Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 15-MAY-10 3N1J TITLE CRYSTAL STRUCTURE OF A STWHY2-DT32 COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN STWHY2; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA 32-MER DT32; COMPND 7 CHAIN: B; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SOLANUM TUBEROSUM; SOURCE 3 ORGANISM_COMMON: POTATO; SOURCE 4 ORGANISM_TAXID: 4113; SOURCE 5 STRAIN: KENNEBEC; SOURCE 6 GENE: STWHY2; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PET21A; SOURCE 12 MOL_ID: 2; SOURCE 13 SYNTHETIC: YES; SOURCE 14 OTHER_DETAILS: DNA SYNTHESIS KEYWDS SINGLE-STRANDED DNA BINDING PROTEIN, PLANT, WHIRLY, PROTEIN-DNA KEYWDS 2 COMPLEX, DNA BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR L.CAPPADOCIA,N.BRISSON,J.SYGUSCH REVDAT 2 17-JUL-19 3N1J 1 REMARK REVDAT 1 11-AUG-10 3N1J 0 JRNL AUTH L.CAPPADOCIA,A.MARECHAL,J.S.PARENT,E.LEPAGE,J.SYGUSCH, JRNL AUTH 2 N.BRISSON JRNL TITL CRYSTAL STRUCTURES OF DNA-WHIRLY COMPLEXES AND THEIR ROLE IN JRNL TITL 2 ARABIDOPSIS ORGANELLE GENOME REPAIR. JRNL REF PLANT CELL V. 22 1849 2010 JRNL REFN ISSN 1040-4651 JRNL PMID 20551348 JRNL DOI 10.1105/TPC.109.071399 REMARK 2 REMARK 2 RESOLUTION. 2.65 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.65 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 38.20 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.050 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.1 REMARK 3 NUMBER OF REFLECTIONS : 6011 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.216 REMARK 3 R VALUE (WORKING SET) : 0.212 REMARK 3 FREE R VALUE : 0.258 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.030 REMARK 3 FREE R VALUE TEST SET COUNT : 603 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 38.2005 - 4.2049 0.99 1481 165 0.2147 0.2472 REMARK 3 2 4.2049 - 3.3382 1.00 1376 154 0.1776 0.2282 REMARK 3 3 3.3382 - 2.9164 0.97 1317 145 0.2124 0.2950 REMARK 3 4 2.9164 - 2.6500 0.92 1234 139 0.2638 0.3118 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : 0.31 REMARK 3 B_SOL : 48.91 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 2.530 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : NULL REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 52.00 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 54.37 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -3.16330 REMARK 3 B22 (A**2) : -3.16330 REMARK 3 B33 (A**2) : -3.16330 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.006 1495 REMARK 3 ANGLE : 0.997 2056 REMARK 3 CHIRALITY : 0.055 225 REMARK 3 PLANARITY : 0.003 236 REMARK 3 DIHEDRAL : 18.387 558 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3N1J COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-MAY-10. REMARK 100 THE DEPOSITION ID IS D_1000059262. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 13-NOV-07 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.0 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) : 1.08 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 6188 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.650 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 19.10 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.11800 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 9.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.65 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.74 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 12.70 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.87000 REMARK 200 <I/SIGMA(I)> FOR SHELL : 3.000 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHENIX, CNS REMARK 200 STARTING MODEL: PDB ENTRY 1L3A REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 47.29 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.14 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 25% PEG6000, 0.1M TRIS, 1.2M LICL, PH REMARK 280 8.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: F 4 3 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z REMARK 290 3555 -X,Y,-Z REMARK 290 4555 X,-Y,-Z REMARK 290 5555 Z,X,Y REMARK 290 6555 Z,-X,-Y REMARK 290 7555 -Z,-X,Y REMARK 290 8555 -Z,X,-Y REMARK 290 9555 Y,Z,X REMARK 290 10555 -Y,Z,-X REMARK 290 11555 Y,-Z,-X REMARK 290 12555 -Y,-Z,X REMARK 290 13555 Y,X,-Z REMARK 290 14555 -Y,-X,-Z REMARK 290 15555 Y,-X,Z REMARK 290 16555 -Y,X,Z REMARK 290 17555 X,Z,-Y REMARK 290 18555 -X,Z,Y REMARK 290 19555 -X,-Z,-Y REMARK 290 20555 X,-Z,Y REMARK 290 21555 Z,Y,-X REMARK 290 22555 Z,-Y,X REMARK 290 23555 -Z,Y,X REMARK 290 24555 -Z,-Y,-X REMARK 290 25555 X,Y+1/2,Z+1/2 REMARK 290 26555 -X,-Y+1/2,Z+1/2 REMARK 290 27555 -X,Y+1/2,-Z+1/2 REMARK 290 28555 X,-Y+1/2,-Z+1/2 REMARK 290 29555 Z,X+1/2,Y+1/2 REMARK 290 30555 Z,-X+1/2,-Y+1/2 REMARK 290 31555 -Z,-X+1/2,Y+1/2 REMARK 290 32555 -Z,X+1/2,-Y+1/2 REMARK 290 33555 Y,Z+1/2,X+1/2 REMARK 290 34555 -Y,Z+1/2,-X+1/2 REMARK 290 35555 Y,-Z+1/2,-X+1/2 REMARK 290 36555 -Y,-Z+1/2,X+1/2 REMARK 290 37555 Y,X+1/2,-Z+1/2 REMARK 290 38555 -Y,-X+1/2,-Z+1/2 REMARK 290 39555 Y,-X+1/2,Z+1/2 REMARK 290 40555 -Y,X+1/2,Z+1/2 REMARK 290 41555 X,Z+1/2,-Y+1/2 REMARK 290 42555 -X,Z+1/2,Y+1/2 REMARK 290 43555 -X,-Z+1/2,-Y+1/2 REMARK 290 44555 X,-Z+1/2,Y+1/2 REMARK 290 45555 Z,Y+1/2,-X+1/2 REMARK 290 46555 Z,-Y+1/2,X+1/2 REMARK 290 47555 -Z,Y+1/2,X+1/2 REMARK 290 48555 -Z,-Y+1/2,-X+1/2 REMARK 290 49555 X+1/2,Y,Z+1/2 REMARK 290 50555 -X+1/2,-Y,Z+1/2 REMARK 290 51555 -X+1/2,Y,-Z+1/2 REMARK 290 52555 X+1/2,-Y,-Z+1/2 REMARK 290 53555 Z+1/2,X,Y+1/2 REMARK 290 54555 Z+1/2,-X,-Y+1/2 REMARK 290 55555 -Z+1/2,-X,Y+1/2 REMARK 290 56555 -Z+1/2,X,-Y+1/2 REMARK 290 57555 Y+1/2,Z,X+1/2 REMARK 290 58555 -Y+1/2,Z,-X+1/2 REMARK 290 59555 Y+1/2,-Z,-X+1/2 REMARK 290 60555 -Y+1/2,-Z,X+1/2 REMARK 290 61555 Y+1/2,X,-Z+1/2 REMARK 290 62555 -Y+1/2,-X,-Z+1/2 REMARK 290 63555 Y+1/2,-X,Z+1/2 REMARK 290 64555 -Y+1/2,X,Z+1/2 REMARK 290 65555 X+1/2,Z,-Y+1/2 REMARK 290 66555 -X+1/2,Z,Y+1/2 REMARK 290 67555 -X+1/2,-Z,-Y+1/2 REMARK 290 68555 X+1/2,-Z,Y+1/2 REMARK 290 69555 Z+1/2,Y,-X+1/2 REMARK 290 70555 Z+1/2,-Y,X+1/2 REMARK 290 71555 -Z+1/2,Y,X+1/2 REMARK 290 72555 -Z+1/2,-Y,-X+1/2 REMARK 290 73555 X+1/2,Y+1/2,Z REMARK 290 74555 -X+1/2,-Y+1/2,Z REMARK 290 75555 -X+1/2,Y+1/2,-Z REMARK 290 76555 X+1/2,-Y+1/2,-Z REMARK 290 77555 Z+1/2,X+1/2,Y REMARK 290 78555 Z+1/2,-X+1/2,-Y REMARK 290 79555 -Z+1/2,-X+1/2,Y REMARK 290 80555 -Z+1/2,X+1/2,-Y REMARK 290 81555 Y+1/2,Z+1/2,X REMARK 290 82555 -Y+1/2,Z+1/2,-X REMARK 290 83555 Y+1/2,-Z+1/2,-X REMARK 290 84555 -Y+1/2,-Z+1/2,X REMARK 290 85555 Y+1/2,X+1/2,-Z REMARK 290 86555 -Y+1/2,-X+1/2,-Z REMARK 290 87555 Y+1/2,-X+1/2,Z REMARK 290 88555 -Y+1/2,X+1/2,Z REMARK 290 89555 X+1/2,Z+1/2,-Y REMARK 290 90555 -X+1/2,Z+1/2,Y REMARK 290 91555 -X+1/2,-Z+1/2,-Y REMARK 290 92555 X+1/2,-Z+1/2,Y REMARK 290 93555 Z+1/2,Y+1/2,-X REMARK 290 94555 Z+1/2,-Y+1/2,X REMARK 290 95555 -Z+1/2,Y+1/2,X REMARK 290 96555 -Z+1/2,-Y+1/2,-X 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 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 6 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 6 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 7 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 9 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 9 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 9 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 10 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 10 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 10 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 12 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 12 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 12 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 13 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 13 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 13 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 14 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 14 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 14 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 15 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 15 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 15 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 16 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 16 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 16 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 17 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 17 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 17 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 18 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 18 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 18 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 19 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 19 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 19 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 20 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 20 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 20 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 21 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 21 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 21 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 22 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 22 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 22 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 23 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 23 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 23 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 24 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 24 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 24 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 25 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 25 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 25 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 26 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 26 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 26 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 27 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 27 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 27 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 28 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 28 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 28 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 29 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 29 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 29 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 30 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 30 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 30 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 31 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 31 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 31 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 32 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 32 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 32 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 33 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 33 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 33 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 34 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 34 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 34 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 35 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 35 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 35 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 36 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 36 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 36 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 37 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 37 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 37 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 38 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 38 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 38 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 39 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 39 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 39 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 40 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 40 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 40 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 41 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 41 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 41 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 42 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 42 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 42 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 43 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 43 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 43 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 44 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 44 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 44 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 45 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 45 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 45 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 46 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 46 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 46 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 47 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 47 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 47 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 48 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 48 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 48 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 49 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 49 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 49 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 50 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 50 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 50 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 51 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 51 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 51 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 52 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 52 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 52 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 53 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 53 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 53 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 54 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 54 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 54 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 55 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 55 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 55 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 56 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 56 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 56 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 57 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 57 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 57 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 58 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 58 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 58 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 59 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 59 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 59 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 60 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 60 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 60 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 61 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 61 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 61 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 62 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 62 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 62 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY1 63 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 63 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 63 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 64 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 64 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 64 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY1 65 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 65 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 65 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 66 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 66 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 66 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 67 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 67 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 67 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY1 68 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 68 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 68 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY1 69 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 69 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 69 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 70 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 70 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 70 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 71 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 71 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 71 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 72 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 72 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 72 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY1 73 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 73 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 73 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 74 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 74 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 74 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 75 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 75 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 75 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 76 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 76 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 76 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 77 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 77 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 77 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 78 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 78 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 78 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 79 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 79 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 79 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 80 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 80 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 80 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 81 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 81 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 81 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 82 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 82 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 82 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 83 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 83 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 83 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 84 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 84 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 84 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 85 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 85 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 85 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 86 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 86 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 86 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 87 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY2 87 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 87 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 88 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY2 88 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY3 88 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 89 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 89 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 89 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 90 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 90 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY3 90 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 91 -1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 91 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 91 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 92 1.000000 0.000000 0.000000 83.24750 REMARK 290 SMTRY2 92 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY3 92 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 93 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 93 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 93 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 94 0.000000 0.000000 1.000000 83.24750 REMARK 290 SMTRY2 94 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 94 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 95 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 95 0.000000 1.000000 0.000000 83.24750 REMARK 290 SMTRY3 95 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 96 0.000000 0.000000 -1.000000 83.24750 REMARK 290 SMTRY2 96 0.000000 -1.000000 0.000000 83.24750 REMARK 290 SMTRY3 96 -1.000000 0.000000 0.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 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 300 REMARK: AUTHORS STATE THAT THE BIOLOGICAL UNIT IS A TETRAMER REMARK 300 PROTEIN PLUS A 32-MER DNA MOLECULE, AS INDICATED AS PENTAMER IN REMARK 300 REMARK 350. PLEASE REFER TO REMARK 999 FOR MORE DETAILS ON THE REMARK 300 SEQUENCES SPECIFICITY OF THIS CRYSTAL STRUCTURE. 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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: 48-MERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 128240 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 171920 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -985.0 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 350 BIOMT1 2 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT3 2 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 3 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT2 3 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 3 0.000000 0.000000 -1.000000 -166.49500 REMARK 350 BIOMT1 4 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 4 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT3 4 0.000000 0.000000 -1.000000 -166.49500 REMARK 350 BIOMT1 5 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT2 5 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT3 5 0.000000 1.000000 0.000000 -166.49500 REMARK 350 BIOMT1 6 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT2 6 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT3 6 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT1 7 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT2 7 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT3 7 0.000000 1.000000 0.000000 -166.49500 REMARK 350 BIOMT1 8 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT2 8 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT3 8 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT1 9 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT2 9 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT3 9 1.000000 0.000000 0.000000 -166.49500 REMARK 350 BIOMT1 10 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT2 10 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT3 10 -1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT1 11 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT2 11 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT3 11 -1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT1 12 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT2 12 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT3 12 1.000000 0.000000 0.000000 -166.49500 REMARK 350 BIOMT1 13 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT2 13 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT3 13 0.000000 0.000000 -1.000000 -166.49500 REMARK 350 BIOMT1 14 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT2 14 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT3 14 0.000000 0.000000 -1.000000 -166.49500 REMARK 350 BIOMT1 15 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT2 15 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT3 15 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 16 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT2 16 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT3 16 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 17 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 17 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT3 17 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT1 18 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT2 18 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT3 18 0.000000 1.000000 0.000000 -166.49500 REMARK 350 BIOMT1 19 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT2 19 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT3 19 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT1 20 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 20 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT3 20 0.000000 1.000000 0.000000 -166.49500 REMARK 350 BIOMT1 21 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT2 21 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 21 -1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT1 22 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT2 22 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT3 22 1.000000 0.000000 0.000000 -166.49500 REMARK 350 BIOMT1 23 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT2 23 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 23 1.000000 0.000000 0.000000 -166.49500 REMARK 350 BIOMT1 24 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT2 24 0.000000 -1.000000 0.000000 166.49500 REMARK 350 BIOMT3 24 -1.000000 0.000000 0.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: OCTAMERIC 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 350 BIOMT1 2 -1.000000 0.000000 0.000000 166.49500 REMARK 350 BIOMT2 2 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 -166.49500 REMARK 350 BIOMT1 3 0.000000 0.000000 1.000000 166.49500 REMARK 350 BIOMT2 3 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 3 -1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT1 4 0.000000 0.000000 -1.000000 0.00000 REMARK 350 BIOMT2 4 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 4 1.000000 0.000000 0.000000 -166.49500 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 MET A 47 REMARK 465 ALA A 48 REMARK 465 ASP A 49 REMARK 465 ALA A 50 REMARK 465 GLY A 51 REMARK 465 LYS A 52 REMARK 465 ARG A 53 REMARK 465 GLU A 54 REMARK 465 PRO A 216 REMARK 465 LEU A 217 REMARK 465 GLU A 218 REMARK 465 HIS A 219 REMARK 465 HIS A 220 REMARK 465 HIS A 221 REMARK 465 HIS A 222 REMARK 465 HIS A 223 REMARK 465 HIS A 224 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 DT B 8 O4' - C1' - N1 ANGL. DEV. = 2.9 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 ASN A 90 -84.13 -99.01 REMARK 500 ARG A 106 51.18 37.99 REMARK 500 LYS A 112 30.15 -94.70 REMARK 500 SER A 142 47.59 -98.21 REMARK 500 LEU A 144 4.65 59.05 REMARK 500 SER A 164 30.60 -81.26 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3N1H RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF STWHY2 REMARK 900 RELATED ID: 3N1I RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF STWHY2-ERE32 COMPLEX REMARK 900 RELATED ID: 3N1K RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF STWHY2-CERE32 COMPLEX REMARK 900 RELATED ID: 3N1L RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF STWHY2-RCERE32 COMPLEX REMARK 999 REMARK 999 SEQUENCE REMARK 999 THE SEQUENCE OF THE CRYSTALLIZED DNA IS A 32-MER OLIGONUCLEOTIDE REMARK 999 WITH SEQUENCE TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT. ONLY 9 RESIDUES REMARK 999 WERE MODELED IN THE COORDINATES OF THE ASYMMETRIC UNIT. ACCORDING REMARK 999 TO THE AUTHORS, THE 32-MER DNA BINDS A TETRAMER THAT INCLUDE FOUR REMARK 999 MONOMERS OF FOUR ASYMMETRIC UNITS; THE STWHY2-DNA BINDING IS NOT REMARK 999 SEQUENCE SPECIFIC THUS EACH TETRAMERIC PROTEIN BINDS A 32-MER DNA REMARK 999 IN DIFFERENT SEQUENCE REGISTERS; AS A RESULT ONLY THREE OF THE FOUR REMARK 999 DNA-BINDING SITES OF EACH TETRAMER WOULD BE PHYSICALLY OCCUPIED BY REMARK 999 THE DNA. DBREF 3N1J A 47 224 PDB 3N1J 3N1J 47 224 DBREF 3N1J B 1 9 PDB 3N1J 3N1J 1 9 SEQRES 1 A 178 MET ALA ASP ALA GLY LYS ARG GLU GLY ARG VAL PHE ALA SEQRES 2 A 178 PRO TYR SER VAL PHE LYS GLY LYS ALA ALA LEU SER ALA SEQRES 3 A 178 GLU PRO ARG LEU PRO THR PHE ASN ARG LEU ASP SER GLY SEQRES 4 A 178 GLY VAL LYS LEU ASN ARG ARG GLY VAL ILE MET LEU THR SEQRES 5 A 178 PHE TRP PRO SER VAL GLY GLU ARG LYS TYR ASP TRP GLU SEQRES 6 A 178 LYS ARG GLN LEU PHE ALA LEU SER ALA THR GLU VAL GLY SEQRES 7 A 178 SER LEU ILE SER MET GLY THR ARG ASP SER SER GLU PHE SEQRES 8 A 178 PHE HIS ASP PRO SER MET LEU SER SER ASN ALA GLY GLN SEQRES 9 A 178 VAL ARG LYS SER LEU SER ILE LYS PRO ASN ALA ASP GLY SEQRES 10 A 178 SER GLY TYR PHE ILE SER LEU SER VAL VAL ASN ASN ASN SEQRES 11 A 178 LEU LYS THR ASN ASP ARG PHE THR VAL PRO VAL THR THR SEQRES 12 A 178 ALA GLU PHE ALA VAL MET ARG THR ALA PHE SER PHE ALA SEQRES 13 A 178 LEU PRO HIS ILE MET GLY TRP ASP ARG PHE THR ASN ARG SEQRES 14 A 178 PRO LEU GLU HIS HIS HIS HIS HIS HIS SEQRES 1 B 9 DT DT DT DT DT DT DT DT DT FORMUL 3 HOH *60(H2 O) HELIX 1 1 ASP A 109 ARG A 113 5 5 HELIX 2 2 SER A 119 SER A 128 1 10 HELIX 3 3 THR A 188 MET A 207 1 20 HELIX 4 4 GLY A 208 PHE A 212 5 5 SHEET 1 A 4 TYR A 61 PHE A 64 0 SHEET 2 A 4 ALA A 68 ARG A 75 -1 O LEU A 70 N VAL A 63 SHEET 3 A 4 VAL A 94 PRO A 101 -1 O VAL A 94 N ARG A 75 SHEET 4 A 4 GLN A 114 LEU A 118 -1 O GLN A 114 N PHE A 99 SHEET 1 B 2 PHE A 79 ARG A 81 0 SHEET 2 B 2 VAL A 87 LEU A 89 -1 O LYS A 88 N ASN A 80 SHEET 1 C 4 SER A 135 HIS A 139 0 SHEET 2 C 4 VAL A 151 PRO A 159 -1 O LEU A 155 N PHE A 137 SHEET 3 C 4 TYR A 166 ASN A 174 -1 O PHE A 167 N LYS A 158 SHEET 4 C 4 THR A 179 VAL A 187 -1 O VAL A 185 N ILE A 168 CRYST1 166.495 166.495 166.495 90.00 90.00 90.00 F 4 3 2 96 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 0.006006 0.000000 0.000000 0.00000 SCALE2 0.000000 0.006006 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006006 0.00000 ATOM 1 N GLY A 55 71.290 143.449 -73.899 1.00 67.58 N ATOM 2 CA GLY A 55 69.953 143.029 -74.281 1.00 72.34 C ATOM 3 C GLY A 55 69.745 141.524 -74.196 1.00 76.17 C ATOM 4 O GLY A 55 70.637 140.739 -74.526 1.00 65.68 O ATOM 5 N ARG A 56 68.556 141.126 -73.752 1.00 72.58 N ATOM 6 CA ARG A 56 68.201 139.718 -73.638 1.00 70.25 C ATOM 7 C ARG A 56 67.955 139.148 -75.037 1.00 69.97 C ATOM 8 O ARG A 56 67.656 139.900 -75.968 1.00 68.68 O ATOM 9 CB ARG A 56 66.941 139.579 -72.782 1.00 78.00 C ATOM 10 CG ARG A 56 67.093 138.709 -71.523 1.00 86.98 C ATOM 11 CD ARG A 56 66.485 137.305 -71.676 1.00 86.49 C ATOM 12 NE ARG A 56 65.888 136.824 -70.424 1.00 88.69 N ATOM 13 CZ ARG A 56 65.684 135.541 -70.116 1.00 86.23 C ATOM 14 NH1 ARG A 56 66.037 134.580 -70.964 1.00 85.55 N ATOM 15 NH2 ARG A 56 65.132 135.213 -68.951 1.00 78.74 N ATOM 16 N VAL A 57 68.087 137.828 -75.183 1.00 69.06 N ATOM 17 CA VAL A 57 67.919 137.154 -76.474 1.00 60.50 C ATOM 18 C VAL A 57 67.072 135.897 -76.305 1.00 61.92 C ATOM 19 O VAL A 57 67.336 135.089 -75.412 1.00 63.36 O ATOM 20 CB VAL A 57 69.277 136.730 -77.069 1.00 60.47 C ATOM 21 CG1 VAL A 57 69.074 135.938 -78.355 1.00 49.34 C ATOM 22 CG2 VAL A 57 70.167 137.944 -77.308 1.00 62.16 C ATOM 23 N PHE A 58 66.067 135.723 -77.161 1.00 56.92 N ATOM 24 CA PHE A 58 65.155 134.582 -77.049 1.00 56.57 C ATOM 25 C PHE A 58 65.168 133.698 -78.300 1.00 57.58 C ATOM 26 O PHE A 58 64.371 133.892 -79.227 1.00 54.00 O ATOM 27 CB PHE A 58 63.720 135.048 -76.768 1.00 57.60 C ATOM 28 CG PHE A 58 63.587 135.930 -75.559 1.00 69.55 C ATOM 29 CD1 PHE A 58 63.313 137.289 -75.698 1.00 71.54 C ATOM 30 CD2 PHE A 58 63.730 135.405 -74.279 1.00 73.86 C ATOM 31 CE1 PHE A 58 63.184 138.109 -74.584 1.00 73.63 C ATOM 32 CE2 PHE A 58 63.605 136.220 -73.154 1.00 76.70 C ATOM 33 CZ PHE A 58 63.330 137.571 -73.307 1.00 79.03 C ATOM 34 N ALA A 59 66.068 132.720 -78.316 1.00 51.20 N ATOM 35 CA ALA A 59 66.181 131.804 -79.440 1.00 44.06 C ATOM 36 C ALA A 59 66.196 130.380 -78.913 1.00 41.29 C ATOM 37 O ALA A 59 67.231 129.717 -78.922 1.00 37.66 O ATOM 38 CB ALA A 59 67.439 132.097 -80.236 1.00 43.12 C ATOM 39 N PRO A 60 65.036 129.909 -78.440 1.00 45.76 N ATOM 40 CA PRO A 60 64.897 128.584 -77.831 1.00 42.27 C ATOM 41 C PRO A 60 64.901 127.501 -78.887 1.00 39.23 C ATOM 42 O PRO A 60 64.241 127.675 -79.906 1.00 41.43 O ATOM 43 CB PRO A 60 63.498 128.626 -77.199 1.00 38.89 C ATOM 44 CG PRO A 60 63.017 130.031 -77.332 1.00 49.03 C ATOM 45 CD PRO A 60 63.753 130.628 -78.483 1.00 47.41 C ATOM 46 N TYR A 61 65.625 126.408 -78.660 1.00 37.76 N ATOM 47 CA TYR A 61 65.364 125.208 -79.436 1.00 41.23 C ATOM 48 C TYR A 61 64.255 124.450 -78.731 1.00 41.95 C ATOM 49 O TYR A 61 64.416 124.011 -77.590 1.00 38.42 O ATOM 50 CB TYR A 61 66.596 124.329 -79.580 1.00 40.60 C ATOM 51 CG TYR A 61 66.322 123.062 -80.354 1.00 38.45 C ATOM 52 CD1 TYR A 61 65.833 123.115 -81.654 1.00 37.70 C ATOM 53 CD2 TYR A 61 66.555 121.811 -79.787 1.00 39.26 C ATOM 54 CE1 TYR A 61 65.584 121.956 -82.371 1.00 43.11 C ATOM 55 CE2 TYR A 61 66.312 120.637 -80.498 1.00 37.07 C ATOM 56 CZ TYR A 61 65.829 120.716 -81.790 1.00 43.16 C ATOM 57 OH TYR A 61 65.584 119.565 -82.511 1.00 41.03 O ATOM 58 N SER A 62 63.117 124.324 -79.400 1.00 40.43 N ATOM 59 CA SER A 62 61.953 123.728 -78.769 1.00 45.15 C ATOM 60 C SER A 62 61.454 122.487 -79.503 1.00 45.55 C ATOM 61 O SER A 62 61.428 122.443 -80.732 1.00 47.46 O ATOM 62 CB SER A 62 60.839 124.769 -78.609 1.00 46.90 C ATOM 63 OG SER A 62 61.181 125.716 -77.607 1.00 45.40 O ATOM 64 N VAL A 63 61.081 121.470 -78.732 1.00 48.17 N ATOM 65 CA VAL A 63 60.468 120.270 -79.284 1.00 50.04 C ATOM 66 C VAL A 63 59.063 120.086 -78.720 1.00 51.97 C ATOM 67 O VAL A 63 58.884 119.989 -77.505 1.00 52.59 O ATOM 68 CB VAL A 63 61.286 119.014 -78.971 1.00 48.12 C ATOM 69 CG1 VAL A 63 60.513 117.778 -79.406 1.00 52.46 C ATOM 70 CG2 VAL A 63 62.651 119.076 -79.654 1.00 43.59 C ATOM 71 N PHE A 64 58.070 120.052 -79.603 1.00 53.45 N ATOM 72 CA PHE A 64 56.677 119.891 -79.198 1.00 51.47 C ATOM 73 C PHE A 64 56.195 118.475 -79.494 1.00 55.41 C ATOM 74 O PHE A 64 56.444 117.937 -80.576 1.00 60.81 O ATOM 75 CB PHE A 64 55.799 120.901 -79.924 1.00 51.43 C ATOM 76 CG PHE A 64 56.108 122.331 -79.580 1.00 53.39 C ATOM 77 CD1 PHE A 64 55.352 123.012 -78.642 1.00 54.12 C ATOM 78 CD2 PHE A 64 57.148 122.996 -80.197 1.00 49.54 C ATOM 79 CE1 PHE A 64 55.627 124.325 -78.328 1.00 52.25 C ATOM 80 CE2 PHE A 64 57.425 124.306 -79.885 1.00 46.93 C ATOM 81 CZ PHE A 64 56.665 124.972 -78.948 1.00 48.64 C ATOM 82 N LYS A 65 55.513 117.868 -78.531 1.00 55.99 N ATOM 83 CA LYS A 65 55.140 116.462 -78.637 1.00 51.67 C ATOM 84 C LYS A 65 53.781 116.210 -77.975 1.00 55.14 C ATOM 85 O LYS A 65 53.049 117.156 -77.674 1.00 49.60 O ATOM 86 CB LYS A 65 56.233 115.572 -78.043 1.00 45.18 C ATOM 87 CG LYS A 65 57.538 115.538 -78.866 1.00 50.47 C ATOM 88 CD LYS A 65 57.543 114.458 -79.962 1.00 55.18 C ATOM 89 CE LYS A 65 58.562 114.763 -81.085 1.00 49.88 C ATOM 90 NZ LYS A 65 59.997 114.441 -80.789 1.00 46.26 N ATOM 91 N GLY A 66 53.445 114.938 -77.760 1.00 56.92 N ATOM 92 CA GLY A 66 52.135 114.554 -77.257 1.00 50.44 C ATOM 93 C GLY A 66 51.649 115.262 -76.004 1.00 51.79 C ATOM 94 O GLY A 66 50.704 116.050 -76.056 1.00 42.00 O ATOM 95 N LYS A 67 52.294 114.980 -74.875 1.00 55.55 N ATOM 96 CA LYS A 67 51.808 115.449 -73.581 1.00 54.51 C ATOM 97 C LYS A 67 52.579 116.653 -73.042 1.00 58.13 C ATOM 98 O LYS A 67 52.076 117.386 -72.181 1.00 61.37 O ATOM 99 CB LYS A 67 51.804 114.305 -72.560 1.00 61.08 C ATOM 100 CG LYS A 67 51.181 113.010 -73.099 1.00 61.47 C ATOM 101 CD LYS A 67 50.459 112.218 -72.002 1.00 62.38 C ATOM 102 CE LYS A 67 49.634 111.061 -72.586 1.00 56.05 C ATOM 103 NZ LYS A 67 50.451 109.945 -73.167 1.00 49.48 N ATOM 104 N ALA A 68 53.792 116.869 -73.544 1.00 61.36 N ATOM 105 CA ALA A 68 54.555 118.051 -73.141 1.00 59.63 C ATOM 106 C ALA A 68 55.471 118.589 -74.235 1.00 58.73 C ATOM 107 O ALA A 68 55.735 117.922 -75.247 1.00 55.45 O ATOM 108 CB ALA A 68 55.351 117.781 -71.865 1.00 55.46 C ATOM 109 N ALA A 69 55.941 119.813 -74.010 1.00 57.00 N ATOM 110 CA ALA A 69 56.924 120.451 -74.868 1.00 53.49 C ATOM 111 C ALA A 69 58.224 120.631 -74.098 1.00 50.67 C ATOM 112 O ALA A 69 58.225 120.764 -72.871 1.00 43.92 O ATOM 113 CB ALA A 69 56.410 121.798 -75.351 1.00 51.58 C ATOM 114 N LEU A 70 59.331 120.647 -74.831 1.00 53.63 N ATOM 115 CA LEU A 70 60.645 120.825 -74.236 1.00 51.53 C ATOM 116 C LEU A 70 61.366 121.995 -74.905 1.00 45.22 C ATOM 117 O LEU A 70 61.470 122.042 -76.123 1.00 47.52 O ATOM 118 CB LEU A 70 61.452 119.542 -74.406 1.00 43.82 C ATOM 119 CG LEU A 70 62.906 119.663 -73.987 1.00 45.98 C ATOM 120 CD1 LEU A 70 62.959 120.214 -72.574 1.00 46.67 C ATOM 121 CD2 LEU A 70 63.599 118.316 -74.091 1.00 42.26 C ATOM 122 N SER A 71 61.861 122.936 -74.111 1.00 46.70 N ATOM 123 CA SER A 71 62.584 124.088 -74.650 1.00 46.92 C ATOM 124 C SER A 71 63.977 124.210 -74.050 1.00 42.43 C ATOM 125 O SER A 71 64.137 124.120 -72.840 1.00 44.14 O ATOM 126 CB SER A 71 61.803 125.367 -74.374 1.00 44.84 C ATOM 127 OG SER A 71 62.390 126.470 -75.029 1.00 49.31 O ATOM 128 N ALA A 72 64.984 124.429 -74.890 1.00 43.77 N ATOM 129 CA ALA A 72 66.354 124.606 -74.398 1.00 41.14 C ATOM 130 C ALA A 72 67.020 125.889 -74.911 1.00 41.27 C ATOM 131 O ALA A 72 67.065 126.140 -76.124 1.00 39.79 O ATOM 132 CB ALA A 72 67.202 123.398 -74.752 1.00 34.06 C ATOM 133 N GLU A 73 67.532 126.697 -73.985 1.00 38.06 N ATOM 134 CA GLU A 73 68.331 127.862 -74.363 1.00 40.06 C ATOM 135 C GLU A 73 69.382 128.197 -73.306 1.00 37.82 C ATOM 136 O GLU A 73 69.127 128.078 -72.111 1.00 37.06 O ATOM 137 CB GLU A 73 67.456 129.082 -74.683 1.00 40.47 C ATOM 138 CG GLU A 73 66.914 129.814 -73.465 1.00 45.56 C ATOM 139 CD GLU A 73 66.146 131.087 -73.823 1.00 60.00 C ATOM 140 OE1 GLU A 73 66.203 131.529 -75.004 1.00 53.10 O ATOM 141 OE2 GLU A 73 65.487 131.643 -72.909 1.00 64.75 O ATOM 142 N PRO A 74 70.578 128.607 -73.758 1.00 38.31 N ATOM 143 CA PRO A 74 71.708 128.950 -72.884 1.00 35.14 C ATOM 144 C PRO A 74 71.435 130.200 -72.055 1.00 38.36 C ATOM 145 O PRO A 74 70.756 131.105 -72.533 1.00 40.28 O ATOM 146 CB PRO A 74 72.843 129.251 -73.868 1.00 33.73 C ATOM 147 CG PRO A 74 72.365 128.753 -75.230 1.00 40.37 C ATOM 148 CD PRO A 74 70.885 128.819 -75.187 1.00 39.15 C ATOM 149 N ARG A 75 71.955 130.234 -70.833 1.00 34.46 N ATOM 150 CA ARG A 75 71.952 131.424 -70.002 1.00 35.43 C ATOM 151 C ARG A 75 73.420 131.733 -69.746 1.00 38.72 C ATOM 152 O ARG A 75 74.112 130.932 -69.104 1.00 38.46 O ATOM 153 CB ARG A 75 71.304 131.129 -68.652 1.00 41.73 C ATOM 154 CG ARG A 75 70.102 131.986 -68.281 1.00 53.71 C ATOM 155 CD ARG A 75 68.969 131.759 -69.289 1.00 62.11 C ATOM 156 NE ARG A 75 67.657 131.591 -68.664 1.00 55.92 N ATOM 157 CZ ARG A 75 66.582 131.159 -69.323 1.00 64.68 C ATOM 158 NH1 ARG A 75 66.678 130.864 -70.617 1.00 53.75 N ATOM 159 NH2 ARG A 75 65.411 131.019 -68.700 1.00 62.26 N ATOM 160 N LEU A 76 73.897 132.876 -70.228 1.00 41.73 N ATOM 161 CA LEU A 76 75.316 133.214 -70.123 1.00 45.01 C ATOM 162 C LEU A 76 75.748 133.406 -68.680 1.00 41.55 C ATOM 163 O LEU A 76 74.914 133.620 -67.807 1.00 41.58 O ATOM 164 CB LEU A 76 75.628 134.474 -70.927 1.00 42.31 C ATOM 165 CG LEU A 76 75.362 134.362 -72.426 1.00 46.78 C ATOM 166 CD1 LEU A 76 75.634 135.682 -73.126 1.00 50.42 C ATOM 167 CD2 LEU A 76 76.211 133.240 -73.007 1.00 46.19 C ATOM 168 N PRO A 77 77.061 133.330 -68.429 1.00 40.92 N ATOM 169 CA PRO A 77 77.618 133.633 -67.108 1.00 42.51 C ATOM 170 C PRO A 77 77.578 135.126 -66.852 1.00 43.14 C ATOM 171 O PRO A 77 77.573 135.909 -67.803 1.00 42.93 O ATOM 172 CB PRO A 77 79.087 133.206 -67.224 1.00 40.07 C ATOM 173 CG PRO A 77 79.232 132.574 -68.546 1.00 41.96 C ATOM 174 CD PRO A 77 78.106 133.004 -69.408 1.00 38.87 C ATOM 175 N THR A 78 77.552 135.514 -65.582 1.00 47.81 N ATOM 176 CA THR A 78 77.766 136.906 -65.215 1.00 52.65 C ATOM 177 C THR A 78 79.231 137.111 -64.851 1.00 51.60 C ATOM 178 O THR A 78 79.879 136.207 -64.321 1.00 46.82 O ATOM 179 CB THR A 78 76.920 137.318 -64.012 1.00 51.20 C ATOM 180 OG1 THR A 78 77.256 136.483 -62.899 1.00 52.92 O ATOM 181 CG2 THR A 78 75.443 137.196 -64.323 1.00 49.69 C ATOM 182 N PHE A 79 79.743 138.302 -65.141 1.00 52.16 N ATOM 183 CA PHE A 79 81.119 138.660 -64.798 1.00 55.73 C ATOM 184 C PHE A 79 81.179 139.889 -63.895 1.00 58.21 C ATOM 185 O PHE A 79 80.326 140.778 -63.971 1.00 60.85 O ATOM 186 CB PHE A 79 81.947 138.928 -66.057 1.00 50.94 C ATOM 187 CG PHE A 79 82.163 137.722 -66.907 1.00 50.28 C ATOM 188 CD1 PHE A 79 81.175 137.283 -67.772 1.00 50.36 C ATOM 189 CD2 PHE A 79 83.356 137.023 -66.845 1.00 53.58 C ATOM 190 CE1 PHE A 79 81.370 136.162 -68.562 1.00 50.33 C ATOM 191 CE2 PHE A 79 83.558 135.908 -67.626 1.00 54.89 C ATOM 192 CZ PHE A 79 82.559 135.474 -68.488 1.00 52.35 C ATOM 193 N ASN A 80 82.197 139.927 -63.042 1.00 55.91 N ATOM 194 CA ASN A 80 82.466 141.085 -62.202 1.00 56.12 C ATOM 195 C ASN A 80 83.783 141.718 -62.622 1.00 51.69 C ATOM 196 O ASN A 80 84.802 141.039 -62.701 1.00 51.08 O ATOM 197 CB ASN A 80 82.507 140.692 -60.720 1.00 53.57 C ATOM 198 CG ASN A 80 81.118 140.499 -60.121 1.00 63.04 C ATOM 199 OD1 ASN A 80 80.104 140.859 -60.730 1.00 66.20 O ATOM 200 ND2 ASN A 80 81.067 139.931 -58.920 1.00 55.87 N ATOM 201 N ARG A 81 83.760 143.014 -62.908 1.00 54.75 N ATOM 202 CA ARG A 81 84.976 143.706 -63.319 1.00 60.14 C ATOM 203 C ARG A 81 85.822 144.052 -62.101 1.00 56.18 C ATOM 204 O ARG A 81 85.431 144.872 -61.276 1.00 55.10 O ATOM 205 CB ARG A 81 84.644 144.957 -64.129 1.00 62.20 C ATOM 206 CG ARG A 81 85.831 145.540 -64.879 1.00 67.98 C ATOM 207 CD ARG A 81 85.385 146.566 -65.919 1.00 75.20 C ATOM 208 NE ARG A 81 84.687 145.944 -67.045 1.00 83.03 N ATOM 209 CZ ARG A 81 83.362 145.845 -67.150 1.00 86.51 C ATOM 210 NH1 ARG A 81 82.572 146.330 -66.195 1.00 78.88 N ATOM 211 NH2 ARG A 81 82.823 145.261 -68.214 1.00 82.23 N ATOM 212 N LEU A 82 86.976 143.403 -61.988 1.00 60.32 N ATOM 213 CA LEU A 82 87.848 143.575 -60.834 1.00 64.24 C ATOM 214 C LEU A 82 88.361 145.005 -60.743 1.00 74.80 C ATOM 215 O LEU A 82 88.323 145.758 -61.721 1.00 75.43 O ATOM 216 CB LEU A 82 89.037 142.620 -60.917 1.00 69.03 C ATOM 217 CG LEU A 82 88.699 141.142 -61.107 1.00 71.48 C ATOM 218 CD1 LEU A 82 89.966 140.306 -61.315 1.00 71.58 C ATOM 219 CD2 LEU A 82 87.898 140.640 -59.922 1.00 62.83 C ATOM 220 N ASP A 83 88.841 145.378 -59.561 1.00 77.93 N ATOM 221 CA ASP A 83 89.466 146.678 -59.388 1.00 76.04 C ATOM 222 C ASP A 83 90.841 146.647 -60.056 1.00 80.43 C ATOM 223 O ASP A 83 91.340 147.671 -60.528 1.00 79.30 O ATOM 224 CB ASP A 83 89.569 147.037 -57.902 1.00 69.00 C ATOM 225 CG ASP A 83 89.565 148.542 -57.665 1.00 78.43 C ATOM 226 OD1 ASP A 83 88.873 149.002 -56.722 1.00 71.57 O ATOM 227 OD2 ASP A 83 90.247 149.265 -58.431 1.00 79.81 O ATOM 228 N SER A 84 91.439 145.458 -60.111 1.00 79.11 N ATOM 229 CA SER A 84 92.707 145.260 -60.809 1.00 79.40 C ATOM 230 C SER A 84 92.626 145.709 -62.269 1.00 81.53 C ATOM 231 O SER A 84 93.636 146.070 -62.871 1.00 85.76 O ATOM 232 CB SER A 84 93.129 143.787 -60.748 1.00 83.68 C ATOM 233 OG SER A 84 93.204 143.314 -59.412 1.00 90.24 O ATOM 234 N GLY A 85 91.422 145.681 -62.835 1.00 80.80 N ATOM 235 CA GLY A 85 91.224 146.004 -64.239 1.00 78.92 C ATOM 236 C GLY A 85 90.748 144.796 -65.034 1.00 81.54 C ATOM 237 O GLY A 85 90.064 144.929 -66.055 1.00 79.08 O ATOM 238 N GLY A 86 91.106 143.607 -64.559 1.00 76.63 N ATOM 239 CA GLY A 86 90.704 142.379 -65.217 1.00 71.83 C ATOM 240 C GLY A 86 89.219 142.103 -65.088 1.00 68.97 C ATOM 241 O GLY A 86 88.467 142.935 -64.581 1.00 65.30 O ATOM 242 N VAL A 87 88.803 140.929 -65.559 1.00 68.83 N ATOM 243 CA VAL A 87 87.417 140.473 -65.443 1.00 64.21 C ATOM 244 C VAL A 87 87.353 139.073 -64.816 1.00 62.69 C ATOM 245 O VAL A 87 88.154 138.194 -65.153 1.00 61.87 O ATOM 246 CB VAL A 87 86.715 140.462 -66.811 1.00 60.23 C ATOM 247 CG1 VAL A 87 85.319 139.897 -66.679 1.00 60.61 C ATOM 248 CG2 VAL A 87 86.677 141.868 -67.403 1.00 60.25 C ATOM 249 N LYS A 88 86.405 138.870 -63.904 1.00 56.63 N ATOM 250 CA LYS A 88 86.292 137.607 -63.181 1.00 52.68 C ATOM 251 C LYS A 88 84.890 137.029 -63.314 1.00 58.22 C ATOM 252 O LYS A 88 83.903 137.708 -63.012 1.00 58.04 O ATOM 253 CB LYS A 88 86.602 137.818 -61.698 1.00 56.79 C ATOM 254 CG LYS A 88 86.558 136.553 -60.848 1.00 61.69 C ATOM 255 CD LYS A 88 86.118 136.856 -59.412 1.00 69.10 C ATOM 256 CE LYS A 88 84.615 137.165 -59.324 1.00 68.63 C ATOM 257 NZ LYS A 88 84.124 137.352 -57.919 1.00 68.06 N ATOM 258 N LEU A 89 84.798 135.775 -63.753 1.00 57.37 N ATOM 259 CA LEU A 89 83.506 135.110 -63.854 1.00 54.76 C ATOM 260 C LEU A 89 82.878 134.967 -62.475 1.00 51.98 C ATOM 261 O LEU A 89 83.490 134.408 -61.571 1.00 55.00 O ATOM 262 CB LEU A 89 83.659 133.735 -64.505 1.00 54.67 C ATOM 263 CG LEU A 89 82.341 133.058 -64.873 1.00 51.43 C ATOM 264 CD1 LEU A 89 82.512 132.149 -66.074 1.00 46.17 C ATOM 265 CD2 LEU A 89 81.732 132.310 -63.680 1.00 45.97 C ATOM 266 N ASN A 90 81.655 135.463 -62.323 1.00 51.20 N ATOM 267 CA ASN A 90 80.947 135.394 -61.045 1.00 57.49 C ATOM 268 C ASN A 90 79.942 134.242 -60.981 1.00 60.58 C ATOM 269 O ASN A 90 80.241 133.167 -60.458 1.00 56.12 O ATOM 270 CB ASN A 90 80.230 136.718 -60.752 1.00 57.75 C ATOM 271 CG ASN A 90 79.351 136.639 -59.518 1.00 61.59 C ATOM 272 OD1 ASN A 90 79.552 135.777 -58.660 1.00 62.86 O ATOM 273 ND2 ASN A 90 78.369 137.534 -59.424 1.00 64.65 N ATOM 274 N ARG A 91 78.742 134.493 -61.504 1.00 57.98 N ATOM 275 CA ARG A 91 77.690 133.480 -61.589 1.00 56.75 C ATOM 276 C ARG A 91 77.844 132.625 -62.853 1.00 56.11 C ATOM 277 O ARG A 91 78.072 133.141 -63.957 1.00 50.83 O ATOM 278 CB ARG A 91 76.305 134.139 -61.559 1.00 60.63 C ATOM 279 CG ARG A 91 75.138 133.184 -61.290 1.00 65.77 C ATOM 280 CD ARG A 91 73.789 133.931 -61.242 1.00 75.78 C ATOM 281 NE ARG A 91 73.157 134.043 -62.558 1.00 74.68 N ATOM 282 CZ ARG A 91 72.224 134.941 -62.876 1.00 78.62 C ATOM 283 NH1 ARG A 91 71.815 135.831 -61.976 1.00 77.52 N ATOM 284 NH2 ARG A 91 71.704 134.957 -64.103 1.00 75.76 N ATOM 285 N ARG A 92 77.720 131.313 -62.694 1.00 51.00 N ATOM 286 CA ARG A 92 77.941 130.404 -63.813 1.00 49.46 C ATOM 287 C ARG A 92 76.792 130.358 -64.804 1.00 45.50 C ATOM 288 O ARG A 92 75.624 130.569 -64.441 1.00 47.03 O ATOM 289 CB ARG A 92 78.212 128.994 -63.307 1.00 52.09 C ATOM 290 CG ARG A 92 79.631 128.499 -63.560 1.00 59.39 C ATOM 291 CD ARG A 92 79.993 128.569 -65.056 1.00 54.74 C ATOM 292 NE ARG A 92 80.830 127.446 -65.503 1.00 57.50 N ATOM 293 CZ ARG A 92 82.037 127.155 -65.009 1.00 62.87 C ATOM 294 NH1 ARG A 92 82.560 127.885 -64.016 1.00 55.58 N ATOM 295 NH2 ARG A 92 82.720 126.118 -65.495 1.00 54.09 N ATOM 296 N GLY A 93 77.133 130.068 -66.056 1.00 36.97 N ATOM 297 CA GLY A 93 76.133 129.897 -67.084 1.00 34.82 C ATOM 298 C GLY A 93 75.540 128.506 -67.018 1.00 37.78 C ATOM 299 O GLY A 93 76.094 127.603 -66.398 1.00 37.25 O ATOM 300 N VAL A 94 74.392 128.332 -67.651 1.00 37.00 N ATOM 301 CA VAL A 94 73.758 127.028 -67.700 1.00 34.00 C ATOM 302 C VAL A 94 73.080 126.885 -69.050 1.00 37.74 C ATOM 303 O VAL A 94 72.945 127.856 -69.790 1.00 36.98 O ATOM 304 CB VAL A 94 72.709 126.842 -66.556 1.00 33.92 C ATOM 305 CG1 VAL A 94 73.364 126.966 -65.181 1.00 30.43 C ATOM 306 CG2 VAL A 94 71.565 127.838 -66.688 1.00 32.80 C ATOM 307 N ILE A 95 72.688 125.664 -69.387 1.00 40.71 N ATOM 308 CA ILE A 95 71.723 125.464 -70.448 1.00 34.49 C ATOM 309 C ILE A 95 70.383 125.260 -69.765 1.00 33.39 C ATOM 310 O ILE A 95 70.148 124.216 -69.161 1.00 32.68 O ATOM 311 CB ILE A 95 72.048 124.222 -71.282 1.00 38.12 C ATOM 312 CG1 ILE A 95 73.392 124.377 -71.997 1.00 34.83 C ATOM 313 CG2 ILE A 95 70.942 123.951 -72.292 1.00 34.84 C ATOM 314 CD1 ILE A 95 73.316 125.123 -73.281 1.00 36.54 C ATOM 315 N MET A 96 69.513 126.264 -69.829 1.00 35.99 N ATOM 316 CA MET A 96 68.189 126.155 -69.201 1.00 36.45 C ATOM 317 C MET A 96 67.210 125.268 -69.973 1.00 36.06 C ATOM 318 O MET A 96 67.020 125.443 -71.181 1.00 40.55 O ATOM 319 CB MET A 96 67.561 127.531 -69.019 1.00 36.90 C ATOM 320 CG MET A 96 66.367 127.542 -68.093 1.00 41.97 C ATOM 321 SD MET A 96 66.764 127.170 -66.354 1.00 39.60 S ATOM 322 CE MET A 96 67.595 128.687 -65.861 1.00 44.50 C ATOM 323 N LEU A 97 66.592 124.322 -69.274 1.00 33.66 N ATOM 324 CA LEU A 97 65.543 123.499 -69.863 1.00 38.99 C ATOM 325 C LEU A 97 64.173 123.897 -69.319 1.00 37.68 C ATOM 326 O LEU A 97 63.989 124.055 -68.105 1.00 36.97 O ATOM 327 CB LEU A 97 65.795 122.014 -69.599 1.00 36.74 C ATOM 328 CG LEU A 97 67.022 121.358 -70.236 1.00 38.08 C ATOM 329 CD1 LEU A 97 67.013 119.844 -69.990 1.00 41.66 C ATOM 330 CD2 LEU A 97 67.104 121.653 -71.724 1.00 35.81 C ATOM 331 N THR A 98 63.218 124.066 -70.223 1.00 38.41 N ATOM 332 CA THR A 98 61.849 124.344 -69.825 1.00 45.27 C ATOM 333 C THR A 98 60.913 123.236 -70.308 1.00 46.66 C ATOM 334 O THR A 98 60.970 122.829 -71.475 1.00 47.70 O ATOM 335 CB THR A 98 61.376 125.705 -70.360 1.00 46.84 C ATOM 336 OG1 THR A 98 62.329 126.715 -70.004 1.00 45.27 O ATOM 337 CG2 THR A 98 60.033 126.067 -69.759 1.00 50.17 C ATOM 338 N PHE A 99 60.078 122.732 -69.400 1.00 45.82 N ATOM 339 CA PHE A 99 59.042 121.762 -69.758 1.00 43.88 C ATOM 340 C PHE A 99 57.684 122.359 -69.449 1.00 45.72 C ATOM 341 O PHE A 99 57.529 123.082 -68.467 1.00 49.25 O ATOM 342 CB PHE A 99 59.190 120.453 -68.978 1.00 40.46 C ATOM 343 CG PHE A 99 60.469 119.718 -69.247 1.00 41.30 C ATOM 344 CD1 PHE A 99 61.671 120.180 -68.726 1.00 40.03 C ATOM 345 CD2 PHE A 99 60.470 118.551 -69.994 1.00 35.02 C ATOM 346 CE1 PHE A 99 62.854 119.496 -68.962 1.00 39.65 C ATOM 347 CE2 PHE A 99 61.654 117.860 -70.231 1.00 40.52 C ATOM 348 CZ PHE A 99 62.848 118.334 -69.717 1.00 36.03 C ATOM 349 N TRP A 100 56.701 122.070 -70.290 1.00 49.27 N ATOM 350 CA TRP A 100 55.332 122.481 -70.003 1.00 54.39 C ATOM 351 C TRP A 100 54.307 121.548 -70.659 1.00 57.25 C ATOM 352 O TRP A 100 54.592 120.934 -71.695 1.00 54.26 O ATOM 353 CB TRP A 100 55.100 123.970 -70.325 1.00 56.05 C ATOM 354 CG TRP A 100 55.220 124.368 -71.768 1.00 58.96 C ATOM 355 CD1 TRP A 100 54.208 124.789 -72.587 1.00 62.36 C ATOM 356 CD2 TRP A 100 56.416 124.421 -72.555 1.00 60.48 C ATOM 357 NE1 TRP A 100 54.698 125.085 -73.839 1.00 61.23 N ATOM 358 CE2 TRP A 100 56.056 124.866 -73.847 1.00 61.61 C ATOM 359 CE3 TRP A 100 57.765 124.128 -72.301 1.00 53.64 C ATOM 360 CZ2 TRP A 100 56.982 125.024 -74.877 1.00 59.62 C ATOM 361 CZ3 TRP A 100 58.687 124.285 -73.327 1.00 51.69 C ATOM 362 CH2 TRP A 100 58.291 124.729 -74.598 1.00 52.25 C ATOM 363 N PRO A 101 53.121 121.417 -70.031 1.00 60.00 N ATOM 364 CA PRO A 101 52.074 120.439 -70.370 1.00 56.12 C ATOM 365 C PRO A 101 51.243 120.816 -71.598 1.00 60.23 C ATOM 366 O PRO A 101 51.080 122.001 -71.884 1.00 64.11 O ATOM 367 CB PRO A 101 51.157 120.463 -69.140 1.00 54.03 C ATOM 368 CG PRO A 101 51.800 121.397 -68.142 1.00 55.14 C ATOM 369 CD PRO A 101 52.727 122.269 -68.897 1.00 55.54 C ATOM 370 N SER A 102 50.705 119.818 -72.296 1.00 61.59 N ATOM 371 CA SER A 102 49.776 120.065 -73.403 1.00 65.67 C ATOM 372 C SER A 102 48.315 120.005 -72.960 1.00 69.38 C ATOM 373 O SER A 102 47.769 118.926 -72.749 1.00 71.11 O ATOM 374 CB SER A 102 49.985 119.044 -74.522 1.00 65.26 C ATOM 375 OG SER A 102 49.518 117.760 -74.131 1.00 67.21 O ATOM 376 N VAL A 103 47.681 121.165 -72.829 1.00 73.83 N ATOM 377 CA VAL A 103 46.259 121.222 -72.511 1.00 73.69 C ATOM 378 C VAL A 103 45.438 121.327 -73.788 1.00 79.49 C ATOM 379 O VAL A 103 45.628 122.249 -74.583 1.00 83.27 O ATOM 380 CB VAL A 103 45.932 122.427 -71.622 1.00 75.89 C ATOM 381 CG1 VAL A 103 46.482 122.218 -70.219 1.00 71.37 C ATOM 382 CG2 VAL A 103 46.487 123.701 -72.243 1.00 76.37 C ATOM 383 N GLY A 104 44.517 120.391 -73.986 1.00 77.51 N ATOM 384 CA GLY A 104 43.751 120.360 -75.216 1.00 77.61 C ATOM 385 C GLY A 104 44.569 119.752 -76.338 1.00 84.47 C ATOM 386 O GLY A 104 45.545 119.048 -76.087 1.00 88.77 O ATOM 387 N GLU A 105 44.175 120.027 -77.578 1.00 93.01 N ATOM 388 CA GLU A 105 44.843 119.458 -78.749 1.00 97.41 C ATOM 389 C GLU A 105 45.901 120.408 -79.303 1.00 97.63 C ATOM 390 O GLU A 105 45.591 121.546 -79.677 1.00100.22 O ATOM 391 CB GLU A 105 43.816 119.098 -79.834 1.00101.03 C ATOM 392 CG GLU A 105 42.783 120.191 -80.108 1.00109.67 C ATOM 393 CD GLU A 105 41.565 119.681 -80.862 1.00110.15 C ATOM 394 OE1 GLU A 105 40.762 120.519 -81.335 1.00109.13 O ATOM 395 OE2 GLU A 105 41.410 118.445 -80.977 1.00103.10 O ATOM 396 N ARG A 106 47.144 119.932 -79.355 1.00 90.78 N ATOM 397 CA ARG A 106 48.278 120.762 -79.760 1.00 87.29 C ATOM 398 C ARG A 106 48.158 122.192 -79.229 1.00 84.95 C ATOM 399 O ARG A 106 48.252 123.159 -79.986 1.00 76.58 O ATOM 400 CB ARG A 106 48.439 120.776 -81.282 1.00 92.59 C ATOM 401 CG ARG A 106 49.756 121.382 -81.758 1.00 87.90 C ATOM 402 CD ARG A 106 49.882 121.357 -83.281 1.00 92.15 C ATOM 403 NE ARG A 106 49.813 119.999 -83.825 1.00 97.48 N ATOM 404 CZ ARG A 106 48.736 119.483 -84.416 1.00101.48 C ATOM 405 NH1 ARG A 106 47.630 120.211 -84.550 1.00100.13 N ATOM 406 NH2 ARG A 106 48.763 118.239 -84.879 1.00102.79 N ATOM 407 N LYS A 107 47.920 122.311 -77.927 1.00 81.89 N ATOM 408 CA LYS A 107 47.961 123.597 -77.242 1.00 76.04 C ATOM 409 C LYS A 107 48.575 123.324 -75.877 1.00 73.35 C ATOM 410 O LYS A 107 48.277 122.303 -75.259 1.00 78.07 O ATOM 411 CB LYS A 107 46.558 124.190 -77.111 1.00 76.22 C ATOM 412 CG LYS A 107 46.519 125.719 -77.059 1.00 76.35 C ATOM 413 CD LYS A 107 46.673 126.261 -75.642 1.00 73.75 C ATOM 414 CE LYS A 107 45.373 126.137 -74.852 1.00 76.88 C ATOM 415 NZ LYS A 107 45.511 126.646 -73.453 1.00 80.14 N ATOM 416 N TYR A 108 49.450 124.207 -75.413 1.00 68.39 N ATOM 417 CA TYR A 108 50.213 123.916 -74.202 1.00 65.04 C ATOM 418 C TYR A 108 50.054 124.976 -73.127 1.00 66.51 C ATOM 419 O TYR A 108 49.926 126.165 -73.426 1.00 70.42 O ATOM 420 CB TYR A 108 51.692 123.748 -74.537 1.00 64.07 C ATOM 421 CG TYR A 108 51.982 122.644 -75.525 1.00 56.02 C ATOM 422 CD1 TYR A 108 51.717 122.811 -76.873 1.00 56.20 C ATOM 423 CD2 TYR A 108 52.538 121.439 -75.109 1.00 54.55 C ATOM 424 CE1 TYR A 108 51.987 121.810 -77.775 1.00 57.75 C ATOM 425 CE2 TYR A 108 52.814 120.433 -76.007 1.00 50.06 C ATOM 426 CZ TYR A 108 52.535 120.626 -77.337 1.00 51.69 C ATOM 427 OH TYR A 108 52.805 119.635 -78.241 1.00 54.42 O ATOM 428 N ASP A 109 50.087 124.540 -71.872 1.00 68.83 N ATOM 429 CA ASP A 109 49.843 125.434 -70.742 1.00 69.94 C ATOM 430 C ASP A 109 51.135 126.025 -70.142 1.00 68.42 C ATOM 431 O ASP A 109 51.689 125.486 -69.183 1.00 64.82 O ATOM 432 CB ASP A 109 49.017 124.712 -69.675 1.00 60.06 C ATOM 433 CG ASP A 109 48.433 125.663 -68.657 1.00 74.71 C ATOM 434 OD1 ASP A 109 47.581 125.223 -67.854 1.00 77.56 O ATOM 435 OD2 ASP A 109 48.829 126.853 -68.665 1.00 76.53 O ATOM 436 N TRP A 110 51.588 127.141 -70.715 1.00 65.33 N ATOM 437 CA TRP A 110 52.860 127.776 -70.363 1.00 63.11 C ATOM 438 C TRP A 110 52.902 128.173 -68.892 1.00 65.15 C ATOM 439 O TRP A 110 53.980 128.335 -68.317 1.00 66.09 O ATOM 440 CB TRP A 110 53.095 129.005 -71.254 1.00 62.07 C ATOM 441 CG TRP A 110 54.385 129.733 -71.009 1.00 65.89 C ATOM 442 CD1 TRP A 110 54.548 130.930 -70.358 1.00 64.66 C ATOM 443 CD2 TRP A 110 55.697 129.324 -71.425 1.00 64.72 C ATOM 444 NE1 TRP A 110 55.878 131.281 -70.339 1.00 64.92 N ATOM 445 CE2 TRP A 110 56.602 130.314 -70.985 1.00 63.36 C ATOM 446 CE3 TRP A 110 56.190 128.214 -72.121 1.00 63.72 C ATOM 447 CZ2 TRP A 110 57.975 130.226 -71.222 1.00 58.83 C ATOM 448 CZ3 TRP A 110 57.555 128.130 -72.352 1.00 58.55 C ATOM 449 CH2 TRP A 110 58.429 129.131 -71.907 1.00 58.37 C ATOM 450 N GLU A 111 51.726 128.333 -68.288 1.00 63.64 N ATOM 451 CA GLU A 111 51.635 128.668 -66.871 1.00 66.33 C ATOM 452 C GLU A 111 52.174 127.522 -66.005 1.00 63.75 C ATOM 453 O GLU A 111 52.672 127.752 -64.903 1.00 63.77 O ATOM 454 CB GLU A 111 50.182 128.974 -66.468 1.00 75.49 C ATOM 455 CG GLU A 111 49.473 130.065 -67.280 1.00 79.53 C ATOM 456 CD GLU A 111 49.930 131.466 -66.912 1.00 88.20 C ATOM 457 OE1 GLU A 111 51.107 131.626 -66.508 1.00 81.53 O ATOM 458 OE2 GLU A 111 49.110 132.407 -67.031 1.00 95.67 O ATOM 459 N LYS A 112 52.067 126.291 -66.503 1.00 59.81 N ATOM 460 CA LYS A 112 52.472 125.111 -65.738 1.00 58.48 C ATOM 461 C LYS A 112 53.901 124.646 -66.029 1.00 52.86 C ATOM 462 O LYS A 112 54.203 123.449 -65.938 1.00 55.32 O ATOM 463 CB LYS A 112 51.509 123.946 -65.999 1.00 62.93 C ATOM 464 CG LYS A 112 50.371 123.829 -64.996 1.00 66.82 C ATOM 465 CD LYS A 112 49.258 124.818 -65.287 1.00 72.80 C ATOM 466 CE LYS A 112 48.599 125.305 -64.000 1.00 81.43 C ATOM 467 NZ LYS A 112 47.945 126.637 -64.216 1.00 82.43 N ATOM 468 N ARG A 113 54.784 125.572 -66.380 1.00 53.73 N ATOM 469 CA ARG A 113 56.125 125.164 -66.771 1.00 52.44 C ATOM 470 C ARG A 113 57.019 124.880 -65.577 1.00 49.80 C ATOM 471 O ARG A 113 56.823 125.416 -64.481 1.00 51.43 O ATOM 472 CB ARG A 113 56.774 126.212 -67.661 1.00 51.87 C ATOM 473 CG ARG A 113 56.870 127.560 -67.008 1.00 56.59 C ATOM 474 CD ARG A 113 57.370 128.591 -67.980 1.00 59.52 C ATOM 475 NE ARG A 113 57.626 129.858 -67.309 1.00 62.79 N ATOM 476 CZ ARG A 113 56.699 130.786 -67.103 1.00 66.60 C ATOM 477 NH1 ARG A 113 55.453 130.579 -67.514 1.00 65.20 N ATOM 478 NH2 ARG A 113 57.019 131.918 -66.486 1.00 64.43 N ATOM 479 N GLN A 114 58.006 124.025 -65.804 1.00 46.40 N ATOM 480 CA GLN A 114 59.043 123.774 -64.819 1.00 46.73 C ATOM 481 C GLN A 114 60.389 123.898 -65.510 1.00 46.18 C ATOM 482 O GLN A 114 60.532 123.552 -66.694 1.00 41.40 O ATOM 483 CB GLN A 114 58.873 122.389 -64.189 1.00 44.56 C ATOM 484 CG GLN A 114 57.491 122.145 -63.590 1.00 46.14 C ATOM 485 CD GLN A 114 57.301 122.791 -62.225 1.00 46.90 C ATOM 486 OE1 GLN A 114 58.171 123.514 -61.737 1.00 44.46 O ATOM 487 NE2 GLN A 114 56.156 122.525 -61.599 1.00 43.50 N ATOM 488 N LEU A 115 61.368 124.403 -64.766 1.00 43.45 N ATOM 489 CA LEU A 115 62.697 124.663 -65.301 1.00 40.38 C ATOM 490 C LEU A 115 63.742 123.747 -64.683 1.00 40.79 C ATOM 491 O LEU A 115 63.636 123.360 -63.521 1.00 35.90 O ATOM 492 CB LEU A 115 63.109 126.109 -65.027 1.00 40.46 C ATOM 493 CG LEU A 115 62.193 127.260 -65.423 1.00 40.84 C ATOM 494 CD1 LEU A 115 62.959 128.548 -65.243 1.00 41.70 C ATOM 495 CD2 LEU A 115 61.718 127.112 -66.856 1.00 45.58 C ATOM 496 N PHE A 116 64.767 123.434 -65.468 1.00 34.82 N ATOM 497 CA PHE A 116 65.902 122.667 -64.986 1.00 36.98 C ATOM 498 C PHE A 116 67.196 123.219 -65.586 1.00 36.60 C ATOM 499 O PHE A 116 67.345 123.261 -66.803 1.00 36.50 O ATOM 500 CB PHE A 116 65.734 121.190 -65.355 1.00 36.85 C ATOM 501 CG PHE A 116 66.644 120.267 -64.596 1.00 33.71 C ATOM 502 CD1 PHE A 116 66.211 119.647 -63.433 1.00 38.34 C ATOM 503 CD2 PHE A 116 67.928 120.015 -65.044 1.00 36.00 C ATOM 504 CE1 PHE A 116 67.036 118.798 -62.730 1.00 35.49 C ATOM 505 CE2 PHE A 116 68.762 119.164 -64.344 1.00 39.97 C ATOM 506 CZ PHE A 116 68.310 118.553 -63.181 1.00 37.08 C ATOM 507 N ALA A 117 68.138 123.618 -64.733 1.00 36.42 N ATOM 508 CA ALA A 117 69.365 124.273 -65.185 1.00 31.98 C ATOM 509 C ALA A 117 70.550 123.321 -65.367 1.00 34.78 C ATOM 510 O ALA A 117 71.207 122.948 -64.400 1.00 36.33 O ATOM 511 CB ALA A 117 69.736 125.391 -64.223 1.00 34.15 C ATOM 512 N LEU A 118 70.839 122.947 -66.609 1.00 35.34 N ATOM 513 CA LEU A 118 72.001 122.108 -66.891 1.00 30.70 C ATOM 514 C LEU A 118 73.303 122.827 -66.579 1.00 34.62 C ATOM 515 O LEU A 118 73.521 123.963 -67.003 1.00 37.08 O ATOM 516 CB LEU A 118 72.007 121.655 -68.348 1.00 34.30 C ATOM 517 CG LEU A 118 70.913 120.666 -68.741 1.00 37.30 C ATOM 518 CD1 LEU A 118 71.127 120.186 -70.160 1.00 29.26 C ATOM 519 CD2 LEU A 118 70.883 119.495 -67.763 1.00 38.08 C ATOM 520 N SER A 119 74.171 122.150 -65.840 1.00 35.60 N ATOM 521 CA SER A 119 75.462 122.696 -65.456 1.00 35.32 C ATOM 522 C SER A 119 76.510 122.333 -66.502 1.00 38.31 C ATOM 523 O SER A 119 76.302 121.429 -67.315 1.00 38.12 O ATOM 524 CB SER A 119 75.876 122.131 -64.096 1.00 37.60 C ATOM 525 OG SER A 119 76.026 120.719 -64.155 1.00 41.80 O ATOM 526 N ALA A 120 77.638 123.033 -66.482 1.00 33.50 N ATOM 527 CA ALA A 120 78.720 122.729 -67.404 1.00 36.90 C ATOM 528 C ALA A 120 78.916 121.220 -67.476 1.00 36.42 C ATOM 529 O ALA A 120 78.880 120.624 -68.555 1.00 35.50 O ATOM 530 CB ALA A 120 80.009 123.421 -66.968 1.00 34.66 C ATOM 531 N THR A 121 79.109 120.603 -66.317 1.00 35.05 N ATOM 532 CA THR A 121 79.365 119.166 -66.250 1.00 37.89 C ATOM 533 C THR A 121 78.227 118.330 -66.833 1.00 35.12 C ATOM 534 O THR A 121 78.464 117.411 -67.610 1.00 36.98 O ATOM 535 CB THR A 121 79.643 118.710 -64.811 1.00 37.54 C ATOM 536 OG1 THR A 121 80.724 119.482 -64.266 1.00 40.96 O ATOM 537 CG2 THR A 121 80.007 117.241 -64.797 1.00 37.67 C ATOM 538 N GLU A 122 76.994 118.661 -66.462 1.00 35.14 N ATOM 539 CA GLU A 122 75.830 117.923 -66.938 1.00 33.75 C ATOM 540 C GLU A 122 75.705 117.983 -68.461 1.00 37.44 C ATOM 541 O GLU A 122 75.453 116.970 -69.107 1.00 38.75 O ATOM 542 CB GLU A 122 74.564 118.413 -66.228 1.00 35.96 C ATOM 543 CG GLU A 122 74.517 117.962 -64.773 1.00 40.11 C ATOM 544 CD GLU A 122 73.431 118.623 -63.944 1.00 41.29 C ATOM 545 OE1 GLU A 122 73.125 118.087 -62.854 1.00 45.79 O ATOM 546 OE2 GLU A 122 72.890 119.666 -64.366 1.00 39.85 O ATOM 547 N VAL A 123 75.895 119.166 -69.036 1.00 36.81 N ATOM 548 CA VAL A 123 75.969 119.290 -70.485 1.00 35.96 C ATOM 549 C VAL A 123 77.080 118.377 -70.997 1.00 38.20 C ATOM 550 O VAL A 123 76.895 117.647 -71.969 1.00 39.52 O ATOM 551 CB VAL A 123 76.240 120.756 -70.932 1.00 39.48 C ATOM 552 CG1 VAL A 123 76.386 120.845 -72.437 1.00 33.08 C ATOM 553 CG2 VAL A 123 75.132 121.684 -70.456 1.00 36.44 C ATOM 554 N GLY A 124 78.233 118.412 -70.334 1.00 37.92 N ATOM 555 CA GLY A 124 79.353 117.567 -70.717 1.00 41.21 C ATOM 556 C GLY A 124 78.973 116.100 -70.712 1.00 41.53 C ATOM 557 O GLY A 124 79.406 115.326 -71.567 1.00 45.59 O ATOM 558 N SER A 125 78.154 115.726 -69.737 1.00 38.87 N ATOM 559 CA SER A 125 77.630 114.370 -69.616 1.00 40.95 C ATOM 560 C SER A 125 76.630 114.030 -70.721 1.00 40.54 C ATOM 561 O SER A 125 76.677 112.957 -71.305 1.00 49.25 O ATOM 562 CB SER A 125 76.976 114.200 -68.245 1.00 45.51 C ATOM 563 OG SER A 125 76.064 113.123 -68.241 1.00 48.81 O ATOM 564 N LEU A 126 75.732 114.960 -71.010 1.00 42.66 N ATOM 565 CA LEU A 126 74.738 114.784 -72.065 1.00 42.59 C ATOM 566 C LEU A 126 75.332 114.607 -73.462 1.00 44.84 C ATOM 567 O LEU A 126 74.901 113.728 -74.206 1.00 49.46 O ATOM 568 CB LEU A 126 73.754 115.961 -72.056 1.00 42.29 C ATOM 569 CG LEU A 126 72.481 115.900 -72.903 1.00 42.22 C ATOM 570 CD1 LEU A 126 71.419 116.757 -72.240 1.00 37.77 C ATOM 571 CD2 LEU A 126 72.725 116.358 -74.342 1.00 35.13 C ATOM 572 N ILE A 127 76.306 115.438 -73.831 1.00 44.32 N ATOM 573 CA ILE A 127 76.837 115.393 -75.195 1.00 46.25 C ATOM 574 C ILE A 127 77.665 114.138 -75.460 1.00 51.12 C ATOM 575 O ILE A 127 77.874 113.752 -76.617 1.00 49.62 O ATOM 576 CB ILE A 127 77.711 116.623 -75.538 1.00 49.16 C ATOM 577 CG1 ILE A 127 78.990 116.633 -74.706 1.00 41.44 C ATOM 578 CG2 ILE A 127 76.942 117.933 -75.362 1.00 44.68 C ATOM 579 CD1 ILE A 127 79.813 117.869 -74.928 1.00 43.95 C ATOM 580 N SER A 128 78.140 113.503 -74.393 1.00 46.59 N ATOM 581 CA SER A 128 79.032 112.360 -74.543 1.00 46.67 C ATOM 582 C SER A 128 78.306 111.016 -74.435 1.00 53.79 C ATOM 583 O SER A 128 78.940 109.960 -74.448 1.00 51.77 O ATOM 584 CB SER A 128 80.175 112.442 -73.529 1.00 50.11 C ATOM 585 OG SER A 128 79.691 112.527 -72.197 1.00 53.60 O ATOM 586 N MET A 129 76.979 111.062 -74.338 1.00 53.50 N ATOM 587 CA MET A 129 76.177 109.849 -74.244 1.00 48.91 C ATOM 588 C MET A 129 76.176 109.049 -75.523 1.00 54.34 C ATOM 589 O MET A 129 75.937 109.587 -76.606 1.00 55.83 O ATOM 590 CB MET A 129 74.722 110.179 -73.946 1.00 48.86 C ATOM 591 CG MET A 129 74.470 110.850 -72.635 1.00 48.69 C ATOM 592 SD MET A 129 72.706 111.153 -72.520 1.00 51.33 S ATOM 593 CE MET A 129 72.129 109.507 -72.100 1.00 52.55 C ATOM 594 N GLY A 130 76.396 107.747 -75.382 1.00 57.13 N ATOM 595 CA GLY A 130 76.158 106.824 -76.469 1.00 59.37 C ATOM 596 C GLY A 130 74.667 106.599 -76.674 1.00 61.86 C ATOM 597 O GLY A 130 73.838 106.986 -75.841 1.00 54.62 O ATOM 598 N THR A 131 74.335 105.965 -77.795 1.00 64.77 N ATOM 599 CA THR A 131 72.957 105.659 -78.141 1.00 63.30 C ATOM 600 C THR A 131 72.323 104.743 -77.098 1.00 63.23 C ATOM 601 O THR A 131 71.104 104.732 -76.928 1.00 59.95 O ATOM 602 CB THR A 131 72.885 104.973 -79.510 1.00 66.08 C ATOM 603 OG1 THR A 131 73.779 105.632 -80.415 1.00 71.08 O ATOM 604 CG2 THR A 131 71.467 105.035 -80.063 1.00 69.95 C ATOM 605 N ARG A 132 73.155 103.983 -76.395 1.00 61.17 N ATOM 606 CA ARG A 132 72.652 103.024 -75.421 1.00 64.51 C ATOM 607 C ARG A 132 72.711 103.553 -73.988 1.00 65.38 C ATOM 608 O ARG A 132 72.175 102.929 -73.065 1.00 65.81 O ATOM 609 CB ARG A 132 73.433 101.710 -75.512 1.00 69.79 C ATOM 610 CG ARG A 132 73.209 100.915 -76.799 1.00 74.58 C ATOM 611 CD ARG A 132 71.862 100.184 -76.787 1.00 83.11 C ATOM 612 NE ARG A 132 70.733 101.105 -76.929 1.00 79.00 N ATOM 613 CZ ARG A 132 70.252 101.527 -78.098 1.00 83.60 C ATOM 614 NH1 ARG A 132 70.801 101.109 -79.239 1.00 84.87 N ATOM 615 NH2 ARG A 132 69.222 102.369 -78.129 1.00 77.68 N ATOM 616 N ASP A 133 73.360 104.697 -73.798 1.00 61.69 N ATOM 617 CA ASP A 133 73.590 105.213 -72.451 1.00 60.44 C ATOM 618 C ASP A 133 72.352 105.896 -71.873 1.00 56.52 C ATOM 619 O ASP A 133 71.446 106.280 -72.605 1.00 56.03 O ATOM 620 CB ASP A 133 74.788 106.167 -72.455 1.00 57.79 C ATOM 621 CG ASP A 133 76.104 105.444 -72.704 1.00 63.14 C ATOM 622 OD1 ASP A 133 76.212 104.254 -72.327 1.00 68.99 O ATOM 623 OD2 ASP A 133 77.029 106.057 -73.274 1.00 58.98 O ATOM 624 N SER A 134 72.301 106.024 -70.554 1.00 49.70 N ATOM 625 CA SER A 134 71.279 106.849 -69.924 1.00 52.64 C ATOM 626 C SER A 134 71.843 107.532 -68.690 1.00 53.67 C ATOM 627 O SER A 134 72.741 107.000 -68.034 1.00 57.43 O ATOM 628 CB SER A 134 70.035 106.032 -69.567 1.00 52.66 C ATOM 629 OG SER A 134 70.295 105.126 -68.517 1.00 53.19 O ATOM 630 N SER A 135 71.324 108.716 -68.380 1.00 53.00 N ATOM 631 CA SER A 135 71.762 109.448 -67.192 1.00 55.59 C ATOM 632 C SER A 135 70.586 110.039 -66.423 1.00 50.69 C ATOM 633 O SER A 135 69.468 110.116 -66.941 1.00 50.54 O ATOM 634 CB SER A 135 72.764 110.548 -67.565 1.00 51.87 C ATOM 635 OG SER A 135 72.240 111.399 -68.569 1.00 49.93 O ATOM 636 N GLU A 136 70.842 110.447 -65.183 1.00 48.57 N ATOM 637 CA GLU A 136 69.823 111.096 -64.369 1.00 44.69 C ATOM 638 C GLU A 136 70.450 112.122 -63.420 1.00 44.80 C ATOM 639 O GLU A 136 71.380 111.799 -62.682 1.00 51.00 O ATOM 640 CB GLU A 136 69.013 110.050 -63.596 1.00 47.84 C ATOM 641 CG GLU A 136 67.835 110.632 -62.805 1.00 58.81 C ATOM 642 CD GLU A 136 66.726 109.614 -62.524 1.00 63.96 C ATOM 643 OE1 GLU A 136 65.601 110.053 -62.178 1.00 57.95 O ATOM 644 OE2 GLU A 136 66.976 108.388 -62.651 1.00 68.76 O ATOM 645 N PHE A 137 69.943 113.356 -63.455 1.00 46.28 N ATOM 646 CA PHE A 137 70.443 114.444 -62.598 1.00 43.32 C ATOM 647 C PHE A 137 69.422 114.851 -61.534 1.00 39.54 C ATOM 648 O PHE A 137 68.222 114.881 -61.793 1.00 41.76 O ATOM 649 CB PHE A 137 70.826 115.676 -63.431 1.00 39.85 C ATOM 650 CG PHE A 137 71.584 115.355 -64.688 1.00 36.72 C ATOM 651 CD1 PHE A 137 72.695 114.528 -64.658 1.00 40.01 C ATOM 652 CD2 PHE A 137 71.193 115.895 -65.900 1.00 40.38 C ATOM 653 CE1 PHE A 137 73.399 114.236 -65.823 1.00 41.21 C ATOM 654 CE2 PHE A 137 71.891 115.608 -67.075 1.00 42.31 C ATOM 655 CZ PHE A 137 72.993 114.778 -67.037 1.00 39.01 C ATOM 656 N PHE A 138 69.907 115.176 -60.342 1.00 40.05 N ATOM 657 CA PHE A 138 69.041 115.561 -59.229 1.00 43.34 C ATOM 658 C PHE A 138 69.396 116.952 -58.744 1.00 39.48 C ATOM 659 O PHE A 138 70.567 117.245 -58.506 1.00 44.95 O ATOM 660 CB PHE A 138 69.183 114.563 -58.077 1.00 45.88 C ATOM 661 CG PHE A 138 68.753 113.177 -58.433 1.00 45.25 C ATOM 662 CD1 PHE A 138 69.604 112.329 -59.131 1.00 47.72 C ATOM 663 CD2 PHE A 138 67.491 112.722 -58.084 1.00 45.22 C ATOM 664 CE1 PHE A 138 69.201 111.042 -59.474 1.00 47.31 C ATOM 665 CE2 PHE A 138 67.080 111.440 -58.420 1.00 50.64 C ATOM 666 CZ PHE A 138 67.936 110.598 -59.115 1.00 49.39 C ATOM 667 N HIS A 139 68.390 117.807 -58.595 1.00 39.61 N ATOM 668 CA HIS A 139 68.619 119.196 -58.202 1.00 41.71 C ATOM 669 C HIS A 139 67.718 119.623 -57.058 1.00 43.77 C ATOM 670 O HIS A 139 66.583 119.168 -56.942 1.00 43.25 O ATOM 671 CB HIS A 139 68.391 120.140 -59.388 1.00 39.56 C ATOM 672 CG HIS A 139 69.490 120.115 -60.411 1.00 41.00 C ATOM 673 ND1 HIS A 139 69.613 121.072 -61.389 1.00 40.22 N ATOM 674 CD2 HIS A 139 70.515 119.251 -60.594 1.00 40.42 C ATOM 675 CE1 HIS A 139 70.661 120.795 -62.146 1.00 40.01 C ATOM 676 NE2 HIS A 139 71.227 119.694 -61.683 1.00 39.86 N ATOM 677 N ASP A 140 68.235 120.512 -56.221 1.00 49.39 N ATOM 678 CA ASP A 140 67.435 121.168 -55.200 1.00 51.96 C ATOM 679 C ASP A 140 67.484 122.670 -55.444 1.00 50.87 C ATOM 680 O ASP A 140 68.474 123.318 -55.111 1.00 52.99 O ATOM 681 CB ASP A 140 67.970 120.837 -53.807 1.00 55.12 C ATOM 682 CG ASP A 140 67.145 121.469 -52.697 1.00 60.55 C ATOM 683 OD1 ASP A 140 66.201 122.231 -53.004 1.00 56.20 O ATOM 684 OD2 ASP A 140 67.445 121.202 -51.513 1.00 64.79 O ATOM 685 N PRO A 141 66.409 123.227 -56.025 1.00 50.77 N ATOM 686 CA PRO A 141 66.335 124.643 -56.399 1.00 54.93 C ATOM 687 C PRO A 141 66.860 125.533 -55.276 1.00 57.29 C ATOM 688 O PRO A 141 67.680 126.429 -55.513 1.00 58.43 O ATOM 689 CB PRO A 141 64.830 124.878 -56.571 1.00 55.40 C ATOM 690 CG PRO A 141 64.272 123.556 -56.889 1.00 48.48 C ATOM 691 CD PRO A 141 65.100 122.563 -56.134 1.00 52.70 C ATOM 692 N SER A 142 66.387 125.268 -54.060 1.00 60.47 N ATOM 693 CA SER A 142 66.739 126.067 -52.890 1.00 63.71 C ATOM 694 C SER A 142 67.858 125.419 -52.074 1.00 61.43 C ATOM 695 O SER A 142 67.761 125.315 -50.853 1.00 59.69 O ATOM 696 CB SER A 142 65.505 126.278 -52.005 1.00 62.42 C ATOM 697 OG SER A 142 64.396 126.728 -52.767 1.00 60.97 O ATOM 698 N MET A 143 68.918 124.991 -52.754 1.00 60.69 N ATOM 699 CA MET A 143 70.052 124.342 -52.096 1.00 62.90 C ATOM 700 C MET A 143 70.853 125.333 -51.239 1.00 68.27 C ATOM 701 O MET A 143 70.977 126.512 -51.587 1.00 67.05 O ATOM 702 CB MET A 143 70.967 123.679 -53.133 1.00 58.68 C ATOM 703 CG MET A 143 71.886 122.614 -52.560 1.00 62.90 C ATOM 704 SD MET A 143 73.156 122.048 -53.713 1.00 68.18 S ATOM 705 CE MET A 143 73.355 120.350 -53.167 1.00 58.97 C ATOM 706 N LEU A 144 71.387 124.841 -50.120 1.00 71.11 N ATOM 707 CA LEU A 144 72.166 125.651 -49.175 1.00 73.65 C ATOM 708 C LEU A 144 71.407 126.834 -48.596 1.00 73.77 C ATOM 709 O LEU A 144 71.985 127.647 -47.872 1.00 78.65 O ATOM 710 CB LEU A 144 73.454 126.173 -49.814 1.00 64.98 C ATOM 711 CG LEU A 144 74.455 125.116 -50.251 1.00 65.36 C ATOM 712 CD1 LEU A 144 75.781 125.787 -50.536 1.00 61.18 C ATOM 713 CD2 LEU A 144 74.595 124.054 -49.169 1.00 68.37 C ATOM 714 N SER A 145 70.127 126.951 -48.921 1.00 72.25 N ATOM 715 CA SER A 145 69.358 128.084 -48.432 1.00 75.13 C ATOM 716 C SER A 145 68.403 127.655 -47.313 1.00 80.61 C ATOM 717 O SER A 145 68.355 126.481 -46.932 1.00 76.29 O ATOM 718 CB SER A 145 68.609 128.773 -49.575 1.00 69.75 C ATOM 719 OG SER A 145 67.408 128.091 -49.880 1.00 78.61 O ATOM 720 N SER A 146 67.654 128.618 -46.789 1.00 83.88 N ATOM 721 CA SER A 146 66.822 128.401 -45.611 1.00 85.14 C ATOM 722 C SER A 146 65.789 127.291 -45.790 1.00 80.59 C ATOM 723 O SER A 146 65.428 126.614 -44.827 1.00 80.72 O ATOM 724 CB SER A 146 66.121 129.707 -45.217 1.00 85.07 C ATOM 725 OG SER A 146 65.535 130.333 -46.350 1.00 82.69 O ATOM 726 N ASN A 147 65.311 127.112 -47.018 1.00 77.35 N ATOM 727 CA ASN A 147 64.217 126.175 -47.280 1.00 77.51 C ATOM 728 C ASN A 147 64.564 125.087 -48.308 1.00 75.14 C ATOM 729 O ASN A 147 63.900 124.936 -49.340 1.00 72.08 O ATOM 730 CB ASN A 147 62.922 126.922 -47.653 1.00 80.29 C ATOM 731 CG ASN A 147 63.124 127.975 -48.746 1.00 80.88 C ATOM 732 OD1 ASN A 147 64.227 128.159 -49.269 1.00 84.21 O ATOM 733 ND2 ASN A 147 62.045 128.674 -49.092 1.00 78.09 N ATOM 734 N ALA A 148 65.606 124.323 -47.990 1.00 69.87 N ATOM 735 CA ALA A 148 66.106 123.258 -48.845 1.00 62.10 C ATOM 736 C ALA A 148 65.422 121.932 -48.530 1.00 61.90 C ATOM 737 O ALA A 148 64.745 121.803 -47.512 1.00 66.27 O ATOM 738 CB ALA A 148 67.613 123.127 -48.672 1.00 62.77 C ATOM 739 N GLY A 149 65.616 120.944 -49.400 1.00 59.62 N ATOM 740 CA GLY A 149 65.014 119.633 -49.225 1.00 60.03 C ATOM 741 C GLY A 149 63.519 119.615 -49.514 1.00 63.38 C ATOM 742 O GLY A 149 62.903 118.547 -49.618 1.00 59.29 O ATOM 743 N GLN A 150 62.937 120.805 -49.650 1.00 60.93 N ATOM 744 CA GLN A 150 61.501 120.949 -49.852 1.00 61.60 C ATOM 745 C GLN A 150 61.087 120.636 -51.284 1.00 56.02 C ATOM 746 O GLN A 150 60.141 119.880 -51.516 1.00 52.84 O ATOM 747 CB GLN A 150 61.058 122.358 -49.476 1.00 63.83 C ATOM 748 CG GLN A 150 61.275 122.688 -48.014 1.00 69.53 C ATOM 749 CD GLN A 150 61.018 124.155 -47.712 1.00 83.55 C ATOM 750 OE1 GLN A 150 60.903 124.984 -48.628 1.00 80.78 O ATOM 751 NE2 GLN A 150 60.932 124.488 -46.423 1.00 80.11 N ATOM 752 N VAL A 151 61.791 121.223 -52.243 1.00 48.72 N ATOM 753 CA VAL A 151 61.537 120.908 -53.641 1.00 52.55 C ATOM 754 C VAL A 151 62.684 120.056 -54.188 1.00 51.04 C ATOM 755 O VAL A 151 63.849 120.307 -53.873 1.00 50.80 O ATOM 756 CB VAL A 151 61.328 122.188 -54.485 1.00 52.36 C ATOM 757 CG1 VAL A 151 61.254 121.851 -55.957 1.00 45.14 C ATOM 758 CG2 VAL A 151 60.061 122.918 -54.038 1.00 48.05 C ATOM 759 N ARG A 152 62.348 119.037 -54.979 1.00 44.04 N ATOM 760 CA ARG A 152 63.354 118.135 -55.553 1.00 44.79 C ATOM 761 C ARG A 152 63.074 117.844 -57.022 1.00 43.56 C ATOM 762 O ARG A 152 62.028 117.272 -57.359 1.00 40.88 O ATOM 763 CB ARG A 152 63.424 116.809 -54.780 1.00 45.35 C ATOM 764 CG ARG A 152 64.290 115.750 -55.458 1.00 51.21 C ATOM 765 CD ARG A 152 64.413 114.452 -54.636 1.00 58.49 C ATOM 766 NE ARG A 152 63.260 113.555 -54.766 1.00 53.20 N ATOM 767 CZ ARG A 152 62.264 113.503 -53.883 1.00 47.75 C ATOM 768 NH1 ARG A 152 62.286 114.302 -52.820 1.00 37.48 N ATOM 769 NH2 ARG A 152 61.249 112.662 -54.060 1.00 41.89 N ATOM 770 N LYS A 153 64.008 118.237 -57.888 1.00 43.27 N ATOM 771 CA LYS A 153 63.870 118.005 -59.321 1.00 41.26 C ATOM 772 C LYS A 153 64.800 116.895 -59.768 1.00 39.33 C ATOM 773 O LYS A 153 65.915 116.771 -59.269 1.00 38.65 O ATOM 774 CB LYS A 153 64.200 119.272 -60.108 1.00 42.37 C ATOM 775 CG LYS A 153 63.304 120.458 -59.810 1.00 43.72 C ATOM 776 CD LYS A 153 63.708 121.642 -60.663 1.00 45.55 C ATOM 777 CE LYS A 153 62.979 122.909 -60.258 1.00 40.90 C ATOM 778 NZ LYS A 153 63.323 124.034 -61.165 1.00 39.66 N ATOM 779 N SER A 154 64.339 116.086 -60.713 1.00 39.14 N ATOM 780 CA SER A 154 65.208 115.098 -61.332 1.00 41.31 C ATOM 781 C SER A 154 64.961 115.063 -62.830 1.00 38.74 C ATOM 782 O SER A 154 63.815 115.035 -63.284 1.00 36.17 O ATOM 783 CB SER A 154 64.976 113.712 -60.734 1.00 42.43 C ATOM 784 OG SER A 154 63.905 113.067 -61.397 1.00 45.67 O ATOM 785 N LEU A 155 66.046 115.080 -63.593 1.00 39.13 N ATOM 786 CA LEU A 155 65.963 114.987 -65.038 1.00 36.97 C ATOM 787 C LEU A 155 66.630 113.694 -65.474 1.00 42.08 C ATOM 788 O LEU A 155 67.748 113.372 -65.053 1.00 40.22 O ATOM 789 CB LEU A 155 66.644 116.185 -65.694 1.00 39.60 C ATOM 790 CG LEU A 155 66.639 116.220 -67.220 1.00 40.32 C ATOM 791 CD1 LEU A 155 65.344 116.813 -67.738 1.00 38.29 C ATOM 792 CD2 LEU A 155 67.823 117.024 -67.695 1.00 42.36 C ATOM 793 N SER A 156 65.926 112.943 -66.308 1.00 44.94 N ATOM 794 CA SER A 156 66.412 111.655 -66.756 1.00 44.60 C ATOM 795 C SER A 156 66.412 111.597 -68.270 1.00 40.28 C ATOM 796 O SER A 156 65.492 112.081 -68.929 1.00 41.75 O ATOM 797 CB SER A 156 65.533 110.540 -66.196 1.00 45.04 C ATOM 798 OG SER A 156 64.210 110.667 -66.679 1.00 40.83 O ATOM 799 N ILE A 157 67.462 111.002 -68.811 1.00 42.92 N ATOM 800 CA ILE A 157 67.554 110.750 -70.234 1.00 49.17 C ATOM 801 C ILE A 157 67.823 109.259 -70.412 1.00 50.80 C ATOM 802 O ILE A 157 68.917 108.776 -70.109 1.00 52.07 O ATOM 803 CB ILE A 157 68.681 111.583 -70.882 1.00 48.03 C ATOM 804 CG1 ILE A 157 68.487 113.073 -70.581 1.00 51.90 C ATOM 805 CG2 ILE A 157 68.729 111.344 -72.380 1.00 48.60 C ATOM 806 CD1 ILE A 157 69.668 113.950 -70.982 1.00 44.29 C ATOM 807 N LYS A 158 66.805 108.530 -70.863 1.00 54.34 N ATOM 808 CA LYS A 158 66.932 107.097 -71.132 1.00 58.26 C ATOM 809 C LYS A 158 66.677 106.898 -72.619 1.00 57.62 C ATOM 810 O LYS A 158 65.777 107.530 -73.178 1.00 56.45 O ATOM 811 CB LYS A 158 65.887 106.289 -70.349 1.00 55.83 C ATOM 812 CG LYS A 158 65.384 106.933 -69.050 1.00 58.66 C ATOM 813 CD LYS A 158 64.138 106.217 -68.484 1.00 66.63 C ATOM 814 CE LYS A 158 62.848 106.544 -69.267 1.00 63.36 C ATOM 815 NZ LYS A 158 62.336 105.422 -70.122 1.00 62.42 N ATOM 816 N PRO A 159 67.467 106.034 -73.275 1.00 55.50 N ATOM 817 CA PRO A 159 67.167 105.679 -74.668 1.00 56.50 C ATOM 818 C PRO A 159 65.852 104.909 -74.700 1.00 59.29 C ATOM 819 O PRO A 159 65.596 104.212 -73.726 1.00 67.53 O ATOM 820 CB PRO A 159 68.322 104.732 -75.026 1.00 57.81 C ATOM 821 CG PRO A 159 68.732 104.148 -73.696 1.00 55.45 C ATOM 822 CD PRO A 159 68.664 105.332 -72.783 1.00 55.54 C ATOM 823 N ASN A 160 65.033 105.023 -75.745 1.00 58.94 N ATOM 824 CA ASN A 160 63.891 104.104 -75.865 1.00 75.42 C ATOM 825 C ASN A 160 64.254 102.796 -76.594 1.00 78.82 C ATOM 826 O ASN A 160 65.255 102.740 -77.315 1.00 75.86 O ATOM 827 CB ASN A 160 62.610 104.770 -76.433 1.00 71.20 C ATOM 828 CG ASN A 160 62.746 105.227 -77.881 1.00 69.36 C ATOM 829 OD1 ASN A 160 63.754 104.970 -78.537 1.00 74.23 O ATOM 830 ND2 ASN A 160 61.713 105.909 -78.387 1.00 66.12 N ATOM 831 N ALA A 161 63.454 101.751 -76.372 1.00 79.96 N ATOM 832 CA ALA A 161 63.675 100.433 -76.977 1.00 84.05 C ATOM 833 C ALA A 161 64.275 100.497 -78.385 1.00 86.99 C ATOM 834 O ALA A 161 65.380 99.998 -78.637 1.00 78.89 O ATOM 835 CB ALA A 161 62.368 99.661 -77.010 1.00 85.69 C ATOM 836 N ASP A 162 63.530 101.113 -79.296 1.00 86.53 N ATOM 837 CA ASP A 162 63.890 101.155 -80.709 1.00 84.46 C ATOM 838 C ASP A 162 65.298 101.720 -80.946 1.00 81.74 C ATOM 839 O ASP A 162 66.015 101.278 -81.850 1.00 77.47 O ATOM 840 CB ASP A 162 62.868 101.995 -81.483 1.00 80.97 C ATOM 841 CG ASP A 162 61.582 102.251 -80.690 1.00 86.55 C ATOM 842 OD1 ASP A 162 61.146 101.364 -79.913 1.00 86.39 O ATOM 843 OD2 ASP A 162 61.004 103.353 -80.851 1.00 85.26 O ATOM 844 N GLY A 163 65.694 102.697 -80.134 1.00 81.98 N ATOM 845 CA GLY A 163 66.948 103.386 -80.360 1.00 78.36 C ATOM 846 C GLY A 163 66.661 104.583 -81.240 1.00 74.84 C ATOM 847 O GLY A 163 67.578 105.223 -81.769 1.00 73.39 O ATOM 848 N SER A 164 65.370 104.878 -81.398 1.00 73.57 N ATOM 849 CA SER A 164 64.924 106.015 -82.199 1.00 77.28 C ATOM 850 C SER A 164 65.010 107.314 -81.406 1.00 72.64 C ATOM 851 O SER A 164 64.212 108.242 -81.620 1.00 71.03 O ATOM 852 CB SER A 164 63.495 105.801 -82.724 1.00 76.34 C ATOM 853 OG SER A 164 62.705 105.055 -81.814 1.00 77.52 O ATOM 854 N GLY A 165 65.977 107.367 -80.488 1.00 67.27 N ATOM 855 CA GLY A 165 66.176 108.532 -79.644 1.00 64.23 C ATOM 856 C GLY A 165 66.082 108.258 -78.151 1.00 60.52 C ATOM 857 O GLY A 165 66.534 107.211 -77.669 1.00 59.43 O ATOM 858 N TYR A 166 65.491 109.202 -77.419 1.00 48.39 N ATOM 859 CA TYR A 166 65.455 109.137 -75.962 1.00 46.90 C ATOM 860 C TYR A 166 64.114 109.600 -75.379 1.00 50.24 C ATOM 861 O TYR A 166 63.272 110.163 -76.089 1.00 54.33 O ATOM 862 CB TYR A 166 66.581 109.988 -75.355 1.00 49.60 C ATOM 863 CG TYR A 166 67.998 109.648 -75.783 1.00 48.14 C ATOM 864 CD1 TYR A 166 68.514 110.113 -76.996 1.00 49.00 C ATOM 865 CD2 TYR A 166 68.835 108.903 -74.954 1.00 47.86 C ATOM 866 CE1 TYR A 166 69.814 109.819 -77.381 1.00 50.14 C ATOM 867 CE2 TYR A 166 70.131 108.605 -75.328 1.00 50.32 C ATOM 868 CZ TYR A 166 70.614 109.067 -76.542 1.00 51.12 C ATOM 869 OH TYR A 166 71.899 108.775 -76.925 1.00 57.31 O ATOM 870 N PHE A 167 63.909 109.342 -74.088 1.00 49.45 N ATOM 871 CA PHE A 167 62.844 110.005 -73.344 1.00 50.38 C ATOM 872 C PHE A 167 63.500 110.964 -72.374 1.00 49.74 C ATOM 873 O PHE A 167 64.391 110.581 -71.612 1.00 48.74 O ATOM 874 CB PHE A 167 61.980 109.012 -72.576 1.00 51.17 C ATOM 875 CG PHE A 167 61.172 108.118 -73.455 1.00 62.45 C ATOM 876 CD1 PHE A 167 61.569 106.810 -73.694 1.00 64.07 C ATOM 877 CD2 PHE A 167 60.019 108.586 -74.060 1.00 57.30 C ATOM 878 CE1 PHE A 167 60.821 105.989 -74.509 1.00 60.21 C ATOM 879 CE2 PHE A 167 59.276 107.768 -74.879 1.00 51.59 C ATOM 880 CZ PHE A 167 59.678 106.471 -75.103 1.00 61.22 C ATOM 881 N ILE A 168 63.082 112.219 -72.418 1.00 45.83 N ATOM 882 CA ILE A 168 63.617 113.197 -71.502 1.00 47.06 C ATOM 883 C ILE A 168 62.474 113.622 -70.616 1.00 49.61 C ATOM 884 O ILE A 168 61.496 114.205 -71.089 1.00 50.51 O ATOM 885 CB ILE A 168 64.198 114.411 -72.246 1.00 49.47 C ATOM 886 CG1 ILE A 168 65.372 113.980 -73.129 1.00 47.22 C ATOM 887 CG2 ILE A 168 64.645 115.479 -71.263 1.00 45.07 C ATOM 888 CD1 ILE A 168 66.050 115.117 -73.843 1.00 39.91 C ATOM 889 N SER A 169 62.570 113.304 -69.332 1.00 46.59 N ATOM 890 CA SER A 169 61.484 113.649 -68.432 1.00 47.80 C ATOM 891 C SER A 169 61.978 114.439 -67.242 1.00 42.73 C ATOM 892 O SER A 169 63.090 114.233 -66.754 1.00 43.46 O ATOM 893 CB SER A 169 60.708 112.406 -67.985 1.00 47.30 C ATOM 894 OG SER A 169 61.587 111.401 -67.531 1.00 51.54 O ATOM 895 N LEU A 170 61.134 115.361 -66.797 1.00 43.48 N ATOM 896 CA LEU A 170 61.433 116.194 -65.655 1.00 40.04 C ATOM 897 C LEU A 170 60.397 115.959 -64.578 1.00 45.75 C ATOM 898 O LEU A 170 59.224 116.305 -64.743 1.00 42.21 O ATOM 899 CB LEU A 170 61.432 117.667 -66.048 1.00 37.59 C ATOM 900 CG LEU A 170 61.711 118.619 -64.885 1.00 37.90 C ATOM 901 CD1 LEU A 170 63.079 118.335 -64.266 1.00 35.86 C ATOM 902 CD2 LEU A 170 61.615 120.059 -65.351 1.00 38.82 C ATOM 903 N SER A 171 60.850 115.363 -63.479 1.00 45.17 N ATOM 904 CA SER A 171 60.030 115.144 -62.299 1.00 41.50 C ATOM 905 C SER A 171 60.273 116.267 -61.302 1.00 41.71 C ATOM 906 O SER A 171 61.421 116.663 -61.061 1.00 41.49 O ATOM 907 CB SER A 171 60.393 113.801 -61.665 1.00 44.93 C ATOM 908 OG SER A 171 59.750 113.628 -60.413 1.00 56.48 O ATOM 909 N VAL A 172 59.191 116.785 -60.731 1.00 40.83 N ATOM 910 CA VAL A 172 59.283 117.838 -59.726 1.00 42.67 C ATOM 911 C VAL A 172 58.397 117.520 -58.529 1.00 44.70 C ATOM 912 O VAL A 172 57.169 117.515 -58.644 1.00 45.58 O ATOM 913 CB VAL A 172 58.858 119.202 -60.292 1.00 45.78 C ATOM 914 CG1 VAL A 172 58.988 120.293 -59.222 1.00 39.74 C ATOM 915 CG2 VAL A 172 59.683 119.543 -61.528 1.00 45.95 C ATOM 916 N VAL A 173 59.024 117.261 -57.385 1.00 40.09 N ATOM 917 CA VAL A 173 58.294 116.976 -56.156 1.00 46.09 C ATOM 918 C VAL A 173 58.409 118.148 -55.188 1.00 45.98 C ATOM 919 O VAL A 173 59.511 118.566 -54.830 1.00 46.75 O ATOM 920 CB VAL A 173 58.797 115.680 -55.474 1.00 45.50 C ATOM 921 CG1 VAL A 173 58.159 115.511 -54.099 1.00 45.65 C ATOM 922 CG2 VAL A 173 58.509 114.481 -56.346 1.00 39.66 C ATOM 923 N ASN A 174 57.263 118.674 -54.768 1.00 47.59 N ATOM 924 CA ASN A 174 57.232 119.859 -53.922 1.00 52.54 C ATOM 925 C ASN A 174 56.532 119.598 -52.598 1.00 53.05 C ATOM 926 O ASN A 174 55.308 119.519 -52.539 1.00 56.05 O ATOM 927 CB ASN A 174 56.544 121.007 -54.650 1.00 53.74 C ATOM 928 CG ASN A 174 56.828 122.351 -54.014 1.00 54.26 C ATOM 929 OD1 ASN A 174 56.947 122.467 -52.789 1.00 53.11 O ATOM 930 ND2 ASN A 174 56.943 123.378 -54.847 1.00 44.07 N ATOM 931 N ASN A 175 57.314 119.468 -51.534 1.00 53.06 N ATOM 932 CA ASN A 175 56.763 119.113 -50.233 1.00 59.18 C ATOM 933 C ASN A 175 56.085 120.277 -49.484 1.00 61.84 C ATOM 934 O ASN A 175 55.414 120.061 -48.470 1.00 57.72 O ATOM 935 CB ASN A 175 57.827 118.411 -49.374 1.00 53.44 C ATOM 936 CG ASN A 175 58.103 116.994 -49.848 1.00 51.70 C ATOM 937 OD1 ASN A 175 57.195 116.305 -50.301 1.00 50.59 O ATOM 938 ND2 ASN A 175 59.358 116.554 -49.750 1.00 57.42 N ATOM 939 N ASN A 176 56.249 121.498 -49.992 1.00 59.15 N ATOM 940 CA ASN A 176 55.551 122.659 -49.435 1.00 62.58 C ATOM 941 C ASN A 176 54.132 122.774 -49.983 1.00 62.88 C ATOM 942 O ASN A 176 53.160 122.879 -49.225 1.00 60.09 O ATOM 943 CB ASN A 176 56.324 123.948 -49.726 1.00 61.91 C ATOM 944 CG ASN A 176 57.770 123.871 -49.274 1.00 73.37 C ATOM 945 OD1 ASN A 176 58.138 122.992 -48.491 1.00 73.97 O ATOM 946 ND2 ASN A 176 58.600 124.790 -49.765 1.00 69.98 N ATOM 947 N LEU A 177 54.027 122.757 -51.310 1.00 59.01 N ATOM 948 CA LEU A 177 52.743 122.862 -51.984 1.00 55.98 C ATOM 949 C LEU A 177 52.084 121.494 -52.099 1.00 56.67 C ATOM 950 O LEU A 177 50.936 121.378 -52.538 1.00 62.34 O ATOM 951 CB LEU A 177 52.927 123.485 -53.367 1.00 56.62 C ATOM 952 CG LEU A 177 53.833 124.722 -53.370 1.00 59.56 C ATOM 953 CD1 LEU A 177 54.132 125.203 -54.785 1.00 54.81 C ATOM 954 CD2 LEU A 177 53.214 125.834 -52.529 1.00 58.92 C ATOM 955 N LYS A 178 52.807 120.456 -51.694 1.00 54.03 N ATOM 956 CA LYS A 178 52.277 119.105 -51.778 1.00 57.68 C ATOM 957 C LYS A 178 51.899 118.746 -53.217 1.00 59.52 C ATOM 958 O LYS A 178 50.779 118.286 -53.472 1.00 58.47 O ATOM 959 CB LYS A 178 51.040 118.984 -50.888 1.00 59.17 C ATOM 960 CG LYS A 178 51.286 118.413 -49.511 1.00 55.40 C ATOM 961 CD LYS A 178 52.414 119.104 -48.791 1.00 58.25 C ATOM 962 CE LYS A 178 52.512 118.567 -47.371 1.00 65.22 C ATOM 963 NZ LYS A 178 53.776 118.936 -46.675 1.00 70.96 N ATOM 964 N THR A 179 52.823 118.967 -54.153 1.00 53.56 N ATOM 965 CA THR A 179 52.576 118.660 -55.567 1.00 53.62 C ATOM 966 C THR A 179 53.575 117.629 -56.131 1.00 52.00 C ATOM 967 O THR A 179 54.692 117.493 -55.623 1.00 51.22 O ATOM 968 CB THR A 179 52.591 119.944 -56.455 1.00 55.67 C ATOM 969 OG1 THR A 179 53.876 120.580 -56.382 1.00 60.99 O ATOM 970 CG2 THR A 179 51.521 120.929 -56.016 1.00 57.29 C ATOM 971 N ASN A 180 53.162 116.909 -57.175 1.00 46.27 N ATOM 972 CA ASN A 180 54.039 115.973 -57.883 1.00 44.53 C ATOM 973 C ASN A 180 53.836 116.065 -59.401 1.00 46.36 C ATOM 974 O ASN A 180 52.821 115.596 -59.931 1.00 44.54 O ATOM 975 CB ASN A 180 53.813 114.540 -57.387 1.00 44.22 C ATOM 976 CG ASN A 180 54.771 113.532 -58.025 1.00 50.75 C ATOM 977 OD1 ASN A 180 55.368 113.795 -59.077 1.00 51.74 O ATOM 978 ND2 ASN A 180 54.916 112.367 -57.391 1.00 46.60 N ATOM 979 N ASP A 181 54.801 116.670 -60.094 1.00 41.96 N ATOM 980 CA ASP A 181 54.675 116.926 -61.532 1.00 41.39 C ATOM 981 C ASP A 181 55.657 116.096 -62.355 1.00 40.40 C ATOM 982 O ASP A 181 56.759 115.799 -61.909 1.00 47.58 O ATOM 983 CB ASP A 181 54.872 118.419 -61.838 1.00 45.77 C ATOM 984 CG ASP A 181 53.733 119.292 -61.303 1.00 52.95 C ATOM 985 OD1 ASP A 181 52.549 118.955 -61.532 1.00 51.02 O ATOM 986 OD2 ASP A 181 54.024 120.325 -60.658 1.00 56.80 O ATOM 987 N ARG A 182 55.264 115.720 -63.561 1.00 41.89 N ATOM 988 CA ARG A 182 56.170 114.962 -64.415 1.00 46.75 C ATOM 989 C ARG A 182 55.896 115.168 -65.901 1.00 45.35 C ATOM 990 O ARG A 182 54.831 114.816 -66.405 1.00 43.54 O ATOM 991 CB ARG A 182 56.127 113.480 -64.062 1.00 45.79 C ATOM 992 CG ARG A 182 57.011 112.633 -64.931 1.00 47.82 C ATOM 993 CD ARG A 182 57.089 111.221 -64.413 1.00 47.22 C ATOM 994 NE ARG A 182 58.200 110.509 -65.032 1.00 60.96 N ATOM 995 CZ ARG A 182 59.465 110.600 -64.621 1.00 67.74 C ATOM 996 NH1 ARG A 182 59.780 111.366 -63.581 1.00 60.79 N ATOM 997 NH2 ARG A 182 60.421 109.920 -65.244 1.00 74.62 N ATOM 998 N PHE A 183 56.869 115.750 -66.594 1.00 47.03 N ATOM 999 CA PHE A 183 56.735 116.007 -68.015 1.00 44.61 C ATOM 1000 C PHE A 183 57.740 115.167 -68.776 1.00 45.70 C ATOM 1001 O PHE A 183 58.942 115.297 -68.570 1.00 47.73 O ATOM 1002 CB PHE A 183 56.976 117.480 -68.335 1.00 44.96 C ATOM 1003 CG PHE A 183 56.320 118.438 -67.383 1.00 38.93 C ATOM 1004 CD1 PHE A 183 55.052 118.919 -67.626 1.00 45.13 C ATOM 1005 CD2 PHE A 183 56.991 118.881 -66.266 1.00 44.05 C ATOM 1006 CE1 PHE A 183 54.458 119.814 -66.758 1.00 49.39 C ATOM 1007 CE2 PHE A 183 56.405 119.772 -65.395 1.00 50.26 C ATOM 1008 CZ PHE A 183 55.137 120.245 -65.641 1.00 47.36 C ATOM 1009 N THR A 184 57.244 114.309 -69.662 1.00 51.71 N ATOM 1010 CA THR A 184 58.113 113.485 -70.489 1.00 50.29 C ATOM 1011 C THR A 184 57.972 113.842 -71.953 1.00 51.20 C ATOM 1012 O THR A 184 56.856 113.912 -72.481 1.00 54.87 O ATOM 1013 CB THR A 184 57.769 112.003 -70.373 1.00 48.10 C ATOM 1014 OG1 THR A 184 57.910 111.575 -69.013 1.00 54.51 O ATOM 1015 CG2 THR A 184 58.691 111.196 -71.262 1.00 44.25 C ATOM 1016 N VAL A 185 59.105 114.046 -72.614 1.00 48.32 N ATOM 1017 CA VAL A 185 59.104 114.349 -74.037 1.00 46.86 C ATOM 1018 C VAL A 185 60.003 113.381 -74.811 1.00 49.03 C ATOM 1019 O VAL A 185 61.146 113.144 -74.421 1.00 50.52 O ATOM 1020 CB VAL A 185 59.558 115.791 -74.285 1.00 46.40 C ATOM 1021 CG1 VAL A 185 59.633 116.068 -75.778 1.00 53.31 C ATOM 1022 CG2 VAL A 185 58.609 116.766 -73.599 1.00 45.80 C ATOM 1023 N PRO A 186 59.478 112.802 -75.903 1.00 50.71 N ATOM 1024 CA PRO A 186 60.264 111.926 -76.788 1.00 53.78 C ATOM 1025 C PRO A 186 61.198 112.738 -77.691 1.00 49.05 C ATOM 1026 O PRO A 186 60.777 113.758 -78.237 1.00 50.63 O ATOM 1027 CB PRO A 186 59.196 111.229 -77.653 1.00 48.57 C ATOM 1028 CG PRO A 186 57.865 111.658 -77.107 1.00 52.03 C ATOM 1029 CD PRO A 186 58.075 112.915 -76.335 1.00 50.34 C ATOM 1030 N VAL A 187 62.436 112.286 -77.861 1.00 45.89 N ATOM 1031 CA VAL A 187 63.410 113.031 -78.659 1.00 53.62 C ATOM 1032 C VAL A 187 64.069 112.173 -79.736 1.00 49.44 C ATOM 1033 O VAL A 187 64.881 111.311 -79.429 1.00 52.82 O ATOM 1034 CB VAL A 187 64.512 113.654 -77.767 1.00 50.93 C ATOM 1035 CG1 VAL A 187 65.639 114.212 -78.618 1.00 49.12 C ATOM 1036 CG2 VAL A 187 63.922 114.741 -76.873 1.00 52.11 C ATOM 1037 N THR A 188 63.733 112.423 -80.997 1.00 47.11 N ATOM 1038 CA THR A 188 64.288 111.639 -82.095 1.00 47.17 C ATOM 1039 C THR A 188 65.812 111.727 -82.120 1.00 45.91 C ATOM 1040 O THR A 188 66.401 112.557 -81.433 1.00 46.42 O ATOM 1041 CB THR A 188 63.721 112.097 -83.444 1.00 46.64 C ATOM 1042 OG1 THR A 188 64.102 113.458 -83.681 1.00 50.22 O ATOM 1043 CG2 THR A 188 62.202 111.997 -83.433 1.00 42.77 C ATOM 1044 N THR A 189 66.452 110.864 -82.900 1.00 46.27 N ATOM 1045 CA THR A 189 67.904 110.933 -83.045 1.00 48.22 C ATOM 1046 C THR A 189 68.286 112.297 -83.607 1.00 48.35 C ATOM 1047 O THR A 189 69.234 112.929 -83.128 1.00 46.83 O ATOM 1048 CB THR A 189 68.468 109.813 -83.961 1.00 42.32 C ATOM 1049 OG1 THR A 189 68.221 108.534 -83.373 1.00 52.29 O ATOM 1050 CG2 THR A 189 69.966 109.970 -84.152 1.00 36.17 C ATOM 1051 N ALA A 190 67.539 112.747 -84.616 1.00 41.27 N ATOM 1052 CA ALA A 190 67.798 114.035 -85.257 1.00 44.22 C ATOM 1053 C ALA A 190 67.679 115.203 -84.284 1.00 44.07 C ATOM 1054 O ALA A 190 68.540 116.078 -84.255 1.00 41.75 O ATOM 1055 CB ALA A 190 66.872 114.247 -86.443 1.00 42.49 C ATOM 1056 N GLU A 191 66.611 115.219 -83.497 1.00 41.80 N ATOM 1057 CA GLU A 191 66.405 116.283 -82.519 1.00 42.81 C ATOM 1058 C GLU A 191 67.494 116.303 -81.451 1.00 41.67 C ATOM 1059 O GLU A 191 67.981 117.361 -81.065 1.00 45.31 O ATOM 1060 CB GLU A 191 65.023 116.162 -81.870 1.00 47.37 C ATOM 1061 CG GLU A 191 63.872 116.431 -82.826 1.00 41.24 C ATOM 1062 CD GLU A 191 62.538 116.094 -82.224 1.00 45.87 C ATOM 1063 OE1 GLU A 191 61.542 116.775 -82.561 1.00 46.77 O ATOM 1064 OE2 GLU A 191 62.494 115.149 -81.411 1.00 48.76 O ATOM 1065 N PHE A 192 67.880 115.130 -80.975 1.00 42.32 N ATOM 1066 CA PHE A 192 68.929 115.045 -79.970 1.00 41.54 C ATOM 1067 C PHE A 192 70.288 115.434 -80.563 1.00 40.20 C ATOM 1068 O PHE A 192 71.170 115.924 -79.853 1.00 43.25 O ATOM 1069 CB PHE A 192 68.964 113.640 -79.357 1.00 43.74 C ATOM 1070 CG PHE A 192 69.926 113.494 -78.211 1.00 41.73 C ATOM 1071 CD1 PHE A 192 69.544 113.828 -76.921 1.00 40.68 C ATOM 1072 CD2 PHE A 192 71.209 113.018 -78.426 1.00 40.47 C ATOM 1073 CE1 PHE A 192 70.422 113.693 -75.871 1.00 36.59 C ATOM 1074 CE2 PHE A 192 72.096 112.886 -77.382 1.00 44.69 C ATOM 1075 CZ PHE A 192 71.704 113.220 -76.102 1.00 43.50 C ATOM 1076 N ALA A 193 70.458 115.214 -81.861 1.00 38.35 N ATOM 1077 CA ALA A 193 71.674 115.641 -82.549 1.00 41.94 C ATOM 1078 C ALA A 193 71.768 117.167 -82.578 1.00 39.98 C ATOM 1079 O ALA A 193 72.861 117.735 -82.491 1.00 35.92 O ATOM 1080 CB ALA A 193 71.716 115.081 -83.973 1.00 44.57 C ATOM 1081 N VAL A 194 70.618 117.825 -82.709 1.00 36.10 N ATOM 1082 CA VAL A 194 70.578 119.276 -82.653 1.00 37.81 C ATOM 1083 C VAL A 194 71.090 119.737 -81.295 1.00 38.57 C ATOM 1084 O VAL A 194 72.000 120.563 -81.204 1.00 39.45 O ATOM 1085 CB VAL A 194 69.170 119.829 -82.893 1.00 36.51 C ATOM 1086 CG1 VAL A 194 69.142 121.309 -82.590 1.00 32.67 C ATOM 1087 CG2 VAL A 194 68.743 119.571 -84.330 1.00 35.19 C ATOM 1088 N MET A 195 70.517 119.178 -80.239 1.00 40.26 N ATOM 1089 CA MET A 195 70.947 119.494 -78.886 1.00 38.28 C ATOM 1090 C MET A 195 72.445 119.262 -78.677 1.00 38.02 C ATOM 1091 O MET A 195 73.139 120.145 -78.191 1.00 40.74 O ATOM 1092 CB MET A 195 70.146 118.682 -77.871 1.00 40.63 C ATOM 1093 CG MET A 195 68.649 118.941 -77.919 1.00 45.50 C ATOM 1094 SD MET A 195 67.723 117.888 -76.777 1.00 48.29 S ATOM 1095 CE MET A 195 66.057 118.435 -77.122 1.00 46.70 C ATOM 1096 N ARG A 196 72.944 118.082 -79.023 1.00 31.87 N ATOM 1097 CA ARG A 196 74.357 117.780 -78.792 1.00 40.29 C ATOM 1098 C ARG A 196 75.245 118.836 -79.462 1.00 41.08 C ATOM 1099 O ARG A 196 76.177 119.370 -78.854 1.00 37.95 O ATOM 1100 CB ARG A 196 74.713 116.362 -79.284 1.00 44.17 C ATOM 1101 CG ARG A 196 76.214 116.024 -79.272 1.00 50.58 C ATOM 1102 CD ARG A 196 76.535 114.727 -80.052 1.00 54.76 C ATOM 1103 NE ARG A 196 76.221 113.514 -79.293 1.00 62.48 N ATOM 1104 CZ ARG A 196 75.235 112.672 -79.591 1.00 64.22 C ATOM 1105 NH1 ARG A 196 74.464 112.899 -80.652 1.00 62.65 N ATOM 1106 NH2 ARG A 196 75.025 111.596 -78.835 1.00 66.27 N ATOM 1107 N THR A 197 74.938 119.145 -80.715 1.00 42.09 N ATOM 1108 CA THR A 197 75.723 120.109 -81.470 1.00 39.16 C ATOM 1109 C THR A 197 75.533 121.523 -80.928 1.00 37.47 C ATOM 1110 O THR A 197 76.507 122.251 -80.727 1.00 34.44 O ATOM 1111 CB THR A 197 75.379 120.054 -82.965 1.00 39.82 C ATOM 1112 OG1 THR A 197 75.549 118.711 -83.437 1.00 43.17 O ATOM 1113 CG2 THR A 197 76.283 120.977 -83.748 1.00 37.97 C ATOM 1114 N ALA A 198 74.280 121.899 -80.680 1.00 36.10 N ATOM 1115 CA ALA A 198 73.977 123.211 -80.120 1.00 36.04 C ATOM 1116 C ALA A 198 74.539 123.359 -78.707 1.00 37.45 C ATOM 1117 O ALA A 198 75.047 124.419 -78.348 1.00 38.64 O ATOM 1118 CB ALA A 198 72.494 123.461 -80.130 1.00 36.23 C ATOM 1119 N PHE A 199 74.475 122.287 -77.922 1.00 35.06 N ATOM 1120 CA PHE A 199 74.993 122.307 -76.556 1.00 34.08 C ATOM 1121 C PHE A 199 76.525 122.371 -76.558 1.00 33.24 C ATOM 1122 O PHE A 199 77.118 123.072 -75.747 1.00 33.63 O ATOM 1123 CB PHE A 199 74.496 121.090 -75.757 1.00 34.72 C ATOM 1124 CG PHE A 199 73.037 121.162 -75.364 1.00 35.95 C ATOM 1125 CD1 PHE A 199 72.151 121.983 -76.058 1.00 38.50 C ATOM 1126 CD2 PHE A 199 72.548 120.393 -74.313 1.00 35.91 C ATOM 1127 CE1 PHE A 199 70.810 122.054 -75.708 1.00 36.18 C ATOM 1128 CE2 PHE A 199 71.207 120.449 -73.953 1.00 34.18 C ATOM 1129 CZ PHE A 199 70.333 121.279 -74.654 1.00 40.47 C ATOM 1130 N SER A 200 77.166 121.638 -77.466 1.00 33.71 N ATOM 1131 CA SER A 200 78.623 121.696 -77.585 1.00 34.87 C ATOM 1132 C SER A 200 79.058 123.106 -77.927 1.00 32.08 C ATOM 1133 O SER A 200 80.026 123.621 -77.377 1.00 28.79 O ATOM 1134 CB SER A 200 79.126 120.761 -78.684 1.00 36.31 C ATOM 1135 OG SER A 200 78.888 119.406 -78.360 1.00 47.33 O ATOM 1136 N PHE A 201 78.341 123.714 -78.862 1.00 33.24 N ATOM 1137 CA PHE A 201 78.647 125.067 -79.289 1.00 36.25 C ATOM 1138 C PHE A 201 78.550 126.000 -78.099 1.00 38.08 C ATOM 1139 O PHE A 201 79.405 126.875 -77.903 1.00 32.32 O ATOM 1140 CB PHE A 201 77.667 125.528 -80.374 1.00 37.00 C ATOM 1141 CG PHE A 201 77.728 127.008 -80.654 1.00 39.94 C ATOM 1142 CD1 PHE A 201 78.745 127.542 -81.427 1.00 38.05 C ATOM 1143 CD2 PHE A 201 76.773 127.868 -80.134 1.00 35.64 C ATOM 1144 CE1 PHE A 201 78.798 128.908 -81.676 1.00 34.96 C ATOM 1145 CE2 PHE A 201 76.824 129.228 -80.387 1.00 31.49 C ATOM 1146 CZ PHE A 201 77.831 129.746 -81.157 1.00 31.56 C ATOM 1147 N ALA A 202 77.504 125.797 -77.302 1.00 31.62 N ATOM 1148 CA ALA A 202 77.189 126.718 -76.227 1.00 33.28 C ATOM 1149 C ALA A 202 78.081 126.511 -75.011 1.00 35.50 C ATOM 1150 O ALA A 202 78.237 127.417 -74.182 1.00 37.92 O ATOM 1151 CB ALA A 202 75.721 126.601 -75.842 1.00 33.26 C ATOM 1152 N LEU A 203 78.670 125.325 -74.902 1.00 32.66 N ATOM 1153 CA LEU A 203 79.405 124.965 -73.691 1.00 34.54 C ATOM 1154 C LEU A 203 80.527 125.955 -73.324 1.00 36.07 C ATOM 1155 O LEU A 203 80.605 126.413 -72.181 1.00 33.73 O ATOM 1156 CB LEU A 203 79.944 123.536 -73.784 1.00 27.94 C ATOM 1157 CG LEU A 203 80.635 123.025 -72.523 1.00 30.86 C ATOM 1158 CD1 LEU A 203 79.638 122.923 -71.388 1.00 34.13 C ATOM 1159 CD2 LEU A 203 81.298 121.680 -72.772 1.00 34.50 C ATOM 1160 N PRO A 204 81.397 126.293 -74.291 1.00 33.66 N ATOM 1161 CA PRO A 204 82.481 127.217 -73.957 1.00 32.67 C ATOM 1162 C PRO A 204 81.949 128.593 -73.537 1.00 38.44 C ATOM 1163 O PRO A 204 82.603 129.272 -72.740 1.00 40.83 O ATOM 1164 CB PRO A 204 83.270 127.325 -75.269 1.00 36.31 C ATOM 1165 CG PRO A 204 82.811 126.156 -76.114 1.00 35.25 C ATOM 1166 CD PRO A 204 81.399 125.928 -75.718 1.00 31.94 C ATOM 1167 N HIS A 205 80.784 128.987 -74.049 1.00 35.86 N ATOM 1168 CA HIS A 205 80.208 130.298 -73.740 1.00 37.40 C ATOM 1169 C HIS A 205 79.637 130.384 -72.335 1.00 37.11 C ATOM 1170 O HIS A 205 79.841 131.375 -71.642 1.00 38.09 O ATOM 1171 CB HIS A 205 79.119 130.675 -74.744 1.00 39.16 C ATOM 1172 CG HIS A 205 79.629 130.885 -76.134 1.00 44.52 C ATOM 1173 ND1 HIS A 205 79.885 129.841 -76.996 1.00 44.63 N ATOM 1174 CD2 HIS A 205 79.940 132.016 -76.809 1.00 50.47 C ATOM 1175 CE1 HIS A 205 80.329 130.320 -78.146 1.00 38.92 C ATOM 1176 NE2 HIS A 205 80.370 131.635 -78.058 1.00 48.62 N ATOM 1177 N ILE A 206 78.905 129.357 -71.916 1.00 38.93 N ATOM 1178 CA ILE A 206 78.366 129.355 -70.562 1.00 35.16 C ATOM 1179 C ILE A 206 79.495 129.224 -69.554 1.00 32.81 C ATOM 1180 O ILE A 206 79.331 129.565 -68.388 1.00 36.67 O ATOM 1181 CB ILE A 206 77.300 128.260 -70.337 1.00 30.73 C ATOM 1182 CG1 ILE A 206 77.931 126.871 -70.343 1.00 34.37 C ATOM 1183 CG2 ILE A 206 76.210 128.355 -71.388 1.00 34.60 C ATOM 1184 CD1 ILE A 206 77.050 125.800 -69.744 1.00 31.94 C ATOM 1185 N MET A 207 80.645 128.740 -70.008 1.00 34.03 N ATOM 1186 CA MET A 207 81.809 128.621 -69.136 1.00 38.01 C ATOM 1187 C MET A 207 82.559 129.943 -69.091 1.00 41.21 C ATOM 1188 O MET A 207 83.363 130.175 -68.191 1.00 40.85 O ATOM 1189 CB MET A 207 82.750 127.511 -69.614 1.00 40.98 C ATOM 1190 CG MET A 207 82.216 126.078 -69.457 1.00 39.01 C ATOM 1191 SD MET A 207 83.249 124.885 -70.357 1.00 38.76 S ATOM 1192 CE MET A 207 84.871 125.241 -69.703 1.00 38.26 C ATOM 1193 N GLY A 208 82.284 130.806 -70.068 1.00 39.78 N ATOM 1194 CA GLY A 208 82.946 132.092 -70.173 1.00 38.24 C ATOM 1195 C GLY A 208 84.239 132.016 -70.968 1.00 45.85 C ATOM 1196 O GLY A 208 85.006 132.980 -71.010 1.00 43.48 O ATOM 1197 N TRP A 209 84.486 130.871 -71.602 1.00 45.13 N ATOM 1198 CA TRP A 209 85.711 130.680 -72.378 1.00 44.71 C ATOM 1199 C TRP A 209 85.726 131.447 -73.695 1.00 44.52 C ATOM 1200 O TRP A 209 86.766 131.513 -74.357 1.00 43.46 O ATOM 1201 CB TRP A 209 85.984 129.190 -72.617 1.00 39.67 C ATOM 1202 CG TRP A 209 86.708 128.551 -71.466 1.00 41.67 C ATOM 1203 CD1 TRP A 209 86.532 128.819 -70.132 1.00 39.05 C ATOM 1204 CD2 TRP A 209 87.716 127.537 -71.542 1.00 41.33 C ATOM 1205 NE1 TRP A 209 87.373 128.035 -69.378 1.00 38.36 N ATOM 1206 CE2 TRP A 209 88.114 127.238 -70.220 1.00 39.74 C ATOM 1207 CE3 TRP A 209 88.332 126.854 -72.601 1.00 39.60 C ATOM 1208 CZ2 TRP A 209 89.091 126.289 -69.925 1.00 41.53 C ATOM 1209 CZ3 TRP A 209 89.305 125.914 -72.311 1.00 43.43 C ATOM 1210 CH2 TRP A 209 89.674 125.639 -70.981 1.00 45.99 C ATOM 1211 N ASP A 210 84.584 132.026 -74.070 1.00 42.73 N ATOM 1212 CA ASP A 210 84.502 132.830 -75.290 1.00 45.48 C ATOM 1213 C ASP A 210 85.107 134.212 -75.079 1.00 52.09 C ATOM 1214 O ASP A 210 85.256 134.976 -76.032 1.00 53.83 O ATOM 1215 CB ASP A 210 83.061 132.967 -75.773 1.00 40.13 C ATOM 1216 CG ASP A 210 82.155 133.575 -74.727 1.00 52.23 C ATOM 1217 OD1 ASP A 210 82.442 133.400 -73.522 1.00 50.41 O ATOM 1218 OD2 ASP A 210 81.153 134.224 -75.104 1.00 57.05 O ATOM 1219 N ARG A 211 85.444 134.528 -73.829 1.00 51.56 N ATOM 1220 CA ARG A 211 86.147 135.768 -73.512 1.00 53.54 C ATOM 1221 C ARG A 211 87.623 135.661 -73.881 1.00 54.73 C ATOM 1222 O ARG A 211 88.279 136.668 -74.148 1.00 61.96 O ATOM 1223 CB ARG A 211 86.015 136.117 -72.032 1.00 50.81 C ATOM 1224 CG ARG A 211 84.658 136.668 -71.635 1.00 54.71 C ATOM 1225 CD ARG A 211 84.360 137.992 -72.327 1.00 63.53 C ATOM 1226 NE ARG A 211 83.313 138.728 -71.619 1.00 72.34 N ATOM 1227 CZ ARG A 211 83.536 139.552 -70.594 1.00 70.35 C ATOM 1228 NH1 ARG A 211 84.776 139.759 -70.168 1.00 68.64 N ATOM 1229 NH2 ARG A 211 82.524 140.177 -69.998 1.00 64.05 N ATOM 1230 N PHE A 212 88.149 134.441 -73.889 1.00 53.13 N ATOM 1231 CA PHE A 212 89.529 134.234 -74.310 1.00 53.78 C ATOM 1232 C PHE A 212 89.601 134.278 -75.838 1.00 55.83 C ATOM 1233 O PHE A 212 89.406 133.263 -76.510 1.00 58.98 O ATOM 1234 CB PHE A 212 90.071 132.903 -73.780 1.00 46.70 C ATOM 1235 CG PHE A 212 90.011 132.766 -72.279 1.00 44.19 C ATOM 1236 CD1 PHE A 212 89.075 131.937 -71.685 1.00 45.67 C ATOM 1237 CD2 PHE A 212 90.899 133.452 -71.463 1.00 48.36 C ATOM 1238 CE1 PHE A 212 89.019 131.796 -70.298 1.00 45.47 C ATOM 1239 CE2 PHE A 212 90.846 133.318 -70.077 1.00 49.72 C ATOM 1240 CZ PHE A 212 89.903 132.489 -69.497 1.00 46.32 C ATOM 1241 N THR A 213 89.857 135.459 -76.391 1.00 59.32 N ATOM 1242 CA THR A 213 89.922 135.609 -77.841 1.00 61.72 C ATOM 1243 C THR A 213 91.016 136.576 -78.276 1.00 65.59 C ATOM 1244 O THR A 213 91.191 137.633 -77.672 1.00 66.74 O ATOM 1245 CB THR A 213 88.587 136.104 -78.423 1.00 63.64 C ATOM 1246 OG1 THR A 213 87.498 135.467 -77.744 1.00 64.95 O ATOM 1247 CG2 THR A 213 88.517 135.799 -79.922 1.00 63.52 C ATOM 1248 N ASN A 214 91.737 136.197 -79.333 1.00 68.20 N ATOM 1249 CA ASN A 214 92.776 137.034 -79.932 1.00 66.88 C ATOM 1250 C ASN A 214 92.139 138.145 -80.771 1.00 78.91 C ATOM 1251 O ASN A 214 91.812 137.912 -81.947 1.00 83.28 O ATOM 1252 CB ASN A 214 93.702 136.190 -80.809 1.00 56.58 C ATOM 1253 CG ASN A 214 94.522 135.192 -80.006 1.00 60.31 C ATOM 1254 OD1 ASN A 214 94.885 135.442 -78.844 1.00 58.61 O ATOM 1255 ND2 ASN A 214 94.837 134.062 -80.626 1.00 50.19 N ATOM 1256 N ARG A 215 91.962 139.329 -80.173 1.00 82.40 N ATOM 1257 CA ARG A 215 91.277 140.443 -80.819 1.00 86.49 C ATOM 1258 C ARG A 215 89.801 140.108 -80.932 1.00 91.57 C ATOM 1259 O ARG A 215 89.386 138.950 -80.969 1.00 89.12 O ATOM 1260 CB ARG A 215 91.843 140.745 -82.211 1.00 87.12 C ATOM 1261 CG ARG A 215 91.507 142.131 -82.807 1.00 91.80 C ATOM 1262 CD ARG A 215 92.047 143.319 -81.981 1.00 95.34 C ATOM 1263 NE ARG A 215 93.486 143.232 -81.741 1.00 96.49 N ATOM 1264 CZ ARG A 215 94.035 143.029 -80.544 1.00 99.66 C ATOM 1265 NH1 ARG A 215 93.268 142.903 -79.461 1.00 95.63 N ATOM 1266 NH2 ARG A 215 95.357 142.960 -80.426 1.00 91.81 N TER 1267 ARG A 215 ATOM 1268 P DT B 1 58.630 133.689 -60.275 0.70 99.80 P ATOM 1269 OP1 DT B 1 58.249 132.901 -59.076 0.70 88.47 O ATOM 1270 OP2 DT B 1 59.120 135.084 -60.138 0.70 81.72 O ATOM 1271 O5' DT B 1 59.726 132.853 -61.094 0.70 89.84 O ATOM 1272 C5' DT B 1 60.793 132.233 -60.388 0.70 79.62 C ATOM 1273 C4' DT B 1 61.339 131.058 -61.173 0.70 75.08 C ATOM 1274 O4' DT B 1 62.075 131.554 -62.324 0.70 78.59 O ATOM 1275 C3' DT B 1 62.339 130.206 -60.407 0.70 70.20 C ATOM 1276 O3' DT B 1 62.361 128.879 -60.925 0.70 63.02 O ATOM 1277 C2' DT B 1 63.647 130.939 -60.690 0.70 68.93 C ATOM 1278 C1' DT B 1 63.457 131.291 -62.163 0.70 71.47 C ATOM 1279 N1 DT B 1 64.194 132.511 -62.593 0.70 77.60 N ATOM 1280 C2 DT B 1 64.819 132.537 -63.831 0.70 80.12 C ATOM 1281 O2 DT B 1 64.813 131.601 -64.620 0.70 73.86 O ATOM 1282 N3 DT B 1 65.465 133.719 -64.117 0.70 81.22 N ATOM 1283 C4 DT B 1 65.541 134.843 -63.314 0.70 80.17 C ATOM 1284 O4 DT B 1 66.143 135.854 -63.665 0.70 88.92 O ATOM 1285 C5 DT B 1 64.865 134.750 -62.041 0.70 78.80 C ATOM 1286 C7 DT B 1 64.890 135.916 -61.095 0.70 75.60 C ATOM 1287 C6 DT B 1 64.232 133.603 -61.744 0.70 77.57 C ATOM 1288 P DT B 2 63.024 127.742 -60.015 0.70 60.13 P ATOM 1289 OP1 DT B 2 62.351 126.457 -60.297 0.70 50.37 O ATOM 1290 OP2 DT B 2 63.057 128.272 -58.628 0.70 64.39 O ATOM 1291 O5' DT B 2 64.524 127.687 -60.571 0.70 53.20 O ATOM 1292 C5' DT B 2 64.739 127.425 -61.949 0.70 51.45 C ATOM 1293 C4' DT B 2 66.219 127.305 -62.248 0.70 43.11 C ATOM 1294 O4' DT B 2 66.780 128.605 -62.527 0.70 53.92 O ATOM 1295 C3' DT B 2 67.025 126.689 -61.122 0.70 43.47 C ATOM 1296 O3' DT B 2 67.571 125.485 -61.629 0.70 41.81 O ATOM 1297 C2' DT B 2 68.107 127.712 -60.771 0.70 44.53 C ATOM 1298 C1' DT B 2 67.928 128.870 -61.752 0.70 52.27 C ATOM 1299 N1 DT B 2 67.745 130.218 -61.094 0.70 63.19 N ATOM 1300 C2 DT B 2 68.349 131.355 -61.610 0.70 64.50 C ATOM 1301 O2 DT B 2 69.055 131.374 -62.606 0.70 60.34 O ATOM 1302 N3 DT B 2 68.091 132.505 -60.904 0.70 71.15 N ATOM 1303 C4 DT B 2 67.315 132.648 -59.766 0.70 69.74 C ATOM 1304 O4 DT B 2 67.149 133.734 -59.210 0.70 68.53 O ATOM 1305 C5 DT B 2 66.717 131.426 -59.284 0.70 68.93 C ATOM 1306 C7 DT B 2 65.854 131.436 -58.056 0.70 71.50 C ATOM 1307 C6 DT B 2 66.957 130.295 -59.961 0.70 65.59 C ATOM 1308 P DT B 3 67.283 124.070 -60.957 0.70 32.91 P ATOM 1309 OP1 DT B 3 67.827 123.044 -61.863 0.70 34.75 O ATOM 1310 OP2 DT B 3 65.871 123.995 -60.536 0.70 36.49 O ATOM 1311 O5' DT B 3 68.177 124.144 -59.640 0.70 44.62 O ATOM 1312 C5' DT B 3 69.558 124.470 -59.686 0.70 42.26 C ATOM 1313 C4' DT B 3 70.169 124.145 -58.331 0.70 46.38 C ATOM 1314 O4' DT B 3 70.258 122.717 -58.163 0.70 41.67 O ATOM 1315 C3' DT B 3 71.593 124.626 -58.100 0.70 45.91 C ATOM 1316 O3' DT B 3 71.524 125.894 -57.497 0.70 45.93 O ATOM 1317 C2' DT B 3 72.166 123.638 -57.096 0.70 43.24 C ATOM 1318 C1' DT B 3 71.211 122.456 -57.161 0.70 45.57 C ATOM 1319 N1 DT B 3 71.937 121.237 -57.517 0.70 46.40 N ATOM 1320 C2 DT B 3 71.814 120.136 -56.714 0.70 44.58 C ATOM 1321 O2 DT B 3 71.115 120.108 -55.722 0.70 47.94 O ATOM 1322 N3 DT B 3 72.546 119.062 -57.129 0.70 47.33 N ATOM 1323 C4 DT B 3 73.370 118.982 -58.233 0.70 48.38 C ATOM 1324 O4 DT B 3 73.981 117.958 -58.510 0.70 51.24 O ATOM 1325 C5 DT B 3 73.458 120.184 -59.027 0.70 48.94 C ATOM 1326 C7 DT B 3 74.315 120.246 -60.257 0.70 45.48 C ATOM 1327 C6 DT B 3 72.745 121.243 -58.633 0.70 47.78 C ATOM 1328 P DT B 4 72.722 126.918 -57.687 0.70 40.84 P ATOM 1329 OP1 DT B 4 72.139 128.277 -57.620 0.70 39.93 O ATOM 1330 OP2 DT B 4 73.518 126.490 -58.858 0.70 51.55 O ATOM 1331 O5' DT B 4 73.622 126.650 -56.400 0.70 42.24 O ATOM 1332 C5' DT B 4 73.107 126.956 -55.126 0.70 42.37 C ATOM 1333 C4' DT B 4 74.218 126.885 -54.106 0.70 45.63 C ATOM 1334 O4' DT B 4 74.583 125.497 -53.928 0.70 52.16 O ATOM 1335 C3' DT B 4 75.497 127.622 -54.490 0.70 45.13 C ATOM 1336 O3' DT B 4 76.005 128.326 -53.353 0.70 50.54 O ATOM 1337 C2' DT B 4 76.420 126.496 -54.946 0.70 47.44 C ATOM 1338 C1' DT B 4 75.983 125.373 -54.014 0.70 51.65 C ATOM 1339 N1 DT B 4 76.256 124.002 -54.516 0.70 53.99 N ATOM 1340 C2 DT B 4 76.665 123.021 -53.630 0.70 55.97 C ATOM 1341 O2 DT B 4 76.828 123.217 -52.435 0.70 52.66 O ATOM 1342 N3 DT B 4 76.880 121.792 -54.205 0.70 51.04 N ATOM 1343 C4 DT B 4 76.727 121.469 -55.545 0.70 56.45 C ATOM 1344 O4 DT B 4 76.938 120.343 -55.987 0.70 59.19 O ATOM 1345 C5 DT B 4 76.299 122.541 -56.404 0.70 52.13 C ATOM 1346 C7 DT B 4 76.104 122.282 -57.867 0.70 51.70 C ATOM 1347 C6 DT B 4 76.084 123.741 -55.859 0.70 52.51 C ATOM 1348 P DT B 5 77.146 129.440 -53.521 0.70 48.70 P ATOM 1349 OP1 DT B 5 76.899 130.523 -52.544 0.70 50.01 O ATOM 1350 OP2 DT B 5 77.265 129.763 -54.960 0.70 42.08 O ATOM 1351 O5' DT B 5 78.447 128.636 -53.055 0.70 52.26 O ATOM 1352 C5' DT B 5 78.446 128.050 -51.766 0.70 50.61 C ATOM 1353 C4' DT B 5 79.664 127.173 -51.577 0.70 55.58 C ATOM 1354 O4' DT B 5 79.400 125.873 -52.138 0.70 58.96 O ATOM 1355 C3' DT B 5 80.923 127.667 -52.271 0.70 56.51 C ATOM 1356 O3' DT B 5 81.728 128.335 -51.320 0.70 62.46 O ATOM 1357 C2' DT B 5 81.621 126.405 -52.778 0.70 56.69 C ATOM 1358 C1' DT B 5 80.628 125.280 -52.498 0.70 58.64 C ATOM 1359 N1 DT B 5 80.327 124.410 -53.658 0.70 53.27 N ATOM 1360 C2 DT B 5 80.440 123.047 -53.509 0.70 54.75 C ATOM 1361 O2 DT B 5 80.794 122.521 -52.468 0.70 54.66 O ATOM 1362 N3 DT B 5 80.126 122.327 -54.633 0.70 52.56 N ATOM 1363 C4 DT B 5 79.716 122.834 -55.854 0.70 53.01 C ATOM 1364 O4 DT B 5 79.458 122.104 -56.805 0.70 54.27 O ATOM 1365 C5 DT B 5 79.616 124.271 -55.935 0.70 52.63 C ATOM 1366 C7 DT B 5 79.185 124.933 -57.210 0.70 50.71 C ATOM 1367 C6 DT B 5 79.921 124.983 -54.844 0.70 51.76 C ATOM 1368 P DT B 6 82.870 129.349 -51.801 0.70 66.86 P ATOM 1369 OP1 DT B 6 83.002 130.390 -50.751 0.70 55.90 O ATOM 1370 OP2 DT B 6 82.618 129.710 -53.217 0.70 57.71 O ATOM 1371 O5' DT B 6 84.178 128.432 -51.769 0.70 63.87 O ATOM 1372 C5' DT B 6 84.487 127.715 -50.582 0.70 61.61 C ATOM 1373 C4' DT B 6 85.578 126.704 -50.865 0.70 58.68 C ATOM 1374 O4' DT B 6 85.006 125.559 -51.543 0.70 59.28 O ATOM 1375 C3' DT B 6 86.695 127.219 -51.766 0.70 55.43 C ATOM 1376 O3' DT B 6 87.941 126.768 -51.295 0.70 64.23 O ATOM 1377 C2' DT B 6 86.397 126.560 -53.105 0.70 56.18 C ATOM 1378 C1' DT B 6 85.835 125.233 -52.631 0.70 53.82 C ATOM 1379 N1 DT B 6 85.005 124.566 -53.639 0.70 53.39 N ATOM 1380 C2 DT B 6 84.741 123.235 -53.464 0.70 55.55 C ATOM 1381 O2 DT B 6 85.160 122.605 -52.512 0.70 60.86 O ATOM 1382 N3 DT B 6 83.966 122.678 -54.446 0.70 53.12 N ATOM 1383 C4 DT B 6 83.450 123.319 -55.553 0.70 50.73 C ATOM 1384 O4 DT B 6 82.768 122.736 -56.382 0.70 52.11 O ATOM 1385 C5 DT B 6 83.769 124.714 -55.675 0.70 52.84 C ATOM 1386 C7 DT B 6 83.253 125.489 -56.850 0.70 50.61 C ATOM 1387 C6 DT B 6 84.524 125.271 -54.721 0.70 53.26 C ATOM 1388 P DT B 7 88.720 127.521 -50.120 0.70 66.35 P ATOM 1389 OP1 DT B 7 89.534 126.502 -49.419 0.70 69.12 O ATOM 1390 OP2 DT B 7 87.773 128.384 -49.379 0.70 67.12 O ATOM 1391 O5' DT B 7 89.715 128.465 -50.920 0.70 59.18 O ATOM 1392 C5' DT B 7 90.870 127.893 -51.495 0.70 65.40 C ATOM 1393 C4' DT B 7 91.415 128.864 -52.518 0.70 67.63 C ATOM 1394 O4' DT B 7 91.160 128.395 -53.857 0.70 62.67 O ATOM 1395 C3' DT B 7 90.794 130.255 -52.440 0.70 68.98 C ATOM 1396 O3' DT B 7 91.749 131.095 -51.789 0.70 70.44 O ATOM 1397 C2' DT B 7 90.470 130.623 -53.895 0.70 62.92 C ATOM 1398 C1' DT B 7 91.158 129.521 -54.699 0.70 62.38 C ATOM 1399 N1 DT B 7 90.439 129.100 -55.928 0.70 62.93 N ATOM 1400 C2 DT B 7 89.100 128.769 -55.842 0.70 60.09 C ATOM 1401 O2 DT B 7 88.457 128.807 -54.808 0.70 57.85 O ATOM 1402 N3 DT B 7 88.535 128.388 -57.031 0.70 59.19 N ATOM 1403 C4 DT B 7 89.164 128.303 -58.262 0.70 59.42 C ATOM 1404 O4 DT B 7 88.567 127.948 -59.276 0.70 57.91 O ATOM 1405 C5 DT B 7 90.561 128.658 -58.277 0.70 56.49 C ATOM 1406 C7 DT B 7 91.332 128.604 -59.564 0.70 53.94 C ATOM 1407 C6 DT B 7 91.126 129.033 -57.122 0.70 57.81 C ATOM 1408 P DT B 8 92.088 132.584 -52.278 0.70 81.54 P ATOM 1409 OP1 DT B 8 93.363 132.968 -51.617 0.70 80.79 O ATOM 1410 OP2 DT B 8 90.883 133.445 -52.118 0.70 62.98 O ATOM 1411 O5' DT B 8 92.385 132.369 -53.834 0.70 67.34 O ATOM 1412 C5' DT B 8 92.212 133.469 -54.680 0.70 71.18 C ATOM 1413 C4' DT B 8 93.549 134.103 -54.979 0.70 71.44 C ATOM 1414 O4' DT B 8 94.166 133.381 -56.067 0.70 73.22 O ATOM 1415 C3' DT B 8 93.453 135.546 -55.442 0.70 75.46 C ATOM 1416 O3' DT B 8 94.561 136.264 -54.931 0.70 77.47 O ATOM 1417 C2' DT B 8 93.482 135.477 -56.969 0.70 72.05 C ATOM 1418 C1' DT B 8 93.845 134.026 -57.285 0.70 73.04 C ATOM 1419 N1 DT B 8 92.733 133.313 -58.000 0.70 70.04 N ATOM 1420 C2 DT B 8 93.020 132.638 -59.173 0.70 69.24 C ATOM 1421 O2 DT B 8 94.140 132.576 -59.653 0.70 64.40 O ATOM 1422 N3 DT B 8 91.933 132.033 -59.764 0.70 70.58 N ATOM 1423 C4 DT B 8 90.621 132.039 -59.311 0.70 67.40 C ATOM 1424 O4 DT B 8 89.713 131.464 -59.913 0.70 59.92 O ATOM 1425 C5 DT B 8 90.397 132.768 -58.082 0.70 65.46 C ATOM 1426 C7 DT B 8 89.022 132.848 -57.493 0.70 63.29 C ATOM 1427 C6 DT B 8 91.444 133.365 -57.500 0.70 62.57 C ATOM 1428 P DT B 9 94.507 137.863 -54.894 0.70 86.07 P ATOM 1429 OP1 DT B 9 95.593 138.311 -53.989 0.70 87.91 O ATOM 1430 OP2 DT B 9 93.108 138.285 -54.638 0.70 81.43 O ATOM 1431 O5' DT B 9 94.889 138.258 -56.399 0.70 78.50 O ATOM 1432 C5' DT B 9 96.257 138.278 -56.787 0.70 75.45 C ATOM 1433 C4' DT B 9 96.395 138.357 -58.296 0.70 76.36 C ATOM 1434 O4' DT B 9 96.026 137.085 -58.884 0.70 80.15 O ATOM 1435 C3' DT B 9 95.489 139.370 -58.981 0.70 78.57 C ATOM 1436 O3' DT B 9 96.079 140.673 -58.951 0.70 78.32 O ATOM 1437 C2' DT B 9 95.409 138.809 -60.400 0.70 77.82 C ATOM 1438 C1' DT B 9 95.486 137.297 -60.178 0.70 77.53 C ATOM 1439 N1 DT B 9 94.165 136.585 -60.299 0.70 75.90 N ATOM 1440 C2 DT B 9 94.135 135.362 -60.933 0.70 73.15 C ATOM 1441 O2 DT B 9 95.129 134.832 -61.398 0.70 76.27 O ATOM 1442 N3 DT B 9 92.895 134.780 -61.010 0.70 68.21 N ATOM 1443 C4 DT B 9 91.704 135.285 -60.522 0.70 71.34 C ATOM 1444 O4 DT B 9 90.634 134.692 -60.635 0.70 68.56 O ATOM 1445 C5 DT B 9 91.804 136.567 -59.869 0.70 72.88 C ATOM 1446 C7 DT B 9 90.566 137.200 -59.304 0.70 71.27 C ATOM 1447 C6 DT B 9 93.010 137.152 -59.790 0.70 73.17 C TER 1448 DT B 9 HETATM 1449 O HOH A 1 54.202 112.351 -79.468 1.00 43.33 O HETATM 1450 O HOH A 2 57.046 110.847 -80.862 1.00 49.84 O HETATM 1451 O HOH A 3 64.563 127.363 -71.546 1.00 42.02 O HETATM 1452 O HOH A 4 77.473 125.347 -65.236 1.00 36.01 O HETATM 1453 O HOH A 7 72.977 124.012 -62.467 1.00 39.95 O HETATM 1454 O HOH A 8 79.819 122.518 -63.732 1.00 29.35 O HETATM 1455 O HOH A 9 72.646 114.839 -60.065 1.00 44.97 O HETATM 1456 O HOH A 10 77.058 105.685 -79.315 1.00 52.20 O HETATM 1457 O HOH A 11 68.666 105.903 -78.319 1.00 65.23 O HETATM 1458 O HOH A 12 61.991 114.596 -58.461 1.00 44.07 O HETATM 1459 O HOH A 13 71.611 121.952 -49.328 1.00 61.53 O HETATM 1460 O HOH A 14 78.899 122.396 -82.056 1.00 31.98 O HETATM 1461 O HOH A 15 81.490 126.914 -79.824 1.00 41.47 O HETATM 1462 O HOH A 16 66.064 110.887 -86.303 1.00 46.98 O HETATM 1463 O HOH A 17 62.898 114.280 -86.075 1.00 41.20 O HETATM 1464 O HOH A 18 58.863 105.292 -70.642 1.00 56.93 O HETATM 1465 O HOH A 19 63.570 109.285 -69.000 1.00 48.92 O HETATM 1466 O HOH A 20 84.625 128.219 -65.987 1.00 43.04 O HETATM 1467 O HOH A 21 71.256 112.036 -81.734 1.00 49.97 O HETATM 1468 O HOH A 23 64.517 115.046 -89.053 1.00 34.92 O HETATM 1469 O HOH A 24 73.702 110.571 -64.248 1.00 42.60 O HETATM 1470 O HOH A 25 77.399 119.718 -61.770 1.00 47.12 O HETATM 1471 O HOH A 26 75.736 125.726 -62.726 1.00 44.69 O HETATM 1472 O HOH A 27 73.527 111.835 -61.009 1.00 52.05 O HETATM 1473 O HOH A 28 60.213 119.694 -46.976 1.00 61.95 O HETATM 1474 O HOH A 29 62.296 121.795 -45.317 1.00 67.52 O HETATM 1475 O HOH A 30 67.615 116.202 -55.154 1.00 40.72 O HETATM 1476 O HOH A 31 73.028 108.960 -81.208 1.00 68.77 O HETATM 1477 O HOH A 32 75.865 103.315 -75.886 1.00 57.31 O HETATM 1478 O HOH A 33 59.950 111.316 -80.971 1.00 52.05 O HETATM 1479 O HOH A 34 61.331 109.067 -78.798 1.00 58.06 O HETATM 1480 O HOH A 35 57.409 109.747 -74.565 1.00 51.47 O HETATM 1481 O HOH A 37 54.864 114.575 -74.322 1.00 62.57 O HETATM 1482 O HOH A 38 63.316 112.012 -64.646 1.00 44.16 O HETATM 1483 O HOH A 39 75.092 104.618 -69.627 1.00 58.52 O HETATM 1484 O HOH A 40 64.044 123.045 -51.604 1.00 62.25 O HETATM 1485 O HOH A 41 94.428 143.785 -65.972 1.00 76.73 O HETATM 1486 O HOH A 43 72.488 131.120 -64.702 1.00 57.13 O HETATM 1487 O HOH A 44 64.826 108.398 -84.815 1.00 60.84 O HETATM 1488 O HOH A 45 70.412 123.618 -45.573 1.00 62.26 O HETATM 1489 O HOH A 46 60.002 114.906 -84.908 1.00 44.74 O HETATM 1490 O HOH A 225 77.682 117.908 -84.434 1.00 47.88 O HETATM 1491 O HOH A 226 78.881 124.111 -84.455 1.00 38.09 O HETATM 1492 O HOH A 227 58.808 119.928 -82.758 1.00 61.20 O HETATM 1493 O HOH A 228 50.238 123.385 -49.420 1.00 49.72 O HETATM 1494 O HOH A 229 53.769 132.750 -65.037 1.00 71.21 O HETATM 1495 O HOH A 230 61.815 129.463 -69.453 1.00 52.02 O HETATM 1496 O HOH A 231 54.391 114.622 -69.806 1.00 51.20 O HETATM 1497 O HOH A 232 76.298 108.787 -80.363 1.00 64.98 O HETATM 1498 O HOH A 233 58.453 127.874 -62.611 1.00 47.83 O HETATM 1499 O HOH A 234 56.021 134.060 -69.621 1.00 64.26 O HETATM 1500 O HOH A 235 60.602 124.831 -57.968 1.00 40.76 O HETATM 1501 O HOH B 33 60.540 125.167 -62.004 1.00 47.31 O HETATM 1502 O HOH B 42 70.615 129.476 -63.016 1.00 48.88 O HETATM 1503 O HOH B 47 58.963 135.038 -62.928 1.00 72.58 O HETATM 1504 O HOH B 53 60.706 134.041 -57.381 1.00 78.33 O HETATM 1505 O HOH B 55 62.037 135.094 -60.678 1.00 75.55 O HETATM 1506 O HOH B 59 86.566 130.619 -54.167 1.00 58.05 O HETATM 1507 O HOH B 60 72.101 130.688 -59.838 1.00 56.20 O HETATM 1508 O HOH B 61 63.131 137.003 -63.724 1.00 66.93 O MASTER 738 0 0 4 10 0 0 6 1506 2 0 15 END
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Related entries of code: 3n1j
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3n1i
RCSB PDB
PDBbind
178aa, >3N1I_1|Chain... *
3n1k
RCSB PDB
PDBbind
178aa, >3N1K_1|Chain... at 100%
3n1l
RCSB PDB
PDBbind
178aa, >3N1L_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3n1j
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Whirly protein StWhy2
Ligand Name
DNA 32-mer dT32
EC.Number
E.C.-.-.-.-
Resolution
2.65(Å)
Affinity (Kd/Ki/IC50)
Kd=4.45nM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Plant Cell Vol. 22: pp. 1849-1867
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
D9J034
Entrez Gene ID
NCBI Entrez Gene ID:
102577630
ASD
Information of known allosteric effects of PDB entries
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