18.592 1.00 41.78 C
ATOM 508 CD2 TRP A1712 45.814 21.559 17.031 1.00 40.79 C
ATOM 509 NE1 TRP A1712 46.348 23.713 17.363 1.00 42.34 N
ATOM 510 CE2 TRP A1712 46.124 22.776 16.385 1.00 42.34 C
ATOM 511 CE3 TRP A1712 45.537 20.427 16.247 1.00 40.04 C
ATOM 512 CZ2 TRP A1712 46.178 22.895 14.992 1.00 43.36 C
ATOM 513 CZ3 TRP A1712 45.589 20.544 14.860 1.00 41.54 C
ATOM 514 CH2 TRP A1712 45.906 21.773 14.248 1.00 41.29 C
ATOM 515 N VAL A1713 43.483 18.050 19.869 1.00 25.80 N
ATOM 516 CA VAL A1713 43.351 16.725 20.466 1.00 23.41 C
ATOM 517 C VAL A1713 44.332 15.965 19.564 1.00 24.19 C
ATOM 518 O VAL A1713 44.019 15.623 18.413 1.00 22.43 O
ATOM 519 CB VAL A1713 41.921 16.213 20.297 1.00 19.60 C
ATOM 520 CG1 VAL A1713 41.755 14.834 20.976 1.00 17.81 C
ATOM 521 CG2 VAL A1713 40.956 17.200 20.895 1.00 16.18 C
ATOM 522 N VAL A1714 45.533 15.745 20.088 1.00 23.08 N
ATOM 523 CA VAL A1714 46.612 15.141 19.328 1.00 24.21 C
ATOM 524 C VAL A1714 47.170 13.846 19.897 1.00 23.89 C
ATOM 525 O VAL A1714 47.194 13.635 21.105 1.00 24.00 O
ATOM 526 CB VAL A1714 47.775 16.162 19.201 1.00 38.59 C
ATOM 527 CG1 VAL A1714 48.930 15.565 18.454 1.00 38.42 C
ATOM 528 CG2 VAL A1714 47.281 17.418 18.496 1.00 41.66 C
ATOM 529 N SER A1715 47.630 12.982 19.009 1.00 33.65 N
ATOM 530 CA SER A1715 48.198 11.719 19.442 1.00 34.70 C
ATOM 531 C SER A1715 49.480 11.956 20.224 1.00 34.73 C
ATOM 532 O SER A1715 50.244 12.879 19.934 1.00 35.56 O
ATOM 533 CB SER A1715 48.493 10.827 18.244 1.00 20.89 C
ATOM 534 OG SER A1715 49.297 9.730 18.650 1.00 24.67 O
ATOM 535 N TYR A1716 49.705 11.116 21.225 1.00 22.32 N
ATOM 536 CA TYR A1716 50.903 11.213 22.044 1.00 24.50 C
ATOM 537 C TYR A1716 52.124 11.040 21.157 1.00 25.73 C
ATOM 538 O TYR A1716 53.250 11.354 21.568 1.00 26.17 O
ATOM 539 CB TYR A1716 50.855 10.150 23.148 1.00 40.46 C
ATOM 540 CG TYR A1716 52.177 9.805 23.794 1.00 41.99 C
ATOM 541 CD1 TYR A1716 52.852 8.634 23.450 1.00 44.59 C
ATOM 542 CD2 TYR A1716 52.752 10.643 24.755 1.00 44.51 C
ATOM 543 CE1 TYR A1716 54.064 8.301 24.043 1.00 45.44 C
ATOM 544 CE2 TYR A1716 53.970 10.321 25.357 1.00 44.12 C
ATOM 545 CZ TYR A1716 54.618 9.148 24.994 1.00 45.84 C
ATOM 546 OH TYR A1716 55.815 8.812 25.578 1.00 45.38 O
ATOM 547 N PHE A1717 51.905 10.552 19.935 1.00 28.06 N
ATOM 548 CA PHE A1717 53.004 10.365 18.986 1.00 30.53 C
ATOM 549 C PHE A1717 53.579 11.707 18.530 1.00 29.85 C
ATOM 550 O PHE A1717 54.676 11.771 17.984 1.00 29.48 O
ATOM 551 CB PHE A1717 52.550 9.554 17.768 1.00 34.28 C
ATOM 552 CG PHE A1717 52.482 8.072 18.017 1.00 37.11 C
ATOM 553 CD1 PHE A1717 51.272 7.402 17.947 1.00 37.28 C
ATOM 554 CD2 PHE A1717 53.629 7.351 18.341 1.00 38.81 C
ATOM 555 CE1 PHE A1717 51.195 6.032 18.191 1.00 37.84 C
ATOM 556 CE2 PHE A1717 53.567 5.974 18.589 1.00 40.16 C
ATOM 557 CZ PHE A1717 52.344 5.317 18.516 1.00 41.01 C
ATOM 558 N TRP A1718 52.826 12.775 18.754 1.00 36.65 N
ATOM 559 CA TRP A1718 53.275 14.117 18.399 1.00 37.06 C
ATOM 560 C TRP A1718 54.491 14.430 19.269 1.00 38.27 C
ATOM 561 O TRP A1718 55.470 15.016 18.812 1.00 38.11 O
ATOM 562 CB TRP A1718 52.146 15.116 18.680 1.00 30.34 C
ATOM 563 CG TRP A1718 52.508 16.588 18.584 1.00 29.86 C
ATOM 564 CD1 TRP A1718 52.991 17.251 17.488 1.00 31.90 C
ATOM 565 CD2 TRP A1718 52.307 17.583 19.596 1.00 29.05 C
ATOM 566 NE1 TRP A1718 53.095 18.600 17.756 1.00 31.18 N
ATOM 567 CE2 TRP A1718 52.683 18.830 19.042 1.00 30.07 C
ATOM 568 CE3 TRP A1718 51.845 17.544 20.920 1.00 30.76 C
ATOM 569 CZ2 TRP A1718 52.604 20.034 19.766 1.00 29.24 C
ATOM 570 CZ3 TRP A1718 51.767 18.747 21.643 1.00 32.66 C
ATOM 571 CH2 TRP A1718 52.150 19.972 21.058 1.00 27.80 C