Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 16-NOV-09 3AAF TITLE STRUCTURE OF WRN RQC DOMAIN BOUND TO DOUBLE-STRANDED DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: WERNER SYNDROME ATP-DEPENDENT HELICASE; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: RECQ C-TERMINAL (RQC) DOMAIN; COMPND 5 SYNONYM: WERNER SYNDROME PROTEIN, WRN; COMPND 6 EC: 3.6.1.-; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: DNA (5'-D(*AP*CP*CP*CP*TP*AP*AP*TP*TP*AP*GP*GP*GP*T)-3'); COMPND 10 CHAIN: C, D; COMPND 11 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21-CODONPLUS RIL; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PGEX-5X-1; SOURCE 10 MOL_ID: 2; SOURCE 11 SYNTHETIC: YES KEYWDS HELIX-TURN-HELIX, WINGED-HELIX, PROTEIN-DNA COMPLEX, DNA-BINDING, KEYWDS 2 HELICASE, DNA BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR K.KITANO,T.HAKOSHIMA REVDAT 3 13-JUL-11 3AAF 1 VERSN REVDAT 2 14-APR-10 3AAF 1 JRNL REVDAT 1 16-FEB-10 3AAF 0 JRNL AUTH K.KITANO,S.Y.KIM,T.HAKOSHIMA JRNL TITL STRUCTURAL BASIS FOR DNA STRAND SEPARATION BY THE JRNL TITL 2 UNCONVENTIONAL WINGED-HELIX DOMAIN OF RECQ HELICASE WRN JRNL REF STRUCTURE V. 18 177 2010 JRNL REFN ISSN 0969-2126 JRNL PMID 20159463 JRNL DOI 10.1016/J.STR.2009.12.011 REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 3 NUMBER OF REFLECTIONS : 39605 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.213 REMARK 3 R VALUE (WORKING SET) : 0.212 REMARK 3 FREE R VALUE : 0.244 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 2107 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.90 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.95 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2812 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 98.93 REMARK 3 BIN R VALUE (WORKING SET) : 0.2540 REMARK 3 BIN FREE R VALUE SET COUNT : 158 REMARK 3 BIN FREE R VALUE : 0.3180 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1776 REMARK 3 NUCLEIC ACID ATOMS : 568 REMARK 3 HETEROGEN ATOMS : 8 REMARK 3 SOLVENT ATOMS : 338 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 41.25 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 1.60000 REMARK 3 B22 (A**2) : 1.60000 REMARK 3 B33 (A**2) : -3.20000 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 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.125 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.123 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.096 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 7.336 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.961 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.947 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2460 ; 0.009 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3426 ; 1.409 ; 2.241 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 216 ; 5.440 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 86 ;30.188 ;23.023 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 334 ;15.281 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 14 ;12.815 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 366 ; 0.094 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1660 ; 0.005 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1073 ; 0.203 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1627 ; 0.298 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 280 ; 0.155 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 62 ; 0.153 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 47 ; 0.180 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1112 ; 0.614 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1716 ; 1.038 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1750 ; 1.491 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1710 ; 2.308 ; 4.500 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 5 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 956 A 1064 REMARK 3 ORIGIN FOR THE GROUP (A): 46.4204 29.7168 40.1429 REMARK 3 T TENSOR REMARK 3 T11: 0.0113 T22: -0.1277 REMARK 3 T33: -0.0713 T12: 0.0812 REMARK 3 T13: -0.0385 T23: -0.0313 REMARK 3 L TENSOR REMARK 3 L11: 1.1367 L22: 0.7054 REMARK 3 L33: 6.5199 L12: -0.3664 REMARK 3 L13: -0.5404 L23: 0.0281 REMARK 3 S TENSOR REMARK 3 S11: 0.0092 S12: -0.0319 S13: -0.1477 REMARK 3 S21: 0.0402 S22: 0.0580 S23: -0.1108 REMARK 3 S31: 0.8357 S32: 0.3218 S33: -0.0672 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 956 B 1064 REMARK 3 ORIGIN FOR THE GROUP (A): 71.4970 4.6582 9.3888 REMARK 3 T TENSOR REMARK 3 T11: -0.1300 T22: -0.0606 REMARK 3 T33: -0.0845 T12: 0.0802 REMARK 3 T13: -0.0017 T23: -0.0433 REMARK 3 L TENSOR REMARK 3 L11: 0.4814 L22: 1.0280 REMARK 3 L33: 6.4850 L12: -0.4095 REMARK 3 L13: 0.5756 L23: 0.7674 REMARK 3 S TENSOR REMARK 3 S11: -0.0166 S12: 0.0278 S13: 0.1368 REMARK 3 S21: -0.0507 S22: -0.1642 S23: 0.1981 REMARK 3 S31: -0.5646 S32: -0.6593 S33: 0.1808 REMARK 3 REMARK 3 TLS GROUP : 3 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : C 1 C 14 REMARK 3 ORIGIN FOR THE GROUP (A): 61.7301 19.1619 26.3057 REMARK 3 T TENSOR REMARK 3 T11: 0.2762 T22: 0.0872 REMARK 3 T33: 0.0592 T12: 0.2619 REMARK 3 T13: -0.1488 T23: -0.0811 REMARK 3 L TENSOR REMARK 3 L11: 4.0973 L22: 5.4994 REMARK 3 L33: 0.2149 L12: -4.5257 REMARK 3 L13: -0.7156 L23: 0.5783 REMARK 3 S TENSOR REMARK 3 S11: -0.1012 S12: 0.0535 S13: -0.2763 REMARK 3 S21: 0.1449 S22: -0.0364 S23: -0.0562 REMARK 3 S31: -0.1017 S32: -0.0169 S33: 0.1376 REMARK 3 REMARK 3 TLS GROUP : 4 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : D 1 D 14 REMARK 3 ORIGIN FOR THE GROUP (A): 60.7411 19.9857 23.2908 REMARK 3 T TENSOR REMARK 3 T11: 0.0517 T22: 0.1260 REMARK 3 T33: 0.0209 T12: 0.2069 REMARK 3 T13: -0.0556 T23: -0.0793 REMARK 3 L TENSOR REMARK 3 L11: 8.3053 L22: 9.3371 REMARK 3 L33: 0.9492 L12: -8.8022 REMARK 3 L13: 2.1961 L23: -2.3827 REMARK 3 S TENSOR REMARK 3 S11: -0.4467 S12: -0.4238 S13: -0.3516 REMARK 3 S21: 0.5648 S22: 0.5762 S23: 0.3865 REMARK 3 S31: -0.3518 S32: -0.5307 S33: -0.1296 REMARK 3 REMARK 3 TLS GROUP : 5 REMARK 3 NUMBER OF COMPONENTS GROUP : 2 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 1 A 1 REMARK 3 RESIDUE RANGE : A 4 A 305 REMARK 3 ORIGIN FOR THE GROUP (A): 59.9585 16.6177 23.6393 REMARK 3 T TENSOR REMARK 3 T11: 0.1595 T22: 0.1560 REMARK 3 T33: 0.1229 T12: 0.0760 REMARK 3 T13: -0.0385 T23: -0.0423 REMARK 3 L TENSOR REMARK 3 L11: 0.9845 L22: 0.9315 REMARK 3 L33: 0.4726 L12: -0.9577 REMARK 3 L13: -0.6821 L23: 0.6635 REMARK 3 S TENSOR REMARK 3 S11: -0.0121 S12: 0.1305 S13: 0.0002 REMARK 3 S21: 0.0276 S22: -0.1125 S23: 0.0221 REMARK 3 S31: -0.0558 S32: -0.1964 S33: 0.1246 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3AAF COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 20-NOV-09. REMARK 100 THE RCSB ID CODE IS RCSB029013. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 30-SEP-07; 19-JUL-08 REMARK 200 TEMPERATURE (KELVIN) : 90; 90 REMARK 200 PH : 9 REMARK 200 NUMBER OF CRYSTALS USED : 2 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y; Y REMARK 200 RADIATION SOURCE : SPRING-8; SPRING-8 REMARK 200 BEAMLINE : BL44XU; BL41XU REMARK 200 X-RAY GENERATOR MODEL : NULL; NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M; M REMARK 200 WAVELENGTH OR RANGE (A) : 0.9000; 1.0057, 1.0090, 1.0257 REMARK 200 MONOCHROMATOR : NULL; NULL REMARK 200 OPTICS : NULL; NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE; CCD REMARK 200 DETECTOR MANUFACTURER : BRUKER DIP-6040; RAYONIX MX225HE REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 41719 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.900 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 9.700 REMARK 200 R MERGE (I) : 0.04300 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 14.7000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.97 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.9 REMARK 200 DATA REDUNDANCY IN SHELL : 9.50 REMARK 200 R MERGE FOR SHELL (I) : 0.48800 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : 6.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH; MAD REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MAD REMARK 200 SOFTWARE USED: SHARP REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 62.38 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.27 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20% PEG 4000, 0.2M SODIUM ACETATE, REMARK 280 0.1M CAPS-NAOH, PH 9, VAPOR DIFFUSION, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y,X,Z+3/4 REMARK 290 4555 Y,-X,Z+1/4 REMARK 290 5555 -X,Y,-Z REMARK 290 6555 X,-Y,-Z+1/2 REMARK 290 7555 Y,X,-Z+1/4 REMARK 290 8555 -Y,-X,-Z+3/4 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 72.64550 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 108.96825 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 36.32275 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 72.64550 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 36.32275 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 108.96825 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 4230 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 16230 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -31.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D 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 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A 335 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 290 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 83 LIES ON A SPECIAL POSITION. REMARK 375 HOH B 258 LIES ON A SPECIAL POSITION. 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 GLY A 946 REMARK 465 ILE A 947 REMARK 465 ARG A 948 REMARK 465 MET A 949 REMARK 465 ASP A 950 REMARK 465 ASP A 951 REMARK 465 SER A 952 REMARK 465 GLU A 953 REMARK 465 ASP A 954 REMARK 465 THR A 955 REMARK 465 ALA A 1065 REMARK 465 ASN A 1066 REMARK 465 GLU A 1067 REMARK 465 GLU A 1068 REMARK 465 LEU A 1069 REMARK 465 CYS A 1070 REMARK 465 PRO A 1071 REMARK 465 LYS A 1072 REMARK 465 LYS A 1073 REMARK 465 PHE A 1074 REMARK 465 LEU A 1075 REMARK 465 LEU A 1076 REMARK 465 PRO A 1077 REMARK 465 SER A 1078 REMARK 465 SER A 1079 REMARK 465 GLY B 946 REMARK 465 ILE B 947 REMARK 465 ARG B 948 REMARK 465 MET B 949 REMARK 465 ASP B 950 REMARK 465 ASP B 951 REMARK 465 SER B 952 REMARK 465 GLU B 953 REMARK 465 ASP B 954 REMARK 465 THR B 955 REMARK 465 ALA B 1065 REMARK 465 ASN B 1066 REMARK 465 GLU B 1067 REMARK 465 GLU B 1068 REMARK 465 LEU B 1069 REMARK 465 CYS B 1070 REMARK 465 PRO B 1071 REMARK 465 LYS B 1072 REMARK 465 LYS B 1073 REMARK 465 PHE B 1074 REMARK 465 LEU B 1075 REMARK 465 LEU B 1076 REMARK 465 PRO B 1077 REMARK 465 SER B 1078 REMARK 465 SER B 1079 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O6 DG C 12 O HOH C 58 2.17 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 VAL B1029 CB - CA - C ANGL. DEV. = -12.8 DEGREES REMARK 500 DC C 3 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DC C 4 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DT C 5 O4' - C1' - N1 ANGL. DEV. = 1.9 DEGREES REMARK 500 DG C 12 O4' - C1' - N9 ANGL. DEV. = 2.2 DEGREES REMARK 500 DG C 11 C3' - O3' - P ANGL. DEV. = 11.1 DEGREES REMARK 500 DG C 13 O4' - C4' - C3' ANGL. DEV. = -2.9 DEGREES REMARK 500 DG C 13 C3' - C2' - C1' ANGL. DEV. = -4.9 DEGREES REMARK 500 DG C 13 C3' - O3' - P ANGL. DEV. = 8.3 DEGREES REMARK 500 DC D 4 O4' - C1' - N1 ANGL. DEV. = 2.6 DEGREES REMARK 500 DG D 12 O4' - C1' - N9 ANGL. DEV. = 2.5 DEGREES REMARK 500 DT D 14 O4' - C1' - N1 ANGL. DEV. = 2.3 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 TYR A1034 -72.06 77.31 REMARK 500 TYR B1034 -61.48 72.35 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 262 DISTANCE = 5.60 ANGSTROMS REMARK 525 HOH B 220 DISTANCE = 6.40 ANGSTROMS REMARK 525 HOH B 258 DISTANCE = 5.01 ANGSTROMS REMARK 525 HOH B 268 DISTANCE = 5.76 ANGSTROMS REMARK 525 HOH B 278 DISTANCE = 5.07 ANGSTROMS REMARK 525 HOH B 291 DISTANCE = 7.35 ANGSTROMS REMARK 525 HOH B 292 DISTANCE = 5.14 ANGSTROMS REMARK 525 HOH B 304 DISTANCE = 6.65 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACT A 1 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACT B 2 DBREF 3AAF A 949 1079 UNP Q14191 WRN_HUMAN 949 1079 DBREF 3AAF B 949 1079 UNP Q14191 WRN_HUMAN 949 1079 DBREF 3AAF C 1 14 PDB 3AAF 3AAF 1 14 DBREF 3AAF D 1 14 PDB 3AAF 3AAF 1 14 SEQADV 3AAF GLY A 946 UNP Q14191 EXPRESSION TAG SEQADV 3AAF ILE A 947 UNP Q14191 EXPRESSION TAG SEQADV 3AAF ARG A 948 UNP Q14191 EXPRESSION TAG SEQADV 3AAF GLY B 946 UNP Q14191 EXPRESSION TAG SEQADV 3AAF ILE B 947 UNP Q14191 EXPRESSION TAG SEQADV 3AAF ARG B 948 UNP Q14191 EXPRESSION TAG SEQRES 1 A 134 GLY ILE ARG MET ASP ASP SER GLU ASP THR SER TRP ASP SEQRES 2 A 134 PHE GLY PRO GLN ALA PHE LYS LEU LEU SER ALA VAL ASP SEQRES 3 A 134 ILE LEU GLY GLU LYS PHE GLY ILE GLY LEU PRO ILE LEU SEQRES 4 A 134 PHE LEU ARG GLY SER ASN SER GLN ARG LEU ALA ASP GLN SEQRES 5 A 134 TYR ARG ARG HIS SER LEU PHE GLY THR GLY LYS ASP GLN SEQRES 6 A 134 THR GLU SER TRP TRP LYS ALA PHE SER ARG GLN LEU ILE SEQRES 7 A 134 THR GLU GLY PHE LEU VAL GLU VAL SER ARG TYR ASN LYS SEQRES 8 A 134 PHE MET LYS ILE CYS ALA LEU THR LYS LYS GLY ARG ASN SEQRES 9 A 134 TRP LEU HIS LYS ALA ASN THR GLU SER GLN SER LEU ILE SEQRES 10 A 134 LEU GLN ALA ASN GLU GLU LEU CYS PRO LYS LYS PHE LEU SEQRES 11 A 134 LEU PRO SER SER SEQRES 1 B 134 GLY ILE ARG MET ASP ASP SER GLU ASP THR SER TRP ASP SEQRES 2 B 134 PHE GLY PRO GLN ALA PHE LYS LEU LEU SER ALA VAL ASP SEQRES 3 B 134 ILE LEU GLY GLU LYS PHE GLY ILE GLY LEU PRO ILE LEU SEQRES 4 B 134 PHE LEU ARG GLY SER ASN SER GLN ARG LEU ALA ASP GLN SEQRES 5 B 134 TYR ARG ARG HIS SER LEU PHE GLY THR GLY LYS ASP GLN SEQRES 6 B 134 THR GLU SER TRP TRP LYS ALA PHE SER ARG GLN LEU ILE SEQRES 7 B 134 THR GLU GLY PHE LEU VAL GLU VAL SER ARG TYR ASN LYS SEQRES 8 B 134 PHE MET LYS ILE CYS ALA LEU THR LYS LYS GLY ARG ASN SEQRES 9 B 134 TRP LEU HIS LYS ALA ASN THR GLU SER GLN SER LEU ILE SEQRES 10 B 134 LEU GLN ALA ASN GLU GLU LEU CYS PRO LYS LYS PHE LEU SEQRES 11 B 134 LEU PRO SER SER SEQRES 1 C 14 DA DC DC DC DT DA DA DT DT DA DG DG DG SEQRES 2 C 14 DT SEQRES 1 D 14 DA DC DC DC DT DA DA DT DT DA DG DG DG SEQRES 2 D 14 DT HET ACT A 1 4 HET ACT B 2 4 HETNAM ACT ACETATE ION FORMUL 5 ACT 2(C2 H3 O2 1-) FORMUL 7 HOH *338(H2 O) HELIX 1 1 PHE A 959 LEU A 973 1 15 HELIX 2 2 ILE A 979 ARG A 987 1 9 HELIX 3 3 ALA A 995 HIS A 1001 5 7 HELIX 4 4 THR A 1011 GLU A 1025 1 15 HELIX 5 5 THR A 1044 ASN A 1055 1 12 HELIX 6 6 PHE B 959 LEU B 973 1 15 HELIX 7 7 ILE B 979 ARG B 987 1 9 HELIX 8 8 ALA B 995 HIS B 1001 5 7 HELIX 9 9 THR B 1011 GLU B 1025 1 15 HELIX 10 10 THR B 1044 ASN B 1055 1 12 SHEET 1 A 2 TRP A 957 ASP A 958 0 SHEET 2 A 2 ILE A1062 LEU A1063 -1 O LEU A1063 N TRP A 957 SHEET 1 B 2 LEU A1028 SER A1032 0 SHEET 2 B 2 LYS A1039 LEU A1043 -1 O ALA A1042 N VAL A1029 SHEET 1 C 2 TRP B 957 ASP B 958 0 SHEET 2 C 2 ILE B1062 LEU B1063 -1 O LEU B1063 N TRP B 957 SHEET 1 D 2 LEU B1028 SER B1032 0 SHEET 2 D 2 LYS B1039 LEU B1043 -1 O ALA B1042 N VAL B1029 SITE 1 AC1 6 HOH A 48 HOH A 56 ARG A1033 TYR A1034 SITE 2 AC1 6 ARG A1048 HIS A1052 SITE 1 AC2 4 HOH B 51 HOH B 313 HIS B1052 ASN B1055 CRYST1 84.077 84.077 145.291 90.00 90.00 90.00 P 43 2 2 16 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 0.011894 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011894 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006883 0.00000 ATOM 1 N SER A 956 35.535 12.622 48.759 1.00 47.45 N ATOM 2 CA SER A 956 35.750 14.084 48.996 1.00 47.33 C ATOM 3 C SER A 956 37.069 14.397 49.697 1.00 46.90 C ATOM 4 O SER A 956 37.441 13.737 50.670 1.00 46.77 O ATOM 5 CB SER A 956 34.586 14.688 49.791 1.00 47.56 C ATOM 6 OG SER A 956 33.659 15.320 48.924 1.00 48.81 O ATOM 7 N TRP A 957 37.761 15.417 49.196 1.00 46.45 N ATOM 8 CA TRP A 957 39.028 15.852 49.767 1.00 45.80 C ATOM 9 C TRP A 957 39.101 17.386 49.825 1.00 44.79 C ATOM 10 O TRP A 957 38.550 18.079 48.969 1.00 44.41 O ATOM 11 CB TRP A 957 40.206 15.267 48.971 1.00 46.60 C ATOM 12 CG TRP A 957 41.539 15.561 49.589 1.00 47.48 C ATOM 13 CD1 TRP A 957 42.378 16.595 49.275 1.00 48.73 C ATOM 14 CD2 TRP A 957 42.177 14.832 50.645 1.00 48.32 C ATOM 15 NE1 TRP A 957 43.501 16.552 50.070 1.00 49.29 N ATOM 16 CE2 TRP A 957 43.405 15.480 50.918 1.00 48.70 C ATOM 17 CE3 TRP A 957 41.833 13.691 51.385 1.00 48.44 C ATOM 18 CZ2 TRP A 957 44.293 15.027 51.903 1.00 48.33 C ATOM 19 CZ3 TRP A 957 42.718 13.237 52.368 1.00 48.68 C ATOM 20 CH2 TRP A 957 43.935 13.906 52.614 1.00 48.46 C ATOM 21 N ASP A 958 39.775 17.899 50.849 1.00 43.67 N ATOM 22 CA ASP A 958 39.953 19.339 51.024 1.00 42.82 C ATOM 23 C ASP A 958 41.228 19.804 50.325 1.00 42.25 C ATOM 24 O ASP A 958 42.342 19.502 50.774 1.00 42.41 O ATOM 25 CB ASP A 958 40.007 19.680 52.514 1.00 42.90 C ATOM 26 CG ASP A 958 40.161 21.173 52.777 1.00 42.45 C ATOM 27 OD1 ASP A 958 40.138 21.975 51.820 1.00 40.93 O ATOM 28 OD2 ASP A 958 40.303 21.545 53.961 1.00 42.89 O ATOM 29 N PHE A 959 41.058 20.541 49.232 1.00 41.12 N ATOM 30 CA PHE A 959 42.185 21.036 48.445 1.00 40.63 C ATOM 31 C PHE A 959 42.508 22.505 48.728 1.00 40.04 C ATOM 32 O PHE A 959 43.145 23.162 47.911 1.00 39.57 O ATOM 33 CB PHE A 959 41.914 20.866 46.948 1.00 40.89 C ATOM 34 CG PHE A 959 41.919 19.438 46.490 1.00 41.18 C ATOM 35 CD1 PHE A 959 43.115 18.798 46.178 1.00 42.49 C ATOM 36 CD2 PHE A 959 40.728 18.731 46.373 1.00 41.89 C ATOM 37 CE1 PHE A 959 43.128 17.458 45.753 1.00 42.48 C ATOM 38 CE2 PHE A 959 40.724 17.394 45.946 1.00 42.88 C ATOM 39 CZ PHE A 959 41.929 16.758 45.638 1.00 42.64 C ATOM 40 N GLY A 960 42.074 23.002 49.882 1.00 39.77 N ATOM 41 CA GLY A 960 42.299 24.403 50.279 1.00 39.54 C ATOM 42 C GLY A 960 43.739 24.894 50.196 1.00 39.72 C ATOM 43 O GLY A 960 43.987 25.993 49.688 1.00 40.49 O ATOM 44 N PRO A 961 44.707 24.114 50.729 1.00 39.74 N ATOM 45 CA PRO A 961 46.102 24.557 50.626 1.00 39.55 C ATOM 46 C PRO A 961 46.580 24.745 49.180 1.00 39.54 C ATOM 47 O PRO A 961 47.271 25.720 48.881 1.00 39.61 O ATOM 48 CB PRO A 961 46.873 23.432 51.326 1.00 39.57 C ATOM 49 CG PRO A 961 45.872 22.838 52.278 1.00 39.61 C ATOM 50 CD PRO A 961 44.591 22.867 51.506 1.00 39.84 C ATOM 51 N GLN A 962 46.195 23.831 48.294 1.00 39.06 N ATOM 52 CA GLN A 962 46.569 23.914 46.881 1.00 39.16 C ATOM 53 C GLN A 962 45.820 25.034 46.171 1.00 38.73 C ATOM 54 O GLN A 962 46.391 25.729 45.328 1.00 38.92 O ATOM 55 CB GLN A 962 46.313 22.580 46.172 1.00 39.22 C ATOM 56 CG GLN A 962 47.255 21.448 46.579 1.00 40.63 C ATOM 57 CD GLN A 962 46.956 20.894 47.959 1.00 43.29 C ATOM 58 OE1 GLN A 962 45.807 20.895 48.413 1.00 44.11 O ATOM 59 NE2 GLN A 962 47.995 20.424 48.640 1.00 45.39 N ATOM 60 N ALA A 963 44.541 25.194 46.499 1.00 38.35 N ATOM 61 CA ALA A 963 43.741 26.311 45.971 1.00 37.93 C ATOM 62 C ALA A 963 44.320 27.653 46.390 1.00 38.28 C ATOM 63 O ALA A 963 44.328 28.596 45.600 1.00 38.10 O ATOM 64 CB ALA A 963 42.310 26.207 46.427 1.00 37.92 C ATOM 65 N PHE A 964 44.787 27.752 47.633 1.00 38.14 N ATOM 66 CA PHE A 964 45.421 28.991 48.061 1.00 38.43 C ATOM 67 C PHE A 964 46.603 29.339 47.151 1.00 38.14 C ATOM 68 O PHE A 964 46.704 30.469 46.689 1.00 39.18 O ATOM 69 CB PHE A 964 45.871 28.966 49.523 1.00 38.75 C ATOM 70 CG PHE A 964 46.539 30.251 49.948 1.00 40.01 C ATOM 71 CD1 PHE A 964 45.776 31.399 50.180 1.00 40.42 C ATOM 72 CD2 PHE A 964 47.920 30.335 50.046 1.00 40.94 C ATOM 73 CE1 PHE A 964 46.376 32.600 50.539 1.00 40.73 C ATOM 74 CE2 PHE A 964 48.538 31.529 50.406 1.00 40.87 C ATOM 75 CZ PHE A 964 47.764 32.664 50.664 1.00 40.89 C ATOM 76 N LYS A 965 47.477 28.371 46.887 1.00 37.85 N ATOM 77 CA LYS A 965 48.634 28.601 46.034 1.00 37.74 C ATOM 78 C LYS A 965 48.223 29.017 44.624 1.00 37.43 C ATOM 79 O LYS A 965 48.755 29.997 44.077 1.00 36.66 O ATOM 80 CB LYS A 965 49.534 27.351 45.980 1.00 37.63 C ATOM 81 CG LYS A 965 50.309 27.109 47.273 1.00 38.16 C ATOM 82 CD LYS A 965 51.039 25.772 47.274 1.00 38.75 C ATOM 83 CE LYS A 965 51.678 25.518 48.633 1.00 40.94 C ATOM 84 NZ LYS A 965 52.394 24.214 48.636 1.00 44.17 N ATOM 85 N LEU A 966 47.295 28.268 44.025 1.00 37.36 N ATOM 86 CA LEU A 966 46.961 28.510 42.620 1.00 37.97 C ATOM 87 C LEU A 966 46.171 29.804 42.447 1.00 38.24 C ATOM 88 O LEU A 966 46.490 30.610 41.547 1.00 38.49 O ATOM 89 CB LEU A 966 46.224 27.318 41.978 1.00 37.89 C ATOM 90 CG LEU A 966 45.879 27.464 40.483 1.00 38.84 C ATOM 91 CD1 LEU A 966 47.130 27.613 39.638 1.00 39.80 C ATOM 92 CD2 LEU A 966 45.051 26.282 39.986 1.00 38.13 C ATOM 93 N LEU A 967 45.164 30.027 43.295 1.00 38.11 N ATOM 94 CA LEU A 967 44.388 31.277 43.181 1.00 38.74 C ATOM 95 C LEU A 967 45.273 32.485 43.513 1.00 38.92 C ATOM 96 O LEU A 967 45.158 33.525 42.869 1.00 39.16 O ATOM 97 CB LEU A 967 43.104 31.268 44.026 1.00 38.95 C ATOM 98 CG LEU A 967 42.078 30.135 43.784 1.00 40.89 C ATOM 99 CD1 LEU A 967 40.825 30.378 44.604 1.00 41.34 C ATOM 100 CD2 LEU A 967 41.704 29.925 42.332 1.00 41.72 C ATOM 101 N SER A 968 46.174 32.331 44.491 1.00 38.91 N ATOM 102 CA SER A 968 47.148 33.379 44.795 1.00 38.88 C ATOM 103 C SER A 968 48.011 33.667 43.574 1.00 39.04 C ATOM 104 O SER A 968 48.221 34.821 43.231 1.00 38.72 O ATOM 105 CB SER A 968 48.028 32.990 45.978 1.00 39.49 C ATOM 106 OG SER A 968 47.290 33.062 47.189 1.00 39.27 O ATOM 107 N ALA A 969 48.469 32.605 42.905 1.00 39.00 N ATOM 108 CA ALA A 969 49.347 32.736 41.741 1.00 39.37 C ATOM 109 C ALA A 969 48.672 33.491 40.599 1.00 39.16 C ATOM 110 O ALA A 969 49.287 34.360 39.975 1.00 39.34 O ATOM 111 CB ALA A 969 49.804 31.376 41.274 1.00 39.25 C ATOM 112 N VAL A 970 47.418 33.141 40.312 1.00 39.31 N ATOM 113 CA VAL A 970 46.612 33.866 39.331 1.00 39.58 C ATOM 114 C VAL A 970 46.552 35.374 39.639 1.00 40.45 C ATOM 115 O VAL A 970 46.744 36.217 38.747 1.00 40.91 O ATOM 116 CB VAL A 970 45.173 33.259 39.226 1.00 39.33 C ATOM 117 CG1 VAL A 970 44.232 34.196 38.443 1.00 39.16 C ATOM 118 CG2 VAL A 970 45.231 31.890 38.575 1.00 39.68 C ATOM 119 N ASP A 971 46.281 35.714 40.898 1.00 40.65 N ATOM 120 CA ASP A 971 46.180 37.117 41.309 1.00 40.85 C ATOM 121 C ASP A 971 47.530 37.817 41.203 1.00 40.06 C ATOM 122 O ASP A 971 47.613 38.957 40.744 1.00 39.51 O ATOM 123 CB ASP A 971 45.682 37.234 42.754 1.00 41.50 C ATOM 124 CG ASP A 971 45.702 38.687 43.267 1.00 45.47 C ATOM 125 OD1 ASP A 971 44.754 39.435 42.970 1.00 47.98 O ATOM 126 OD2 ASP A 971 46.683 39.089 43.943 1.00 49.27 O ATOM 127 N ILE A 972 48.583 37.133 41.648 1.00 38.61 N ATOM 128 CA ILE A 972 49.926 37.706 41.669 1.00 38.98 C ATOM 129 C ILE A 972 50.382 38.097 40.265 1.00 38.45 C ATOM 130 O ILE A 972 51.004 39.154 40.085 1.00 38.19 O ATOM 131 CB ILE A 972 50.941 36.725 42.296 1.00 38.87 C ATOM 132 CG1 ILE A 972 50.722 36.615 43.810 1.00 38.31 C ATOM 133 CG2 ILE A 972 52.373 37.155 42.027 1.00 40.22 C ATOM 134 CD1 ILE A 972 51.269 35.309 44.396 1.00 37.40 C ATOM 135 N LEU A 973 50.059 37.257 39.283 1.00 38.36 N ATOM 136 CA LEU A 973 50.441 37.532 37.889 1.00 38.85 C ATOM 137 C LEU A 973 49.470 38.480 37.165 1.00 38.83 C ATOM 138 O LEU A 973 49.627 38.770 35.968 1.00 38.83 O ATOM 139 CB LEU A 973 50.669 36.232 37.124 1.00 39.39 C ATOM 140 CG LEU A 973 51.907 35.456 37.593 1.00 40.94 C ATOM 141 CD1 LEU A 973 51.860 34.030 37.117 1.00 42.04 C ATOM 142 CD2 LEU A 973 53.167 36.103 37.070 1.00 43.98 C ATOM 143 N GLY A 974 48.475 38.964 37.901 1.00 38.38 N ATOM 144 CA GLY A 974 47.578 40.006 37.417 1.00 39.40 C ATOM 145 C GLY A 974 46.539 39.573 36.403 1.00 40.24 C ATOM 146 O GLY A 974 46.025 40.404 35.686 1.00 39.94 O ATOM 147 N GLU A 975 46.233 38.274 36.346 1.00 41.26 N ATOM 148 CA GLU A 975 45.210 37.734 35.440 1.00 42.93 C ATOM 149 C GLU A 975 45.503 38.121 33.991 1.00 42.88 C ATOM 150 O GLU A 975 44.593 38.337 33.183 1.00 42.72 O ATOM 151 CB GLU A 975 43.804 38.185 35.865 1.00 42.71 C ATOM 152 CG GLU A 975 43.394 37.756 37.282 1.00 44.70 C ATOM 153 CD GLU A 975 41.993 38.247 37.662 1.00 45.75 C ATOM 154 OE1 GLU A 975 41.348 37.631 38.535 1.00 48.76 O ATOM 155 OE2 GLU A 975 41.522 39.247 37.073 1.00 52.06 O ATOM 156 N LYS A 976 46.793 38.205 33.678 1.00 42.37 N ATOM 157 CA LYS A 976 47.241 38.667 32.382 1.00 42.48 C ATOM 158 C LYS A 976 47.536 37.501 31.468 1.00 41.74 C ATOM 159 O LYS A 976 47.797 37.703 30.290 1.00 41.98 O ATOM 160 CB LYS A 976 48.483 39.552 32.537 1.00 43.03 C ATOM 161 CG LYS A 976 48.167 40.985 32.975 1.00 45.32 C ATOM 162 CD LYS A 976 47.718 41.867 31.792 1.00 49.26 C ATOM 163 CE LYS A 976 48.879 42.187 30.843 1.00 50.42 C ATOM 164 NZ LYS A 976 48.463 42.910 29.611 1.00 51.82 N ATOM 165 N PHE A 977 47.457 36.285 32.011 1.00 40.56 N ATOM 166 CA PHE A 977 47.844 35.078 31.296 1.00 39.98 C ATOM 167 C PHE A 977 46.803 33.992 31.482 1.00 38.97 C ATOM 168 O PHE A 977 45.872 34.146 32.275 1.00 38.22 O ATOM 169 CB PHE A 977 49.211 34.566 31.787 1.00 40.05 C ATOM 170 CG PHE A 977 50.325 35.569 31.636 1.00 41.16 C ATOM 171 CD1 PHE A 977 50.984 35.727 30.418 1.00 43.04 C ATOM 172 CD2 PHE A 977 50.723 36.345 32.718 1.00 42.12 C ATOM 173 CE1 PHE A 977 52.013 36.654 30.276 1.00 44.12 C ATOM 174 CE2 PHE A 977 51.743 37.281 32.584 1.00 42.95 C ATOM 175 CZ PHE A 977 52.386 37.439 31.369 1.00 42.31 C ATOM 176 N GLY A 978 46.966 32.905 30.731 1.00 39.10 N ATOM 177 CA GLY A 978 46.251 31.674 30.990 1.00 39.01 C ATOM 178 C GLY A 978 46.846 31.062 32.248 1.00 39.63 C ATOM 179 O GLY A 978 47.650 31.699 32.937 1.00 40.20 O ATOM 180 N ILE A 979 46.461 29.832 32.544 1.00 39.33 N ATOM 181 CA ILE A 979 46.881 29.172 33.792 1.00 39.35 C ATOM 182 C ILE A 979 48.341 28.676 33.771 1.00 39.21 C ATOM 183 O ILE A 979 48.916 28.373 34.823 1.00 39.27 O ATOM 184 CB ILE A 979 45.917 28.006 34.147 1.00 39.25 C ATOM 185 CG1 ILE A 979 45.982 27.691 35.653 1.00 38.00 C ATOM 186 CG2 ILE A 979 46.214 26.768 33.309 1.00 39.79 C ATOM 187 CD1 ILE A 979 45.433 28.814 36.523 1.00 37.15 C ATOM 188 N GLY A 980 48.940 28.636 32.587 1.00 38.81 N ATOM 189 CA GLY A 980 50.307 28.138 32.418 1.00 38.76 C ATOM 190 C GLY A 980 51.325 28.938 33.212 1.00 38.79 C ATOM 191 O GLY A 980 52.185 28.370 33.866 1.00 38.41 O ATOM 192 N LEU A 981 51.228 30.262 33.166 1.00 38.94 N ATOM 193 CA LEU A 981 52.183 31.087 33.891 1.00 39.19 C ATOM 194 C LEU A 981 52.043 30.959 35.411 1.00 38.37 C ATOM 195 O LEU A 981 53.051 30.712 36.082 1.00 38.02 O ATOM 196 CB LEU A 981 52.180 32.543 33.413 1.00 40.33 C ATOM 197 CG LEU A 981 53.419 32.657 32.520 1.00 43.60 C ATOM 198 CD1 LEU A 981 53.110 33.227 31.161 1.00 46.37 C ATOM 199 CD2 LEU A 981 54.571 33.387 33.204 1.00 45.22 C ATOM 200 N PRO A 982 50.811 31.082 35.953 1.00 37.60 N ATOM 201 CA PRO A 982 50.657 30.716 37.374 1.00 37.38 C ATOM 202 C PRO A 982 51.314 29.383 37.777 1.00 36.96 C ATOM 203 O PRO A 982 51.937 29.316 38.835 1.00 37.16 O ATOM 204 CB PRO A 982 49.140 30.683 37.563 1.00 37.48 C ATOM 205 CG PRO A 982 48.657 31.812 36.609 1.00 37.35 C ATOM 206 CD PRO A 982 49.550 31.627 35.389 1.00 38.27 C ATOM 207 N ILE A 983 51.212 28.353 36.938 1.00 36.61 N ATOM 208 CA ILE A 983 51.797 27.044 37.269 1.00 37.00 C ATOM 209 C ILE A 983 53.327 27.059 37.200 1.00 36.89 C ATOM 210 O ILE A 983 53.994 26.486 38.073 1.00 37.51 O ATOM 211 CB ILE A 983 51.207 25.904 36.407 1.00 37.13 C ATOM 212 CG1 ILE A 983 49.726 25.699 36.759 1.00 37.45 C ATOM 213 CG2 ILE A 983 52.007 24.597 36.595 1.00 37.76 C ATOM 214 CD1 ILE A 983 48.942 24.876 35.712 1.00 37.39 C ATOM 215 N LEU A 984 53.879 27.687 36.162 1.00 36.29 N ATOM 216 CA LEU A 984 55.329 27.879 36.052 1.00 36.14 C ATOM 217 C LEU A 984 55.891 28.548 37.304 1.00 35.98 C ATOM 218 O LEU A 984 56.896 28.108 37.871 1.00 35.69 O ATOM 219 CB LEU A 984 55.658 28.717 34.817 1.00 36.38 C ATOM 220 CG LEU A 984 55.550 27.995 33.463 1.00 36.42 C ATOM 221 CD1 LEU A 984 55.742 28.998 32.346 1.00 37.34 C ATOM 222 CD2 LEU A 984 56.564 26.864 33.339 1.00 37.50 C ATOM 223 N PHE A 985 55.205 29.604 37.726 1.00 35.69 N ATOM 224 CA PHE A 985 55.489 30.306 38.979 1.00 35.79 C ATOM 225 C PHE A 985 55.503 29.369 40.191 1.00 35.39 C ATOM 226 O PHE A 985 56.471 29.358 40.951 1.00 35.37 O ATOM 227 CB PHE A 985 54.472 31.444 39.157 1.00 35.38 C ATOM 228 CG PHE A 985 54.516 32.114 40.508 1.00 36.07 C ATOM 229 CD1 PHE A 985 55.456 33.095 40.779 1.00 34.43 C ATOM 230 CD2 PHE A 985 53.582 31.789 41.493 1.00 36.33 C ATOM 231 CE1 PHE A 985 55.486 33.730 42.022 1.00 34.64 C ATOM 232 CE2 PHE A 985 53.604 32.423 42.746 1.00 35.64 C ATOM 233 CZ PHE A 985 54.560 33.392 43.004 1.00 35.50 C ATOM 234 N LEU A 986 54.439 28.585 40.367 1.00 35.43 N ATOM 235 CA LEU A 986 54.329 27.698 41.531 1.00 35.87 C ATOM 236 C LEU A 986 55.361 26.593 41.492 1.00 36.10 C ATOM 237 O LEU A 986 55.845 26.157 42.534 1.00 36.57 O ATOM 238 CB LEU A 986 52.942 27.066 41.643 1.00 35.80 C ATOM 239 CG LEU A 986 51.775 27.967 42.057 1.00 36.50 C ATOM 240 CD1 LEU A 986 50.485 27.169 42.028 1.00 36.93 C ATOM 241 CD2 LEU A 986 52.027 28.564 43.440 1.00 35.09 C ATOM 242 N ARG A 987 55.698 26.137 40.292 1.00 36.47 N ATOM 243 CA ARG A 987 56.644 25.026 40.166 1.00 36.85 C ATOM 244 C ARG A 987 58.106 25.475 40.155 1.00 36.85 C ATOM 245 O ARG A 987 59.012 24.646 40.050 1.00 37.18 O ATOM 246 CB ARG A 987 56.287 24.147 38.960 1.00 37.15 C ATOM 247 CG ARG A 987 54.860 23.590 39.052 1.00 38.03 C ATOM 248 CD ARG A 987 54.630 22.372 38.176 1.00 39.49 C ATOM 249 NE ARG A 987 55.489 21.242 38.549 1.00 38.45 N ATOM 250 CZ ARG A 987 56.518 20.822 37.820 1.00 40.77 C ATOM 251 NH1 ARG A 987 56.812 21.432 36.671 1.00 40.33 N ATOM 252 NH2 ARG A 987 57.249 19.789 38.231 1.00 40.54 N ATOM 253 N GLY A 988 58.337 26.779 40.293 1.00 36.65 N ATOM 254 CA GLY A 988 59.697 27.313 40.408 1.00 36.50 C ATOM 255 C GLY A 988 60.471 27.322 39.102 1.00 36.59 C ATOM 256 O GLY A 988 61.673 27.079 39.083 1.00 35.81 O ATOM 257 N SER A 989 59.775 27.631 38.014 1.00 36.63 N ATOM 258 CA SER A 989 60.348 27.620 36.671 1.00 37.41 C ATOM 259 C SER A 989 61.415 28.691 36.436 1.00 38.29 C ATOM 260 O SER A 989 61.315 29.805 36.949 1.00 38.32 O ATOM 261 CB SER A 989 59.236 27.784 35.634 1.00 36.88 C ATOM 262 OG SER A 989 59.779 27.852 34.329 1.00 36.66 O ATOM 263 N ASN A 990 62.426 28.343 35.643 1.00 39.23 N ATOM 264 CA ASN A 990 63.404 29.316 35.167 1.00 40.72 C ATOM 265 C ASN A 990 63.023 29.930 33.818 1.00 41.53 C ATOM 266 O ASN A 990 63.837 30.608 33.190 1.00 41.65 O ATOM 267 CB ASN A 990 64.804 28.688 35.101 1.00 41.14 C ATOM 268 CG ASN A 990 65.444 28.559 36.464 1.00 42.43 C ATOM 269 OD1 ASN A 990 65.416 29.495 37.259 1.00 45.99 O ATOM 270 ND2 ASN A 990 66.030 27.397 36.745 1.00 44.00 N ATOM 271 N SER A 991 61.777 29.706 33.396 1.00 42.47 N ATOM 272 CA SER A 991 61.289 30.140 32.084 1.00 43.94 C ATOM 273 C SER A 991 61.433 31.630 31.821 1.00 44.72 C ATOM 274 O SER A 991 61.178 32.462 32.707 1.00 44.99 O ATOM 275 CB SER A 991 59.821 29.753 31.896 1.00 43.90 C ATOM 276 OG SER A 991 59.315 30.263 30.668 1.00 45.49 O ATOM 277 N GLN A 992 61.804 31.948 30.581 1.00 45.28 N ATOM 278 CA GLN A 992 61.840 33.316 30.065 1.00 46.41 C ATOM 279 C GLN A 992 60.472 33.982 30.151 1.00 46.42 C ATOM 280 O GLN A 992 60.388 35.201 30.263 1.00 47.08 O ATOM 281 CB GLN A 992 62.314 33.335 28.599 1.00 46.36 C ATOM 282 CG GLN A 992 61.287 32.801 27.582 1.00 46.65 C ATOM 283 CD GLN A 992 61.767 32.841 26.136 1.00 47.59 C ATOM 284 OE1 GLN A 992 62.938 33.110 25.860 1.00 49.54 O ATOM 285 NE2 GLN A 992 60.855 32.561 25.201 1.00 48.75 N ATOM 286 N ARG A 993 59.414 33.173 30.067 1.00 46.63 N ATOM 287 CA ARG A 993 58.030 33.646 30.056 1.00 46.59 C ATOM 288 C ARG A 993 57.677 34.359 31.362 1.00 46.33 C ATOM 289 O ARG A 993 56.812 35.251 31.380 1.00 46.24 O ATOM 290 CB ARG A 993 57.058 32.477 29.832 1.00 46.52 C ATOM 291 CG ARG A 993 57.068 31.865 28.419 1.00 47.10 C ATOM 292 CD ARG A 993 56.079 30.694 28.309 1.00 47.65 C ATOM 293 NE ARG A 993 54.672 31.119 28.386 1.00 50.30 N ATOM 294 CZ ARG A 993 53.649 30.330 28.729 1.00 51.54 C ATOM 295 NH1 ARG A 993 53.838 29.057 29.045 1.00 52.52 N ATOM 296 NH2 ARG A 993 52.418 30.820 28.768 1.00 55.02 N ATOM 297 N LEU A 994 58.348 33.955 32.443 1.00 45.88 N ATOM 298 CA LEU A 994 58.093 34.479 33.781 1.00 45.93 C ATOM 299 C LEU A 994 59.139 35.512 34.179 1.00 46.31 C ATOM 300 O LEU A 994 60.333 35.205 34.241 1.00 46.44 O ATOM 301 CB LEU A 994 58.055 33.343 34.813 1.00 45.35 C ATOM 302 CG LEU A 994 57.730 33.731 36.261 1.00 45.00 C ATOM 303 CD1 LEU A 994 56.244 33.957 36.456 1.00 43.10 C ATOM 304 CD2 LEU A 994 58.224 32.675 37.231 1.00 43.86 C ATOM 305 N ALA A 995 58.679 36.732 34.459 1.00 46.29 N ATOM 306 CA ALA A 995 59.559 37.838 34.848 1.00 46.75 C ATOM 307 C ALA A 995 60.261 37.556 36.171 1.00 46.92 C ATOM 308 O ALA A 995 59.680 36.936 37.070 1.00 46.89 O ATOM 309 CB ALA A 995 58.768 39.143 34.921 1.00 46.84 C ATOM 310 N ASP A 996 61.510 38.014 36.283 1.00 47.19 N ATOM 311 CA ASP A 996 62.340 37.771 37.466 1.00 47.38 C ATOM 312 C ASP A 996 61.781 38.331 38.760 1.00 47.14 C ATOM 313 O ASP A 996 62.058 37.796 39.832 1.00 46.99 O ATOM 314 CB ASP A 996 63.759 38.316 37.264 1.00 47.92 C ATOM 315 CG ASP A 996 64.664 37.336 36.544 1.00 49.32 C ATOM 316 OD1 ASP A 996 64.290 36.148 36.423 1.00 51.08 O ATOM 317 OD2 ASP A 996 65.752 37.757 36.096 1.00 50.19 O ATOM 318 N GLN A 997 61.005 39.408 38.669 1.00 46.97 N ATOM 319 CA GLN A 997 60.445 40.035 39.868 1.00 46.82 C ATOM 320 C GLN A 997 59.615 39.029 40.669 1.00 45.92 C ATOM 321 O GLN A 997 59.568 39.101 41.896 1.00 45.80 O ATOM 322 CB GLN A 997 59.629 41.284 39.509 1.00 47.17 C ATOM 323 CG GLN A 997 58.140 41.190 39.793 1.00 50.18 C ATOM 324 CD GLN A 997 57.286 41.799 38.701 1.00 53.66 C ATOM 325 OE1 GLN A 997 57.514 41.562 37.511 1.00 55.35 O ATOM 326 NE2 GLN A 997 56.276 42.572 39.100 1.00 54.29 N ATOM 327 N TYR A 998 58.990 38.080 39.967 1.00 44.96 N ATOM 328 CA TYR A 998 58.137 37.067 40.596 1.00 44.06 C ATOM 329 C TYR A 998 58.908 35.986 41.350 1.00 43.65 C ATOM 330 O TYR A 998 58.363 35.352 42.253 1.00 43.51 O ATOM 331 CB TYR A 998 57.213 36.427 39.561 1.00 43.86 C ATOM 332 CG TYR A 998 56.276 37.416 38.918 1.00 43.31 C ATOM 333 CD1 TYR A 998 55.285 38.051 39.671 1.00 42.95 C ATOM 334 CD2 TYR A 998 56.385 37.732 37.562 1.00 42.86 C ATOM 335 CE1 TYR A 998 54.422 38.972 39.094 1.00 42.55 C ATOM 336 CE2 TYR A 998 55.521 38.655 36.972 1.00 43.24 C ATOM 337 CZ TYR A 998 54.541 39.272 37.752 1.00 43.75 C ATOM 338 OH TYR A 998 53.661 40.174 37.190 1.00 43.59 O ATOM 339 N ARG A 999 60.174 35.796 40.989 1.00 43.17 N ATOM 340 CA ARG A 999 61.027 34.797 41.631 1.00 43.12 C ATOM 341 C ARG A 999 61.397 35.224 43.054 1.00 43.10 C ATOM 342 O ARG A 999 61.909 34.424 43.839 1.00 42.61 O ATOM 343 CB ARG A 999 62.277 34.515 40.781 1.00 42.84 C ATOM 344 CG ARG A 999 61.925 34.055 39.367 1.00 42.76 C ATOM 345 CD ARG A 999 63.085 33.419 38.589 1.00 43.44 C ATOM 346 NE ARG A 999 62.529 32.607 37.506 1.00 44.75 N ATOM 347 CZ ARG A 999 62.169 33.069 36.309 1.00 45.71 C ATOM 348 NH1 ARG A 999 62.337 34.347 35.997 1.00 47.21 N ATOM 349 NH2 ARG A 999 61.642 32.248 35.412 1.00 45.47 N ATOM 350 N ARG A1000 61.100 36.481 43.380 1.00 43.15 N ATOM 351 CA ARG A1000 61.313 37.011 44.731 1.00 43.17 C ATOM 352 C ARG A1000 60.097 36.806 45.635 1.00 42.51 C ATOM 353 O ARG A1000 60.183 37.008 46.847 1.00 42.27 O ATOM 354 CB ARG A1000 61.686 38.492 44.677 1.00 43.55 C ATOM 355 CG ARG A1000 63.057 38.766 44.067 1.00 45.69 C ATOM 356 CD ARG A1000 63.473 40.220 44.255 1.00 49.88 C ATOM 357 NE ARG A1000 62.564 41.144 43.573 1.00 52.64 N ATOM 358 CZ ARG A1000 62.776 41.665 42.365 1.00 54.10 C ATOM 359 NH1 ARG A1000 63.877 41.362 41.678 1.00 54.11 N ATOM 360 NH2 ARG A1000 61.879 42.495 41.840 1.00 55.12 N ATOM 361 N HIS A1001 58.970 36.403 45.049 1.00 41.73 N ATOM 362 CA HIS A1001 57.758 36.149 45.826 1.00 41.45 C ATOM 363 C HIS A1001 57.883 34.883 46.672 1.00 41.67 C ATOM 364 O HIS A1001 58.484 33.901 46.242 1.00 41.58 O ATOM 365 CB HIS A1001 56.516 36.055 44.928 1.00 41.13 C ATOM 366 CG HIS A1001 55.234 36.186 45.685 1.00 40.28 C ATOM 367 ND1 HIS A1001 54.505 37.354 45.709 1.00 40.89 N ATOM 368 CD2 HIS A1001 54.571 35.312 46.477 1.00 38.74 C ATOM 369 CE1 HIS A1001 53.439 37.190 46.470 1.00 40.20 C ATOM 370 NE2 HIS A1001 53.459 35.961 46.954 1.00 41.27 N ATOM 371 N SER A1002 57.296 34.911 47.868 1.00 41.81 N ATOM 372 CA SER A1002 57.383 33.784 48.808 1.00 41.76 C ATOM 373 C SER A1002 56.719 32.505 48.282 1.00 41.43 C ATOM 374 O SER A1002 57.132 31.394 48.634 1.00 42.06 O ATOM 375 CB SER A1002 56.803 34.169 50.175 1.00 41.86 C ATOM 376 OG SER A1002 55.390 34.169 50.127 1.00 43.18 O ATOM 377 N LEU A1003 55.709 32.654 47.431 1.00 40.71 N ATOM 378 CA LEU A1003 55.026 31.491 46.857 1.00 40.19 C ATOM 379 C LEU A1003 55.750 30.832 45.664 1.00 39.59 C ATOM 380 O LEU A1003 55.352 29.749 45.226 1.00 39.09 O ATOM 381 CB LEU A1003 53.585 31.838 46.471 1.00 40.43 C ATOM 382 CG LEU A1003 52.603 32.113 47.615 1.00 40.87 C ATOM 383 CD1 LEU A1003 51.218 32.452 47.040 1.00 41.18 C ATOM 384 CD2 LEU A1003 52.512 30.924 48.561 1.00 42.51 C ATOM 385 N PHE A1004 56.794 31.481 45.147 1.00 38.92 N ATOM 386 CA PHE A1004 57.549 30.951 44.005 1.00 38.70 C ATOM 387 C PHE A1004 58.181 29.613 44.361 1.00 38.90 C ATOM 388 O PHE A1004 58.903 29.509 45.345 1.00 37.79 O ATOM 389 CB PHE A1004 58.623 31.948 43.549 1.00 38.45 C ATOM 390 CG PHE A1004 59.490 31.444 42.420 1.00 38.60 C ATOM 391 CD1 PHE A1004 58.996 31.367 41.116 1.00 38.81 C ATOM 392 CD2 PHE A1004 60.808 31.054 42.663 1.00 37.79 C ATOM 393 CE1 PHE A1004 59.810 30.898 40.070 1.00 38.55 C ATOM 394 CE2 PHE A1004 61.628 30.589 41.626 1.00 38.52 C ATOM 395 CZ PHE A1004 61.129 30.510 40.331 1.00 37.44 C ATOM 396 N GLY A1005 57.885 28.590 43.566 1.00 39.27 N ATOM 397 CA GLY A1005 58.464 27.267 43.767 1.00 39.69 C ATOM 398 C GLY A1005 57.836 26.423 44.862 1.00 40.09 C ATOM 399 O GLY A1005 58.335 25.337 45.163 1.00 40.17 O ATOM 400 N THR A1006 56.745 26.907 45.455 1.00 40.40 N ATOM 401 CA THR A1006 56.099 26.219 46.583 1.00 40.91 C ATOM 402 C THR A1006 55.104 25.142 46.148 1.00 41.54 C ATOM 403 O THR A1006 54.567 24.415 46.992 1.00 41.31 O ATOM 404 CB THR A1006 55.395 27.207 47.563 1.00 41.07 C ATOM 405 OG1 THR A1006 54.350 27.924 46.886 1.00 40.69 O ATOM 406 CG2 THR A1006 56.401 28.183 48.166 1.00 41.22 C ATOM 407 N GLY A1007 54.862 25.044 44.841 1.00 41.82 N ATOM 408 CA GLY A1007 53.989 24.008 44.294 1.00 43.03 C ATOM 409 C GLY A1007 54.745 22.917 43.556 1.00 44.01 C ATOM 410 O GLY A1007 54.149 22.148 42.799 1.00 44.29 O ATOM 411 N LYS A1008 56.057 22.851 43.791 1.00 44.75 N ATOM 412 CA LYS A1008 56.956 21.878 43.157 1.00 45.98 C ATOM 413 C LYS A1008 56.571 20.416 43.371 1.00 46.37 C ATOM 414 O LYS A1008 56.877 19.570 42.532 1.00 46.58 O ATOM 415 CB LYS A1008 58.389 22.070 43.663 1.00 46.17 C ATOM 416 CG LYS A1008 59.218 23.084 42.898 1.00 47.10 C ATOM 417 CD LYS A1008 60.670 23.043 43.378 1.00 48.87 C ATOM 418 CE LYS A1008 61.503 24.160 42.754 1.00 50.38 C ATOM 419 NZ LYS A1008 61.270 25.486 43.400 1.00 50.91 N ATOM 420 N ASP A1009 55.915 20.116 44.490 1.00 46.83 N ATOM 421 CA ASP A1009 55.584 18.728 44.815 1.00 47.65 C ATOM 422 C ASP A1009 54.368 18.159 44.067 1.00 47.30 C ATOM 423 O ASP A1009 53.991 17.005 44.280 1.00 47.36 O ATOM 424 CB ASP A1009 55.489 18.509 46.337 1.00 48.18 C ATOM 425 CG ASP A1009 54.384 19.323 46.997 1.00 50.04 C ATOM 426 OD1 ASP A1009 53.906 20.331 46.423 1.00 53.03 O ATOM 427 OD2 ASP A1009 54.005 18.948 48.130 1.00 52.58 O ATOM 428 N GLN A1010 53.778 18.964 43.185 1.00 46.72 N ATOM 429 CA GLN A1010 52.747 18.494 42.260 1.00 46.29 C ATOM 430 C GLN A1010 53.194 18.795 40.834 1.00 45.59 C ATOM 431 O GLN A1010 53.820 19.821 40.574 1.00 45.41 O ATOM 432 CB GLN A1010 51.388 19.156 42.533 1.00 46.53 C ATOM 433 CG GLN A1010 50.860 19.056 43.975 1.00 48.36 C ATOM 434 CD GLN A1010 50.322 17.678 44.342 1.00 51.17 C ATOM 435 OE1 GLN A1010 50.363 16.735 43.544 1.00 52.72 O ATOM 436 NE2 GLN A1010 49.821 17.554 45.568 1.00 51.87 N ATOM 437 N THR A1011 52.872 17.891 39.914 1.00 44.99 N ATOM 438 CA THR A1011 53.296 18.017 38.521 1.00 44.30 C ATOM 439 C THR A1011 52.507 19.112 37.819 1.00 44.15 C ATOM 440 O THR A1011 51.421 19.477 38.262 1.00 43.56 O ATOM 441 CB THR A1011 53.091 16.701 37.745 1.00 44.27 C ATOM 442 OG1 THR A1011 51.690 16.427 37.626 1.00 43.47 O ATOM 443 CG2 THR A1011 53.781 15.543 38.449 1.00 43.95 C ATOM 444 N GLU A1012 53.057 19.623 36.721 1.00 43.96 N ATOM 445 CA GLU A1012 52.353 20.590 35.887 1.00 44.15 C ATOM 446 C GLU A1012 51.007 20.018 35.448 1.00 43.61 C ATOM 447 O GLU A1012 49.999 20.717 35.456 1.00 44.27 O ATOM 448 CB GLU A1012 53.219 20.956 34.683 1.00 44.44 C ATOM 449 CG GLU A1012 52.571 21.901 33.705 1.00 46.41 C ATOM 450 CD GLU A1012 53.570 22.525 32.752 1.00 49.46 C ATOM 451 OE1 GLU A1012 54.393 23.362 33.201 1.00 49.90 O ATOM 452 OE2 GLU A1012 53.514 22.189 31.549 1.00 50.03 O ATOM 453 N SER A1013 51.001 18.735 35.085 1.00 43.33 N ATOM 454 CA SER A1013 49.779 18.022 34.709 1.00 42.74 C ATOM 455 C SER A1013 48.714 18.051 35.813 1.00 42.01 C ATOM 456 O SER A1013 47.529 18.273 35.542 1.00 41.79 O ATOM 457 CB SER A1013 50.104 16.570 34.351 1.00 43.02 C ATOM 458 OG SER A1013 48.989 15.959 33.736 1.00 44.00 O ATOM 459 N TRP A1014 49.142 17.821 37.051 1.00 41.24 N ATOM 460 CA TRP A1014 48.237 17.846 38.194 1.00 40.72 C ATOM 461 C TRP A1014 47.595 19.224 38.354 1.00 40.47 C ATOM 462 O TRP A1014 46.367 19.343 38.464 1.00 40.20 O ATOM 463 CB TRP A1014 48.967 17.455 39.476 1.00 40.64 C ATOM 464 CG TRP A1014 48.023 17.315 40.631 1.00 40.87 C ATOM 465 CD1 TRP A1014 47.373 16.181 41.025 1.00 40.93 C ATOM 466 CD2 TRP A1014 47.603 18.353 41.527 1.00 40.48 C ATOM 467 NE1 TRP A1014 46.579 16.448 42.117 1.00 40.98 N ATOM 468 CE2 TRP A1014 46.699 17.773 42.443 1.00 40.77 C ATOM 469 CE3 TRP A1014 47.903 19.716 41.643 1.00 40.18 C ATOM 470 CZ2 TRP A1014 46.091 18.509 43.467 1.00 40.78 C ATOM 471 CZ3 TRP A1014 47.298 20.449 42.655 1.00 40.36 C ATOM 472 CH2 TRP A1014 46.401 19.845 43.552 1.00 41.07 C ATOM 473 N TRP A1015 48.436 20.257 38.365 1.00 40.01 N ATOM 474 CA TRP A1015 47.975 21.636 38.512 1.00 39.85 C ATOM 475 C TRP A1015 46.984 22.028 37.420 1.00 40.19 C ATOM 476 O TRP A1015 45.997 22.712 37.691 1.00 40.60 O ATOM 477 CB TRP A1015 49.164 22.597 38.515 1.00 39.62 C ATOM 478 CG TRP A1015 49.952 22.607 39.797 1.00 39.45 C ATOM 479 CD1 TRP A1015 51.229 22.161 39.975 1.00 38.90 C ATOM 480 CD2 TRP A1015 49.517 23.107 41.073 1.00 38.81 C ATOM 481 NE1 TRP A1015 51.616 22.342 41.285 1.00 39.17 N ATOM 482 CE2 TRP A1015 50.587 22.925 41.979 1.00 38.75 C ATOM 483 CE3 TRP A1015 48.328 23.693 41.537 1.00 38.87 C ATOM 484 CZ2 TRP A1015 50.503 23.292 43.331 1.00 38.45 C ATOM 485 CZ3 TRP A1015 48.245 24.070 42.887 1.00 38.77 C ATOM 486 CH2 TRP A1015 49.330 23.863 43.767 1.00 39.10 C ATOM 487 N LYS A1016 47.252 21.593 36.188 1.00 40.46 N ATOM 488 CA LYS A1016 46.342 21.830 35.073 1.00 41.22 C ATOM 489 C LYS A1016 44.987 21.144 35.307 1.00 40.87 C ATOM 490 O LYS A1016 43.938 21.782 35.185 1.00 41.06 O ATOM 491 CB LYS A1016 46.988 21.402 33.734 1.00 41.20 C ATOM 492 CG LYS A1016 47.960 22.460 33.184 1.00 42.23 C ATOM 493 CD LYS A1016 48.540 22.122 31.811 1.00 43.30 C ATOM 494 CE LYS A1016 49.214 23.370 31.219 1.00 46.29 C ATOM 495 NZ LYS A1016 49.798 23.101 29.859 1.00 48.90 N ATOM 496 N ALA A1017 45.018 19.859 35.663 1.00 40.48 N ATOM 497 CA ALA A1017 43.806 19.122 36.038 1.00 40.38 C ATOM 498 C ALA A1017 43.064 19.826 37.188 1.00 40.39 C ATOM 499 O ALA A1017 41.835 19.948 37.171 1.00 40.26 O ATOM 500 CB ALA A1017 44.150 17.665 36.413 1.00 40.43 C ATOM 501 N PHE A1018 43.827 20.303 38.170 1.00 40.02 N ATOM 502 CA PHE A1018 43.274 20.989 39.330 1.00 39.59 C ATOM 503 C PHE A1018 42.583 22.285 38.910 1.00 39.57 C ATOM 504 O PHE A1018 41.455 22.555 39.331 1.00 39.49 O ATOM 505 CB PHE A1018 44.382 21.253 40.357 1.00 39.32 C ATOM 506 CG PHE A1018 43.905 21.910 41.629 1.00 39.05 C ATOM 507 CD1 PHE A1018 42.825 21.393 42.343 1.00 38.55 C ATOM 508 CD2 PHE A1018 44.564 23.024 42.127 1.00 37.57 C ATOM 509 CE1 PHE A1018 42.396 22.000 43.532 1.00 39.34 C ATOM 510 CE2 PHE A1018 44.147 23.634 43.315 1.00 39.06 C ATOM 511 CZ PHE A1018 43.062 23.109 44.020 1.00 38.40 C ATOM 512 N SER A1019 43.245 23.061 38.050 1.00 39.53 N ATOM 513 CA SER A1019 42.673 24.304 37.536 1.00 40.14 C ATOM 514 C SER A1019 41.343 24.059 36.811 1.00 40.58 C ATOM 515 O SER A1019 40.426 24.870 36.893 1.00 41.32 O ATOM 516 CB SER A1019 43.677 25.026 36.630 1.00 39.77 C ATOM 517 OG SER A1019 43.740 24.441 35.340 1.00 39.61 O ATOM 518 N ARG A1020 41.246 22.932 36.107 1.00 41.09 N ATOM 519 CA ARG A1020 40.020 22.548 35.418 1.00 41.20 C ATOM 520 C ARG A1020 38.845 22.374 36.371 1.00 40.82 C ATOM 521 O ARG A1020 37.743 22.863 36.097 1.00 40.38 O ATOM 522 CB ARG A1020 40.250 21.267 34.615 1.00 41.84 C ATOM 523 CG ARG A1020 40.946 21.533 33.321 1.00 44.62 C ATOM 524 CD ARG A1020 39.990 22.253 32.408 1.00 50.53 C ATOM 525 NE ARG A1020 40.622 23.364 31.715 1.00 53.29 N ATOM 526 CZ ARG A1020 39.964 24.388 31.179 1.00 53.91 C ATOM 527 NH1 ARG A1020 38.631 24.466 31.259 1.00 52.77 N ATOM 528 NH2 ARG A1020 40.650 25.339 30.571 1.00 54.57 N ATOM 529 N GLN A1021 39.090 21.671 37.477 1.00 40.32 N ATOM 530 CA GLN A1021 38.113 21.518 38.557 1.00 40.65 C ATOM 531 C GLN A1021 37.665 22.857 39.148 1.00 39.98 C ATOM 532 O GLN A1021 36.473 23.059 39.395 1.00 39.99 O ATOM 533 CB GLN A1021 38.687 20.647 39.679 1.00 41.09 C ATOM 534 CG GLN A1021 38.619 19.174 39.408 1.00 44.00 C ATOM 535 CD GLN A1021 37.193 18.659 39.383 1.00 47.41 C ATOM 536 OE1 GLN A1021 36.697 18.243 38.338 1.00 49.22 O ATOM 537 NE2 GLN A1021 36.520 18.700 40.532 1.00 48.02 N ATOM 538 N LEU A1022 38.621 23.756 39.373 1.00 39.25 N ATOM 539 CA LEU A1022 38.326 25.093 39.926 1.00 39.27 C ATOM 540 C LEU A1022 37.500 25.966 38.977 1.00 39.24 C ATOM 541 O LEU A1022 36.695 26.787 39.419 1.00 39.11 O ATOM 542 CB LEU A1022 39.609 25.819 40.332 1.00 38.95 C ATOM 543 CG LEU A1022 40.439 25.203 41.473 1.00 39.28 C ATOM 544 CD1 LEU A1022 41.603 26.127 41.818 1.00 39.66 C ATOM 545 CD2 LEU A1022 39.591 24.933 42.722 1.00 40.70 C ATOM 546 N ILE A1023 37.709 25.792 37.677 1.00 39.33 N ATOM 547 CA ILE A1023 36.847 26.424 36.679 1.00 39.52 C ATOM 548 C ILE A1023 35.425 25.867 36.776 1.00 40.15 C ATOM 549 O ILE A1023 34.458 26.626 36.893 1.00 40.30 O ATOM 550 CB ILE A1023 37.406 26.246 35.262 1.00 39.79 C ATOM 551 CG1 ILE A1023 38.717 27.042 35.127 1.00 39.12 C ATOM 552 CG2 ILE A1023 36.372 26.666 34.207 1.00 40.05 C ATOM 553 CD1 ILE A1023 39.517 26.711 33.873 1.00 41.32 C ATOM 554 N THR A1024 35.306 24.543 36.746 1.00 40.31 N ATOM 555 CA THR A1024 34.007 23.875 36.856 1.00 40.81 C ATOM 556 C THR A1024 33.248 24.291 38.124 1.00 41.04 C ATOM 557 O THR A1024 32.039 24.512 38.074 1.00 41.12 O ATOM 558 CB THR A1024 34.171 22.352 36.791 1.00 40.59 C ATOM 559 OG1 THR A1024 34.714 22.007 35.512 1.00 41.00 O ATOM 560 CG2 THR A1024 32.825 21.640 36.955 1.00 41.33 C ATOM 561 N GLU A1025 33.963 24.425 39.239 1.00 41.21 N ATOM 562 CA GLU A1025 33.347 24.795 40.516 1.00 41.65 C ATOM 563 C GLU A1025 33.183 26.307 40.703 1.00 41.00 C ATOM 564 O GLU A1025 32.666 26.756 41.726 1.00 41.00 O ATOM 565 CB GLU A1025 34.133 24.207 41.693 1.00 42.19 C ATOM 566 CG GLU A1025 34.179 22.685 41.730 1.00 44.76 C ATOM 567 CD GLU A1025 32.802 22.039 41.734 1.00 48.19 C ATOM 568 OE1 GLU A1025 31.958 22.413 42.582 1.00 50.46 O ATOM 569 OE2 GLU A1025 32.568 21.144 40.891 1.00 49.91 O ATOM 570 N GLY A1026 33.644 27.089 39.730 1.00 40.60 N ATOM 571 CA GLY A1026 33.346 28.521 39.687 1.00 39.65 C ATOM 572 C GLY A1026 34.281 29.441 40.453 1.00 39.41 C ATOM 573 O GLY A1026 33.895 30.559 40.800 1.00 39.76 O ATOM 574 N PHE A1027 35.507 28.988 40.709 1.00 38.50 N ATOM 575 CA PHE A1027 36.520 29.825 41.373 1.00 37.78 C ATOM 576 C PHE A1027 37.398 30.583 40.376 1.00 37.73 C ATOM 577 O PHE A1027 37.953 31.651 40.697 1.00 37.29 O ATOM 578 CB PHE A1027 37.389 28.978 42.307 1.00 37.59 C ATOM 579 CG PHE A1027 36.641 28.437 43.490 1.00 38.16 C ATOM 580 CD1 PHE A1027 36.634 29.130 44.697 1.00 39.18 C ATOM 581 CD2 PHE A1027 35.920 27.245 43.389 1.00 38.99 C ATOM 582 CE1 PHE A1027 35.932 28.638 45.801 1.00 40.37 C ATOM 583 CE2 PHE A1027 35.212 26.744 44.481 1.00 40.31 C ATOM 584 CZ PHE A1027 35.218 27.437 45.687 1.00 39.43 C ATOM 585 N LEU A1028 37.498 30.014 39.175 1.00 37.43 N ATOM 586 CA LEU A1028 38.268 30.547 38.054 1.00 37.73 C ATOM 587 C LEU A1028 37.384 30.568 36.809 1.00 38.17 C ATOM 588 O LEU A1028 36.428 29.800 36.712 1.00 37.69 O ATOM 589 CB LEU A1028 39.497 29.656 37.785 1.00 37.65 C ATOM 590 CG LEU A1028 40.620 29.609 38.839 1.00 37.71 C ATOM 591 CD1 LEU A1028 41.623 28.500 38.524 1.00 36.79 C ATOM 592 CD2 LEU A1028 41.344 30.969 38.966 1.00 39.01 C ATOM 593 N VAL A1029 37.691 31.475 35.879 1.00 39.22 N ATOM 594 CA VAL A1029 37.019 31.560 34.574 1.00 40.10 C ATOM 595 C VAL A1029 38.042 31.870 33.503 1.00 39.97 C ATOM 596 O VAL A1029 39.003 32.593 33.749 1.00 40.85 O ATOM 597 CB VAL A1029 36.053 32.781 34.397 1.00 40.83 C ATOM 598 CG1 VAL A1029 34.674 32.385 33.768 1.00 40.81 C ATOM 599 CG2 VAL A1029 36.013 33.719 35.569 1.00 42.41 C ATOM 600 N GLU A1030 37.798 31.363 32.301 1.00 39.84 N ATOM 601 CA GLU A1030 38.589 31.741 31.142 1.00 40.10 C ATOM 602 C GLU A1030 37.868 32.861 30.410 1.00 39.20 C ATOM 603 O GLU A1030 36.642 32.819 30.271 1.00 37.87 O ATOM 604 CB GLU A1030 38.804 30.535 30.230 1.00 40.25 C ATOM 605 CG GLU A1030 39.759 29.517 30.856 1.00 42.19 C ATOM 606 CD GLU A1030 39.997 28.287 29.991 1.00 43.08 C ATOM 607 OE1 GLU A1030 39.206 28.007 29.070 1.00 48.42 O ATOM 608 OE2 GLU A1030 40.982 27.577 30.251 1.00 48.04 O ATOM 609 N VAL A1031 38.627 33.863 29.955 1.00 38.09 N ATOM 610 CA VAL A1031 38.039 35.072 29.369 1.00 38.75 C ATOM 611 C VAL A1031 38.786 35.396 28.085 1.00 38.06 C ATOM 612 O VAL A1031 39.998 35.513 28.106 1.00 37.57 O ATOM 613 CB VAL A1031 38.188 36.303 30.332 1.00 38.49 C ATOM 614 CG1 VAL A1031 37.435 37.516 29.793 1.00 40.34 C ATOM 615 CG2 VAL A1031 37.700 35.965 31.738 1.00 39.85 C ATOM 616 N SER A1032 38.078 35.527 26.967 1.00 37.47 N ATOM 617 CA SER A1032 38.727 35.960 25.735 1.00 38.17 C ATOM 618 C SER A1032 39.252 37.369 25.969 1.00 38.08 C ATOM 619 O SER A1032 38.554 38.172 26.567 1.00 37.93 O ATOM 620 CB SER A1032 37.728 35.984 24.584 1.00 38.65 C ATOM 621 OG SER A1032 38.358 36.559 23.447 1.00 42.73 O ATOM 622 N ARG A1033 40.465 37.667 25.508 1.00 38.38 N ATOM 623 CA ARG A1033 41.049 39.017 25.668 1.00 38.68 C ATOM 624 C ARG A1033 42.140 39.267 24.630 1.00 38.02 C ATOM 625 O ARG A1033 42.742 38.324 24.142 1.00 37.73 O ATOM 626 CB ARG A1033 41.640 39.168 27.065 1.00 39.28 C ATOM 627 CG ARG A1033 41.970 40.610 27.471 1.00 42.14 C ATOM 628 CD ARG A1033 42.058 40.755 28.984 1.00 45.20 C ATOM 629 NE ARG A1033 40.738 40.806 29.629 1.00 46.92 N ATOM 630 CZ ARG A1033 40.542 40.920 30.946 1.00 47.83 C ATOM 631 NH1 ARG A1033 41.571 41.020 31.774 1.00 48.86 N ATOM 632 NH2 ARG A1033 39.314 40.946 31.441 1.00 46.96 N ATOM 633 N TYR A1034 42.388 40.544 24.321 1.00 38.01 N ATOM 634 CA TYR A1034 43.481 40.981 23.432 1.00 37.57 C ATOM 635 C TYR A1034 43.206 40.782 21.960 1.00 37.09 C ATOM 636 O TYR A1034 43.031 41.740 21.208 1.00 37.64 O ATOM 637 CB TYR A1034 44.827 40.322 23.806 1.00 39.02 C ATOM 638 CG TYR A1034 45.170 40.498 25.267 1.00 41.41 C ATOM 639 CD1 TYR A1034 45.334 41.770 25.804 1.00 42.69 C ATOM 640 CD2 TYR A1034 45.338 39.397 26.102 1.00 43.94 C ATOM 641 CE1 TYR A1034 45.639 41.951 27.153 1.00 45.83 C ATOM 642 CE2 TYR A1034 45.651 39.568 27.465 1.00 45.09 C ATOM 643 CZ TYR A1034 45.803 40.850 27.969 1.00 44.87 C ATOM 644 OH TYR A1034 46.108 41.043 29.311 1.00 47.24 O ATOM 645 N ASN A1035 43.228 39.534 21.524 1.00 35.66 N ATOM 646 CA ASN A1035 43.034 39.234 20.107 1.00 35.10 C ATOM 647 C ASN A1035 42.420 37.845 19.958 1.00 34.38 C ATOM 648 O ASN A1035 42.236 37.145 20.959 1.00 33.84 O ATOM 649 CB ASN A1035 44.343 39.402 19.302 1.00 34.30 C ATOM 650 CG ASN A1035 45.448 38.434 19.738 1.00 35.49 C ATOM 651 OD1 ASN A1035 45.288 37.222 19.654 1.00 34.54 O ATOM 652 ND2 ASN A1035 46.584 38.980 20.193 1.00 33.59 N ATOM 653 N LYS A1036 42.122 37.445 18.725 1.00 34.25 N ATOM 654 CA LYS A1036 41.335 36.232 18.498 1.00 35.25 C ATOM 655 C LYS A1036 41.997 34.947 19.031 1.00 35.98 C ATOM 656 O LYS A1036 41.295 33.950 19.285 1.00 35.64 O ATOM 657 CB LYS A1036 40.991 36.063 17.016 1.00 35.53 C ATOM 658 CG LYS A1036 42.129 35.603 16.147 1.00 36.65 C ATOM 659 CD LYS A1036 41.716 35.623 14.689 1.00 41.64 C ATOM 660 CE LYS A1036 42.924 35.560 13.787 1.00 45.15 C ATOM 661 NZ LYS A1036 42.572 36.110 12.431 1.00 48.92 N ATOM 662 N PHE A1037 43.326 34.973 19.194 1.00 35.12 N ATOM 663 CA PHE A1037 44.048 33.788 19.697 1.00 35.11 C ATOM 664 C PHE A1037 44.036 33.594 21.214 1.00 35.90 C ATOM 665 O PHE A1037 44.211 32.469 21.692 1.00 35.86 O ATOM 666 CB PHE A1037 45.489 33.796 19.208 1.00 34.22 C ATOM 667 CG PHE A1037 45.608 33.675 17.728 1.00 33.76 C ATOM 668 CD1 PHE A1037 45.288 32.479 17.091 1.00 32.80 C ATOM 669 CD2 PHE A1037 45.999 34.764 16.964 1.00 33.23 C ATOM 670 CE1 PHE A1037 45.373 32.368 15.721 1.00 33.34 C ATOM 671 CE2 PHE A1037 46.089 34.664 15.574 1.00 34.49 C ATOM 672 CZ PHE A1037 45.775 33.468 14.950 1.00 34.39 C ATOM 673 N MET A1038 43.848 34.678 21.961 1.00 35.76 N ATOM 674 CA MET A1038 44.158 34.685 23.391 1.00 36.27 C ATOM 675 C MET A1038 42.991 34.505 24.355 1.00 36.72 C ATOM 676 O MET A1038 41.876 34.970 24.128 1.00 36.19 O ATOM 677 CB MET A1038 44.896 35.976 23.773 1.00 35.91 C ATOM 678 CG MET A1038 46.111 36.310 22.925 1.00 36.32 C ATOM 679 SD MET A1038 47.313 34.971 22.865 1.00 35.14 S ATOM 680 CE MET A1038 48.589 35.683 21.818 1.00 35.10 C ATOM 681 N LYS A1039 43.274 33.833 25.459 1.00 37.56 N ATOM 682 CA LYS A1039 42.345 33.827 26.572 1.00 39.00 C ATOM 683 C LYS A1039 43.160 33.940 27.842 1.00 39.46 C ATOM 684 O LYS A1039 44.319 33.512 27.875 1.00 40.28 O ATOM 685 CB LYS A1039 41.495 32.560 26.589 1.00 39.09 C ATOM 686 CG LYS A1039 42.295 31.267 26.666 1.00 41.97 C ATOM 687 CD LYS A1039 41.397 30.069 26.932 1.00 44.93 C ATOM 688 CE LYS A1039 42.234 28.820 27.154 1.00 45.62 C ATOM 689 NZ LYS A1039 41.411 27.577 27.106 1.00 48.69 N ATOM 690 N ILE A1040 42.584 34.536 28.875 1.00 39.14 N ATOM 691 CA ILE A1040 43.293 34.589 30.145 1.00 39.81 C ATOM 692 C ILE A1040 42.482 33.797 31.143 1.00 40.45 C ATOM 693 O ILE A1040 41.298 33.524 30.903 1.00 40.27 O ATOM 694 CB ILE A1040 43.557 36.033 30.631 1.00 39.63 C ATOM 695 CG1 ILE A1040 42.258 36.834 30.773 1.00 39.93 C ATOM 696 CG2 ILE A1040 44.516 36.770 29.688 1.00 39.86 C ATOM 697 CD1 ILE A1040 41.592 36.712 32.130 1.00 42.14 C ATOM 698 N CYS A1041 43.118 33.426 32.251 1.00 40.76 N ATOM 699 CA CYS A1041 42.423 32.750 33.330 1.00 40.63 C ATOM 700 C CYS A1041 42.363 33.726 34.501 1.00 40.44 C ATOM 701 O CYS A1041 43.402 34.185 34.990 1.00 40.34 O ATOM 702 CB CYS A1041 43.135 31.446 33.704 1.00 41.08 C ATOM 703 SG CYS A1041 42.233 30.444 34.900 1.00 42.70 S ATOM 704 N ALA A1042 41.139 34.061 34.908 1.00 40.03 N ATOM 705 CA ALA A1042 40.875 35.038 35.967 1.00 39.69 C ATOM 706 C ALA A1042 40.181 34.424 37.181 1.00 39.80 C ATOM 707 O ALA A1042 39.521 33.391 37.079 1.00 39.15 O ATOM 708 CB ALA A1042 40.003 36.151 35.414 1.00 39.72 C ATOM 709 N LEU A1043 40.296 35.100 38.326 1.00 39.33 N ATOM 710 CA LEU A1043 39.461 34.792 39.485 1.00 39.24 C ATOM 711 C LEU A1043 38.026 35.252 39.236 1.00 39.50 C ATOM 712 O LEU A1043 37.797 36.365 38.766 1.00 39.55 O ATOM 713 CB LEU A1043 40.007 35.508 40.736 1.00 39.24 C ATOM 714 CG LEU A1043 41.381 35.064 41.258 1.00 39.23 C ATOM 715 CD1 LEU A1043 41.761 35.928 42.468 1.00 41.15 C ATOM 716 CD2 LEU A1043 41.357 33.637 41.685 1.00 41.41 C ATOM 717 N THR A1044 37.058 34.405 39.573 1.00 39.45 N ATOM 718 CA THR A1044 35.659 34.837 39.619 1.00 39.42 C ATOM 719 C THR A1044 35.446 35.663 40.884 1.00 39.71 C ATOM 720 O THR A1044 36.353 35.760 41.713 1.00 39.48 O ATOM 721 CB THR A1044 34.719 33.641 39.671 1.00 39.30 C ATOM 722 OG1 THR A1044 35.013 32.864 40.843 1.00 39.81 O ATOM 723 CG2 THR A1044 34.886 32.789 38.428 1.00 38.45 C ATOM 724 N LYS A1045 34.254 36.239 41.052 1.00 39.71 N ATOM 725 CA LYS A1045 33.947 36.941 42.304 1.00 40.13 C ATOM 726 C LYS A1045 34.042 35.938 43.450 1.00 39.53 C ATOM 727 O LYS A1045 34.556 36.251 44.531 1.00 38.93 O ATOM 728 CB LYS A1045 32.554 37.569 42.267 1.00 40.57 C ATOM 729 CG LYS A1045 32.399 38.692 41.245 1.00 43.16 C ATOM 730 CD LYS A1045 31.133 39.502 41.521 1.00 47.80 C ATOM 731 CE LYS A1045 30.663 40.288 40.311 1.00 50.71 C ATOM 732 NZ LYS A1045 29.342 40.934 40.611 1.00 54.38 N ATOM 733 N LYS A1046 33.559 34.724 43.204 1.00 39.09 N ATOM 734 CA LYS A1046 33.636 33.671 44.215 1.00 39.21 C ATOM 735 C LYS A1046 35.078 33.346 44.589 1.00 38.90 C ATOM 736 O LYS A1046 35.404 33.207 45.781 1.00 37.84 O ATOM 737 CB LYS A1046 32.920 32.404 43.738 1.00 39.14 C ATOM 738 CG LYS A1046 32.863 31.317 44.786 1.00 40.25 C ATOM 739 CD LYS A1046 31.798 30.289 44.449 1.00 42.29 C ATOM 740 CE LYS A1046 32.399 29.038 43.857 1.00 44.73 C ATOM 741 NZ LYS A1046 31.375 27.932 43.731 1.00 44.38 N ATOM 742 N GLY A1047 35.932 33.218 43.572 1.00 38.43 N ATOM 743 CA GLY A1047 37.342 32.887 43.787 1.00 38.78 C ATOM 744 C GLY A1047 38.044 33.981 44.571 1.00 39.45 C ATOM 745 O GLY A1047 38.839 33.702 45.474 1.00 38.85 O ATOM 746 N ARG A1048 37.722 35.234 44.251 1.00 39.30 N ATOM 747 CA ARG A1048 38.352 36.353 44.937 1.00 40.22 C ATOM 748 C ARG A1048 37.874 36.484 46.393 1.00 39.54 C ATOM 749 O ARG A1048 38.678 36.778 47.286 1.00 40.30 O ATOM 750 CB ARG A1048 38.178 37.659 44.140 1.00 40.98 C ATOM 751 CG ARG A1048 39.132 38.766 44.610 1.00 44.78 C ATOM 752 CD ARG A1048 39.245 39.915 43.621 1.00 45.43 C ATOM 753 NE ARG A1048 39.969 39.589 42.382 1.00 48.44 N ATOM 754 CZ ARG A1048 41.292 39.617 42.246 1.00 48.29 C ATOM 755 NH1 ARG A1048 42.066 39.925 43.288 1.00 50.39 N ATOM 756 NH2 ARG A1048 41.844 39.319 41.069 1.00 46.97 N ATOM 757 N ASN A1049 36.585 36.248 46.637 1.00 38.44 N ATOM 758 CA ASN A1049 36.052 36.265 48.003 1.00 38.40 C ATOM 759 C ASN A1049 36.709 35.175 48.836 1.00 38.02 C ATOM 760 O ASN A1049 37.037 35.378 50.000 1.00 37.82 O ATOM 761 CB ASN A1049 34.535 36.081 48.002 1.00 38.60 C ATOM 762 CG ASN A1049 33.801 37.347 47.620 1.00 39.39 C ATOM 763 OD1 ASN A1049 34.344 38.443 47.731 1.00 40.03 O ATOM 764 ND2 ASN A1049 32.580 37.200 47.133 1.00 39.85 N ATOM 765 N TRP A1050 36.905 34.014 48.216 1.00 37.51 N ATOM 766 CA TRP A1050 37.514 32.873 48.900 1.00 37.07 C ATOM 767 C TRP A1050 38.966 33.211 49.265 1.00 36.72 C ATOM 768 O TRP A1050 39.389 33.013 50.409 1.00 35.50 O ATOM 769 CB TRP A1050 37.421 31.617 48.011 1.00 37.50 C ATOM 770 CG TRP A1050 37.924 30.365 48.672 1.00 36.82 C ATOM 771 CD1 TRP A1050 37.176 29.421 49.321 1.00 37.18 C ATOM 772 CD2 TRP A1050 39.284 29.921 48.747 1.00 37.79 C ATOM 773 NE1 TRP A1050 37.987 28.422 49.799 1.00 36.02 N ATOM 774 CE2 TRP A1050 39.287 28.706 49.474 1.00 37.14 C ATOM 775 CE3 TRP A1050 40.503 30.442 48.292 1.00 38.06 C ATOM 776 CZ2 TRP A1050 40.464 27.984 49.736 1.00 37.90 C ATOM 777 CZ3 TRP A1050 41.679 29.729 48.558 1.00 38.00 C ATOM 778 CH2 TRP A1050 41.646 28.513 49.281 1.00 38.45 C ATOM 779 N LEU A1051 39.722 33.724 48.293 1.00 36.22 N ATOM 780 CA LEU A1051 41.119 34.105 48.515 1.00 37.13 C ATOM 781 C LEU A1051 41.268 35.208 49.564 1.00 36.51 C ATOM 782 O LEU A1051 42.202 35.190 50.359 1.00 36.85 O ATOM 783 CB LEU A1051 41.779 34.543 47.194 1.00 37.43 C ATOM 784 CG LEU A1051 43.272 34.875 47.226 1.00 38.72 C ATOM 785 CD1 LEU A1051 44.089 33.652 47.657 1.00 41.06 C ATOM 786 CD2 LEU A1051 43.733 35.390 45.846 1.00 38.65 C ATOM 787 N HIS A1052 40.346 36.166 49.553 1.00 36.75 N ATOM 788 CA HIS A1052 40.342 37.274 50.510 1.00 36.80 C ATOM 789 C HIS A1052 40.252 36.732 51.946 1.00 36.85 C ATOM 790 O HIS A1052 40.962 37.195 52.855 1.00 35.71 O ATOM 791 CB HIS A1052 39.188 38.239 50.183 1.00 36.57 C ATOM 792 CG HIS A1052 39.139 39.448 51.068 1.00 38.85 C ATOM 793 ND1 HIS A1052 39.866 40.593 50.808 1.00 39.43 N ATOM 794 CD2 HIS A1052 38.465 39.685 52.218 1.00 38.57 C ATOM 795 CE1 HIS A1052 39.642 41.480 51.761 1.00 40.41 C ATOM 796 NE2 HIS A1052 38.789 40.958 52.623 1.00 40.15 N ATOM 797 N LYS A1053 39.382 35.738 52.150 1.00 36.33 N ATOM 798 CA LYS A1053 39.296 35.058 53.447 1.00 36.35 C ATOM 799 C LYS A1053 40.512 34.180 53.723 1.00 36.64 C ATOM 800 O LYS A1053 41.001 34.140 54.852 1.00 36.21 O ATOM 801 CB LYS A1053 38.000 34.237 53.554 1.00 36.11 C ATOM 802 CG LYS A1053 36.740 35.108 53.628 1.00 36.40 C ATOM 803 CD LYS A1053 35.484 34.299 53.890 1.00 36.96 C ATOM 804 CE LYS A1053 34.988 33.590 52.629 1.00 37.16 C ATOM 805 NZ LYS A1053 33.810 32.696 52.968 1.00 35.79 N ATOM 806 N ALA A1054 40.981 33.466 52.695 1.00 37.31 N ATOM 807 CA ALA A1054 42.151 32.587 52.823 1.00 37.90 C ATOM 808 C ALA A1054 43.422 33.333 53.229 1.00 38.98 C ATOM 809 O ALA A1054 44.320 32.742 53.854 1.00 38.69 O ATOM 810 CB ALA A1054 42.380 31.797 51.534 1.00 38.28 C ATOM 811 N ASN A1055 43.492 34.622 52.882 1.00 39.32 N ATOM 812 CA ASN A1055 44.646 35.462 53.228 1.00 40.75 C ATOM 813 C ASN A1055 44.813 35.710 54.723 1.00 41.17 C ATOM 814 O ASN A1055 45.930 36.000 55.177 1.00 42.01 O ATOM 815 CB ASN A1055 44.617 36.804 52.480 1.00 41.12 C ATOM 816 CG ASN A1055 45.315 36.748 51.114 1.00 43.53 C ATOM 817 OD1 ASN A1055 44.934 37.470 50.196 1.00 48.88 O ATOM 818 ND2 ASN A1055 46.349 35.923 50.991 1.00 43.64 N ATOM 819 N THR A1056 43.733 35.588 55.503 1.00 40.82 N ATOM 820 CA THR A1056 43.852 35.764 56.962 1.00 40.00 C ATOM 821 C THR A1056 43.732 34.494 57.810 1.00 39.96 C ATOM 822 O THR A1056 44.285 34.436 58.909 1.00 39.28 O ATOM 823 CB THR A1056 42.890 36.845 57.511 1.00 40.31 C ATOM 824 OG1 THR A1056 41.538 36.364 57.467 1.00 39.18 O ATOM 825 CG2 THR A1056 43.025 38.136 56.711 1.00 39.14 C ATOM 826 N GLU A1057 42.993 33.493 57.321 1.00 39.84 N ATOM 827 CA GLU A1057 42.980 32.156 57.946 1.00 40.47 C ATOM 828 C GLU A1057 42.643 31.076 56.914 1.00 40.61 C ATOM 829 O GLU A1057 41.878 31.319 55.970 1.00 40.20 O ATOM 830 CB GLU A1057 42.048 32.075 59.173 1.00 40.69 C ATOM 831 CG GLU A1057 40.553 31.976 58.862 1.00 41.16 C ATOM 832 CD GLU A1057 39.670 31.873 60.105 1.00 41.02 C ATOM 833 OE1 GLU A1057 38.438 31.888 59.943 1.00 41.89 O ATOM 834 OE2 GLU A1057 40.179 31.790 61.241 1.00 42.52 O ATOM 835 N SER A1058 43.223 29.895 57.096 1.00 40.87 N ATOM 836 CA SER A1058 43.044 28.788 56.147 1.00 41.65 C ATOM 837 C SER A1058 41.574 28.547 55.869 1.00 40.99 C ATOM 838 O SER A1058 40.747 28.582 56.783 1.00 41.07 O ATOM 839 CB SER A1058 43.664 27.495 56.684 1.00 41.83 C ATOM 840 OG SER A1058 45.032 27.689 56.995 1.00 45.50 O ATOM 841 N GLN A1059 41.270 28.302 54.603 1.00 41.11 N ATOM 842 CA GLN A1059 39.927 27.968 54.163 1.00 41.38 C ATOM 843 C GLN A1059 39.948 26.578 53.564 1.00 41.40 C ATOM 844 O GLN A1059 40.946 26.163 52.966 1.00 40.61 O ATOM 845 CB GLN A1059 39.453 28.950 53.091 1.00 41.46 C ATOM 846 CG GLN A1059 39.475 30.417 53.512 1.00 42.29 C ATOM 847 CD GLN A1059 38.451 30.741 54.578 1.00 43.53 C ATOM 848 OE1 GLN A1059 37.259 30.504 54.399 1.00 44.16 O ATOM 849 NE2 GLN A1059 38.911 31.297 55.694 1.00 43.43 N ATOM 850 N SER A1060 38.847 25.861 53.724 1.00 41.65 N ATOM 851 CA SER A1060 38.672 24.613 53.008 1.00 42.45 C ATOM 852 C SER A1060 38.182 24.893 51.592 1.00 42.69 C ATOM 853 O SER A1060 37.525 25.909 51.334 1.00 42.78 O ATOM 854 CB SER A1060 37.694 23.692 53.751 1.00 42.79 C ATOM 855 OG SER A1060 36.386 24.230 53.736 1.00 43.22 O ATOM 856 N LEU A1061 38.530 24.001 50.670 1.00 42.90 N ATOM 857 CA LEU A1061 37.886 23.949 49.366 1.00 43.04 C ATOM 858 C LEU A1061 37.708 22.475 49.022 1.00 43.77 C ATOM 859 O LEU A1061 38.621 21.833 48.502 1.00 43.83 O ATOM 860 CB LEU A1061 38.707 24.686 48.302 1.00 42.71 C ATOM 861 CG LEU A1061 37.917 25.215 47.096 1.00 42.15 C ATOM 862 CD1 LEU A1061 38.712 26.295 46.383 1.00 42.57 C ATOM 863 CD2 LEU A1061 37.537 24.102 46.126 1.00 42.09 C ATOM 864 N ILE A1062 36.530 21.943 49.346 1.00 44.69 N ATOM 865 CA ILE A1062 36.239 20.516 49.191 1.00 45.66 C ATOM 866 C ILE A1062 35.889 20.200 47.742 1.00 46.54 C ATOM 867 O ILE A1062 35.061 20.885 47.136 1.00 46.69 O ATOM 868 CB ILE A1062 35.072 20.053 50.114 1.00 45.67 C ATOM 869 CG1 ILE A1062 35.251 20.556 51.559 1.00 45.45 C ATOM 870 CG2 ILE A1062 34.881 18.529 50.046 1.00 45.71 C ATOM 871 CD1 ILE A1062 36.427 19.971 52.332 1.00 45.98 C ATOM 872 N LEU A1063 36.527 19.166 47.197 1.00 47.34 N ATOM 873 CA LEU A1063 36.270 18.721 45.827 1.00 48.39 C ATOM 874 C LEU A1063 35.771 17.279 45.777 1.00 48.89 C ATOM 875 O LEU A1063 36.224 16.433 46.554 1.00 49.06 O ATOM 876 CB LEU A1063 37.515 18.909 44.955 1.00 48.34 C ATOM 877 CG LEU A1063 37.563 20.067 43.946 1.00 48.59 C ATOM 878 CD1 LEU A1063 36.689 21.256 44.331 1.00 48.67 C ATOM 879 CD2 LEU A1063 39.003 20.507 43.688 1.00 48.68 C ATOM 880 N GLN A1064 34.851 17.030 44.838 1.00 49.74 N ATOM 881 CA GLN A1064 34.078 15.778 44.693 1.00 50.47 C ATOM 882 C GLN A1064 33.834 15.004 45.988 1.00 50.59 C ATOM 883 O GLN A1064 32.990 14.100 46.039 1.00 51.05 O ATOM 884 CB GLN A1064 34.659 14.871 43.591 1.00 50.70 C ATOM 885 CG GLN A1064 35.650 13.796 44.056 1.00 51.75 C ATOM 886 CD GLN A1064 37.046 14.339 44.330 1.00 52.63 C ATOM 887 OE1 GLN A1064 37.500 15.285 43.682 1.00 52.64 O ATOM 888 NE2 GLN A1064 37.740 13.726 45.287 1.00 52.86 N TER 889 GLN A1064 ATOM 890 N SER B 956 54.198 -5.659 0.590 1.00 50.58 N ATOM 891 CA SER B 956 55.664 -5.479 0.332 1.00 50.43 C ATOM 892 C SER B 956 55.994 -4.168 -0.380 1.00 49.95 C ATOM 893 O SER B 956 55.263 -3.735 -1.278 1.00 50.09 O ATOM 894 CB SER B 956 56.238 -6.664 -0.453 1.00 50.62 C ATOM 895 OG SER B 956 57.017 -7.498 0.394 1.00 52.20 O ATOM 896 N TRP B 957 57.104 -3.552 0.032 1.00 49.19 N ATOM 897 CA TRP B 957 57.541 -2.264 -0.505 1.00 48.20 C ATOM 898 C TRP B 957 59.073 -2.176 -0.548 1.00 46.85 C ATOM 899 O TRP B 957 59.760 -2.681 0.339 1.00 45.98 O ATOM 900 CB TRP B 957 56.954 -1.117 0.331 1.00 49.22 C ATOM 901 CG TRP B 957 57.210 0.244 -0.245 1.00 50.27 C ATOM 902 CD1 TRP B 957 58.182 1.124 0.136 1.00 51.02 C ATOM 903 CD2 TRP B 957 56.495 0.876 -1.317 1.00 51.24 C ATOM 904 NE1 TRP B 957 58.117 2.266 -0.628 1.00 51.08 N ATOM 905 CE2 TRP B 957 57.090 2.142 -1.526 1.00 51.15 C ATOM 906 CE3 TRP B 957 55.405 0.498 -2.117 1.00 52.32 C ATOM 907 CZ2 TRP B 957 56.636 3.035 -2.505 1.00 50.86 C ATOM 908 CZ3 TRP B 957 54.950 1.389 -3.094 1.00 51.32 C ATOM 909 CH2 TRP B 957 55.567 2.643 -3.276 1.00 51.19 C ATOM 910 N ASP B 958 59.599 -1.541 -1.592 1.00 45.38 N ATOM 911 CA ASP B 958 61.040 -1.409 -1.753 1.00 44.24 C ATOM 912 C ASP B 958 61.523 -0.170 -1.007 1.00 43.43 C ATOM 913 O ASP B 958 61.272 0.958 -1.439 1.00 43.55 O ATOM 914 CB ASP B 958 61.406 -1.326 -3.241 1.00 44.13 C ATOM 915 CG ASP B 958 62.910 -1.218 -3.479 1.00 43.88 C ATOM 916 OD1 ASP B 958 63.693 -1.258 -2.501 1.00 41.78 O ATOM 917 OD2 ASP B 958 63.312 -1.092 -4.658 1.00 42.56 O ATOM 918 N PHE B 959 62.215 -0.385 0.108 1.00 42.41 N ATOM 919 CA PHE B 959 62.741 0.721 0.910 1.00 41.73 C ATOM 920 C PHE B 959 64.212 1.014 0.630 1.00 41.29 C ATOM 921 O PHE B 959 64.883 1.662 1.432 1.00 40.62 O ATOM 922 CB PHE B 959 62.538 0.444 2.398 1.00 41.96 C ATOM 923 CG PHE B 959 61.101 0.507 2.834 1.00 41.90 C ATOM 924 CD1 PHE B 959 60.531 1.717 3.219 1.00 42.50 C ATOM 925 CD2 PHE B 959 60.323 -0.644 2.865 1.00 42.16 C ATOM 926 CE1 PHE B 959 59.195 1.782 3.628 1.00 43.85 C ATOM 927 CE2 PHE B 959 58.990 -0.598 3.280 1.00 43.27 C ATOM 928 CZ PHE B 959 58.421 0.622 3.655 1.00 43.65 C ATOM 929 N GLY B 960 64.702 0.545 -0.516 1.00 40.77 N ATOM 930 CA GLY B 960 66.109 0.719 -0.892 1.00 40.15 C ATOM 931 C GLY B 960 66.668 2.138 -0.778 1.00 39.87 C ATOM 932 O GLY B 960 67.761 2.322 -0.234 1.00 39.54 O ATOM 933 N PRO B 961 65.958 3.143 -1.332 1.00 39.73 N ATOM 934 CA PRO B 961 66.373 4.549 -1.235 1.00 39.57 C ATOM 935 C PRO B 961 66.546 5.054 0.203 1.00 39.59 C ATOM 936 O PRO B 961 67.507 5.774 0.497 1.00 39.73 O ATOM 937 CB PRO B 961 65.224 5.297 -1.928 1.00 39.74 C ATOM 938 CG PRO B 961 64.686 4.304 -2.910 1.00 40.18 C ATOM 939 CD PRO B 961 64.736 3.007 -2.148 1.00 40.32 C ATOM 940 N GLN B 962 65.621 4.686 1.089 1.00 39.45 N ATOM 941 CA GLN B 962 65.718 5.063 2.508 1.00 38.95 C ATOM 942 C GLN B 962 66.803 4.260 3.230 1.00 38.78 C ATOM 943 O GLN B 962 67.531 4.797 4.060 1.00 38.71 O ATOM 944 CB GLN B 962 64.377 4.877 3.212 1.00 39.21 C ATOM 945 CG GLN B 962 63.310 5.887 2.791 1.00 39.80 C ATOM 946 CD GLN B 962 62.693 5.553 1.452 1.00 42.03 C ATOM 947 OE1 GLN B 962 62.649 4.392 1.045 1.00 43.03 O ATOM 948 NE2 GLN B 962 62.220 6.574 0.749 1.00 44.55 N ATOM 949 N ALA B 963 66.913 2.975 2.905 1.00 38.41 N ATOM 950 CA ALA B 963 67.984 2.140 3.453 1.00 38.02 C ATOM 951 C ALA B 963 69.349 2.687 3.050 1.00 38.11 C ATOM 952 O ALA B 963 70.287 2.722 3.869 1.00 37.54 O ATOM 953 CB ALA B 963 67.814 0.680 3.008 1.00 38.26 C ATOM 954 N PHE B 964 69.476 3.145 1.803 1.00 37.50 N ATOM 955 CA PHE B 964 70.743 3.763 1.396 1.00 37.44 C ATOM 956 C PHE B 964 71.126 4.935 2.310 1.00 37.49 C ATOM 957 O PHE B 964 72.268 5.025 2.769 1.00 37.52 O ATOM 958 CB PHE B 964 70.750 4.211 -0.074 1.00 38.08 C ATOM 959 CG PHE B 964 72.080 4.748 -0.501 1.00 38.72 C ATOM 960 CD1 PHE B 964 73.146 3.880 -0.724 1.00 39.29 C ATOM 961 CD2 PHE B 964 72.295 6.119 -0.604 1.00 41.20 C ATOM 962 CE1 PHE B 964 74.409 4.373 -1.080 1.00 41.30 C ATOM 963 CE2 PHE B 964 73.550 6.625 -0.957 1.00 41.11 C ATOM 964 CZ PHE B 964 74.600 5.755 -1.205 1.00 40.51 C ATOM 965 N LYS B 965 70.171 5.821 2.586 1.00 37.32 N ATOM 966 CA LYS B 965 70.458 6.975 3.432 1.00 37.11 C ATOM 967 C LYS B 965 70.880 6.530 4.832 1.00 37.13 C ATOM 968 O LYS B 965 71.909 6.984 5.355 1.00 36.49 O ATOM 969 CB LYS B 965 69.252 7.920 3.488 1.00 36.93 C ATOM 970 CG LYS B 965 68.923 8.551 2.150 1.00 37.55 C ATOM 971 CD LYS B 965 67.795 9.592 2.282 1.00 37.69 C ATOM 972 CE LYS B 965 67.520 10.275 0.939 1.00 43.67 C ATOM 973 NZ LYS B 965 68.793 10.812 0.327 1.00 46.44 N ATOM 974 N LEU B 966 70.106 5.622 5.424 1.00 36.99 N ATOM 975 CA LEU B 966 70.320 5.265 6.829 1.00 37.11 C ATOM 976 C LEU B 966 71.594 4.436 7.000 1.00 37.66 C ATOM 977 O LEU B 966 72.429 4.736 7.867 1.00 37.24 O ATOM 978 CB LEU B 966 69.092 4.563 7.438 1.00 36.57 C ATOM 979 CG LEU B 966 69.241 4.272 8.948 1.00 37.49 C ATOM 980 CD1 LEU B 966 69.489 5.574 9.741 1.00 38.18 C ATOM 981 CD2 LEU B 966 68.038 3.511 9.496 1.00 37.28 C ATOM 982 N LEU B 967 71.770 3.414 6.162 1.00 37.85 N ATOM 983 CA LEU B 967 72.987 2.605 6.253 1.00 38.40 C ATOM 984 C LEU B 967 74.231 3.433 5.925 1.00 38.88 C ATOM 985 O LEU B 967 75.277 3.252 6.554 1.00 38.77 O ATOM 986 CB LEU B 967 72.916 1.370 5.351 1.00 39.43 C ATOM 987 CG LEU B 967 71.739 0.404 5.566 1.00 42.48 C ATOM 988 CD1 LEU B 967 71.899 -0.830 4.672 1.00 43.06 C ATOM 989 CD2 LEU B 967 71.531 -0.011 7.021 1.00 44.35 C ATOM 990 N SER B 968 74.127 4.351 4.955 1.00 37.90 N ATOM 991 CA SER B 968 75.242 5.283 4.703 1.00 38.20 C ATOM 992 C SER B 968 75.530 6.149 5.934 1.00 38.26 C ATOM 993 O SER B 968 76.686 6.345 6.289 1.00 38.30 O ATOM 994 CB SER B 968 74.968 6.178 3.502 1.00 38.07 C ATOM 995 OG SER B 968 74.948 5.415 2.314 1.00 38.71 O ATOM 996 N ALA B 969 74.481 6.667 6.581 1.00 38.37 N ATOM 997 CA ALA B 969 74.664 7.516 7.761 1.00 39.10 C ATOM 998 C ALA B 969 75.394 6.788 8.890 1.00 39.63 C ATOM 999 O ALA B 969 76.292 7.359 9.529 1.00 40.22 O ATOM 1000 CB ALA B 969 73.317 8.075 8.247 1.00 38.87 C ATOM 1001 N VAL B 970 75.009 5.534 9.122 1.00 39.68 N ATOM 1002 CA VAL B 970 75.662 4.666 10.110 1.00 39.77 C ATOM 1003 C VAL B 970 77.152 4.500 9.772 1.00 40.39 C ATOM 1004 O VAL B 970 78.019 4.678 10.641 1.00 40.54 O ATOM 1005 CB VAL B 970 74.977 3.281 10.189 1.00 39.82 C ATOM 1006 CG1 VAL B 970 75.826 2.295 10.985 1.00 39.06 C ATOM 1007 CG2 VAL B 970 73.578 3.394 10.807 1.00 38.99 C ATOM 1008 N ASP B 971 77.437 4.192 8.509 1.00 40.61 N ATOM 1009 CA ASP B 971 78.827 4.088 8.010 1.00 41.79 C ATOM 1010 C ASP B 971 79.614 5.388 8.240 1.00 41.30 C ATOM 1011 O ASP B 971 80.719 5.371 8.807 1.00 41.88 O ATOM 1012 CB ASP B 971 78.826 3.735 6.516 1.00 41.41 C ATOM 1013 CG ASP B 971 80.199 3.262 6.010 1.00 45.85 C ATOM 1014 OD1 ASP B 971 80.936 2.588 6.761 1.00 47.00 O ATOM 1015 OD2 ASP B 971 80.541 3.557 4.843 1.00 49.38 O ATOM 1016 N ILE B 972 79.042 6.505 7.798 1.00 40.63 N ATOM 1017 CA ILE B 972 79.699 7.821 7.836 1.00 40.84 C ATOM 1018 C ILE B 972 80.082 8.250 9.250 1.00 41.36 C ATOM 1019 O ILE B 972 81.161 8.835 9.473 1.00 41.15 O ATOM 1020 CB ILE B 972 78.794 8.911 7.190 1.00 41.02 C ATOM 1021 CG1 ILE B 972 78.672 8.681 5.680 1.00 40.75 C ATOM 1022 CG2 ILE B 972 79.314 10.323 7.481 1.00 40.59 C ATOM 1023 CD1 ILE B 972 77.351 9.221 5.077 1.00 42.44 C ATOM 1024 N LEU B 973 79.198 7.968 10.205 1.00 41.40 N ATOM 1025 CA LEU B 973 79.401 8.399 11.586 1.00 41.90 C ATOM 1026 C LEU B 973 80.316 7.433 12.357 1.00 41.85 C ATOM 1027 O LEU B 973 80.631 7.665 13.530 1.00 41.58 O ATOM 1028 CB LEU B 973 78.050 8.607 12.287 1.00 41.53 C ATOM 1029 CG LEU B 973 77.412 10.008 12.177 1.00 43.29 C ATOM 1030 CD1 LEU B 973 77.348 10.549 10.778 1.00 45.06 C ATOM 1031 CD2 LEU B 973 76.038 10.014 12.764 1.00 43.26 C ATOM 1032 N GLY B 974 80.744 6.361 11.696 1.00 41.93 N ATOM 1033 CA GLY B 974 81.800 5.473 12.240 1.00 42.23 C ATOM 1034 C GLY B 974 81.402 4.433 13.278 1.00 42.47 C ATOM 1035 O GLY B 974 82.274 3.842 13.947 1.00 41.95 O ATOM 1036 N GLU B 975 80.094 4.201 13.417 1.00 42.88 N ATOM 1037 CA GLU B 975 79.551 3.182 14.335 1.00 44.37 C ATOM 1038 C GLU B 975 80.065 3.331 15.768 1.00 44.34 C ATOM 1039 O GLU B 975 80.426 2.341 16.436 1.00 44.78 O ATOM 1040 CB GLU B 975 79.821 1.776 13.792 1.00 44.68 C ATOM 1041 CG GLU B 975 79.219 1.540 12.408 1.00 45.35 C ATOM 1042 CD GLU B 975 79.595 0.182 11.798 1.00 46.91 C ATOM 1043 OE1 GLU B 975 78.918 -0.224 10.837 1.00 50.09 O ATOM 1044 OE2 GLU B 975 80.554 -0.482 12.273 1.00 51.76 O ATOM 1045 N LYS B 976 80.118 4.586 16.216 1.00 43.50 N ATOM 1046 CA LYS B 976 80.571 4.946 17.554 1.00 43.34 C ATOM 1047 C LYS B 976 79.395 5.413 18.413 1.00 42.57 C ATOM 1048 O LYS B 976 79.564 5.649 19.608 1.00 42.10 O ATOM 1049 CB LYS B 976 81.566 6.103 17.480 1.00 43.88 C ATOM 1050 CG LYS B 976 82.913 5.802 16.842 1.00 46.99 C ATOM 1051 CD LYS B 976 83.538 7.128 16.352 1.00 50.92 C ATOM 1052 CE LYS B 976 82.935 8.344 17.075 1.00 52.17 C ATOM 1053 NZ LYS B 976 83.372 9.653 16.504 1.00 54.09 N ATOM 1054 N PHE B 977 78.228 5.559 17.783 1.00 41.65 N ATOM 1055 CA PHE B 977 77.007 6.037 18.410 1.00 41.88 C ATOM 1056 C PHE B 977 75.879 5.068 18.145 1.00 41.72 C ATOM 1057 O PHE B 977 75.997 4.175 17.302 1.00 41.51 O ATOM 1058 CB PHE B 977 76.619 7.420 17.863 1.00 42.33 C ATOM 1059 CG PHE B 977 77.645 8.467 18.113 1.00 42.83 C ATOM 1060 CD1 PHE B 977 77.723 9.093 19.339 1.00 44.66 C ATOM 1061 CD2 PHE B 977 78.538 8.837 17.107 1.00 45.98 C ATOM 1062 CE1 PHE B 977 78.684 10.069 19.589 1.00 45.18 C ATOM 1063 CE2 PHE B 977 79.504 9.806 17.349 1.00 46.44 C ATOM 1064 CZ PHE B 977 79.585 10.410 18.592 1.00 44.94 C ATOM 1065 N GLY B 978 74.790 5.245 18.878 1.00 41.57 N ATOM 1066 CA GLY B 978 73.558 4.543 18.612 1.00 41.42 C ATOM 1067 C GLY B 978 72.904 5.131 17.369 1.00 41.91 C ATOM 1068 O GLY B 978 73.424 6.073 16.764 1.00 41.15 O ATOM 1069 N ILE B 979 71.756 4.583 17.001 1.00 41.73 N ATOM 1070 CA ILE B 979 71.120 4.925 15.728 1.00 41.78 C ATOM 1071 C ILE B 979 70.567 6.356 15.702 1.00 41.51 C ATOM 1072 O ILE B 979 70.318 6.913 14.631 1.00 41.26 O ATOM 1073 CB ILE B 979 70.038 3.883 15.336 1.00 41.97 C ATOM 1074 CG1 ILE B 979 69.659 4.009 13.846 1.00 42.41 C ATOM 1075 CG2 ILE B 979 68.791 4.036 16.209 1.00 42.94 C ATOM 1076 CD1 ILE B 979 70.764 3.650 12.885 1.00 41.79 C ATOM 1077 N GLY B 980 70.395 6.953 16.884 1.00 41.19 N ATOM 1078 CA GLY B 980 69.856 8.302 17.006 1.00 40.53 C ATOM 1079 C GLY B 980 70.708 9.347 16.317 1.00 40.21 C ATOM 1080 O GLY B 980 70.192 10.305 15.745 1.00 39.66 O ATOM 1081 N LEU B 981 72.019 9.148 16.337 1.00 39.90 N ATOM 1082 CA LEU B 981 72.910 10.093 15.679 1.00 40.13 C ATOM 1083 C LEU B 981 72.852 10.070 14.148 1.00 38.90 C ATOM 1084 O LEU B 981 72.744 11.131 13.534 1.00 38.99 O ATOM 1085 CB LEU B 981 74.330 9.998 16.223 1.00 40.73 C ATOM 1086 CG LEU B 981 74.389 11.162 17.222 1.00 43.80 C ATOM 1087 CD1 LEU B 981 74.718 10.739 18.633 1.00 43.45 C ATOM 1088 CD2 LEU B 981 75.293 12.283 16.707 1.00 45.44 C ATOM 1089 N PRO B 982 72.950 8.881 13.523 1.00 38.48 N ATOM 1090 CA PRO B 982 72.625 8.808 12.089 1.00 37.77 C ATOM 1091 C PRO B 982 71.293 9.463 11.732 1.00 37.13 C ATOM 1092 O PRO B 982 71.208 10.161 10.720 1.00 37.45 O ATOM 1093 CB PRO B 982 72.595 7.300 11.825 1.00 37.33 C ATOM 1094 CG PRO B 982 73.623 6.787 12.765 1.00 37.79 C ATOM 1095 CD PRO B 982 73.466 7.584 14.012 1.00 38.19 C ATOM 1096 N ILE B 983 70.273 9.283 12.569 1.00 36.67 N ATOM 1097 CA ILE B 983 68.969 9.907 12.321 1.00 36.28 C ATOM 1098 C ILE B 983 69.025 11.447 12.413 1.00 35.75 C ATOM 1099 O ILE B 983 68.522 12.134 11.522 1.00 35.47 O ATOM 1100 CB ILE B 983 67.842 9.258 13.181 1.00 36.03 C ATOM 1101 CG1 ILE B 983 67.687 7.788 12.765 1.00 36.67 C ATOM 1102 CG2 ILE B 983 66.509 10.019 13.039 1.00 36.63 C ATOM 1103 CD1 ILE B 983 66.854 6.924 13.705 1.00 37.35 C ATOM 1104 N LEU B 984 69.659 11.986 13.459 1.00 35.10 N ATOM 1105 CA LEU B 984 69.877 13.436 13.556 1.00 34.88 C ATOM 1106 C LEU B 984 70.583 13.989 12.314 1.00 34.67 C ATOM 1107 O LEU B 984 70.205 15.035 11.782 1.00 34.92 O ATOM 1108 CB LEU B 984 70.669 13.781 14.837 1.00 34.96 C ATOM 1109 CG LEU B 984 69.902 13.658 16.164 1.00 35.16 C ATOM 1110 CD1 LEU B 984 70.828 13.907 17.369 1.00 36.71 C ATOM 1111 CD2 LEU B 984 68.668 14.582 16.247 1.00 37.34 C ATOM 1112 N PHE B 985 71.606 13.271 11.873 1.00 34.40 N ATOM 1113 CA PHE B 985 72.369 13.572 10.667 1.00 35.14 C ATOM 1114 C PHE B 985 71.481 13.683 9.420 1.00 35.19 C ATOM 1115 O PHE B 985 71.522 14.694 8.716 1.00 34.93 O ATOM 1116 CB PHE B 985 73.463 12.510 10.486 1.00 35.23 C ATOM 1117 CG PHE B 985 74.151 12.556 9.151 1.00 36.33 C ATOM 1118 CD1 PHE B 985 75.164 13.475 8.903 1.00 37.99 C ATOM 1119 CD2 PHE B 985 73.799 11.658 8.148 1.00 36.85 C ATOM 1120 CE1 PHE B 985 75.812 13.504 7.658 1.00 37.27 C ATOM 1121 CE2 PHE B 985 74.446 11.668 6.910 1.00 37.55 C ATOM 1122 CZ PHE B 985 75.446 12.606 6.663 1.00 37.57 C ATOM 1123 N LEU B 986 70.678 12.650 9.165 1.00 35.42 N ATOM 1124 CA LEU B 986 69.744 12.636 8.029 1.00 35.51 C ATOM 1125 C LEU B 986 68.659 13.695 8.139 1.00 35.81 C ATOM 1126 O LEU B 986 68.224 14.260 7.133 1.00 35.85 O ATOM 1127 CB LEU B 986 69.094 11.252 7.883 1.00 35.54 C ATOM 1128 CG LEU B 986 69.987 10.082 7.441 1.00 36.73 C ATOM 1129 CD1 LEU B 986 69.170 8.785 7.374 1.00 37.33 C ATOM 1130 CD2 LEU B 986 70.643 10.388 6.096 1.00 35.60 C ATOM 1131 N ARG B 987 68.218 13.980 9.358 1.00 35.70 N ATOM 1132 CA ARG B 987 67.141 14.952 9.541 1.00 35.98 C ATOM 1133 C ARG B 987 67.623 16.403 9.569 1.00 35.89 C ATOM 1134 O ARG B 987 66.824 17.325 9.741 1.00 35.59 O ATOM 1135 CB ARG B 987 66.287 14.593 10.766 1.00 36.15 C ATOM 1136 CG ARG B 987 65.568 13.255 10.570 1.00 37.67 C ATOM 1137 CD ARG B 987 64.263 13.167 11.312 1.00 38.47 C ATOM 1138 NE ARG B 987 63.304 14.180 10.877 1.00 40.53 N ATOM 1139 CZ ARG B 987 62.946 15.222 11.615 1.00 40.93 C ATOM 1140 NH1 ARG B 987 63.469 15.378 12.832 1.00 42.49 N ATOM 1141 NH2 ARG B 987 62.064 16.103 11.142 1.00 41.19 N ATOM 1142 N GLY B 988 68.927 16.594 9.384 1.00 35.88 N ATOM 1143 CA GLY B 988 69.520 17.924 9.286 1.00 36.06 C ATOM 1144 C GLY B 988 69.536 18.663 10.603 1.00 36.46 C ATOM 1145 O GLY B 988 69.325 19.870 10.643 1.00 36.46 O ATOM 1146 N SER B 989 69.790 17.934 11.684 1.00 36.93 N ATOM 1147 CA SER B 989 69.739 18.495 13.034 1.00 37.65 C ATOM 1148 C SER B 989 70.882 19.462 13.319 1.00 38.54 C ATOM 1149 O SER B 989 72.004 19.261 12.849 1.00 38.66 O ATOM 1150 CB SER B 989 69.759 17.365 14.064 1.00 37.24 C ATOM 1151 OG SER B 989 69.723 17.881 15.382 1.00 36.17 O ATOM 1152 N ASN B 990 70.591 20.504 14.096 1.00 39.40 N ATOM 1153 CA ASN B 990 71.634 21.374 14.646 1.00 40.72 C ATOM 1154 C ASN B 990 72.075 20.958 16.057 1.00 41.27 C ATOM 1155 O ASN B 990 72.756 21.712 16.756 1.00 41.11 O ATOM 1156 CB ASN B 990 71.204 22.854 14.592 1.00 41.11 C ATOM 1157 CG ASN B 990 71.148 23.389 13.170 1.00 42.76 C ATOM 1158 OD1 ASN B 990 71.927 22.972 12.300 1.00 46.38 O ATOM 1159 ND2 ASN B 990 70.217 24.303 12.916 1.00 44.65 N ATOM 1160 N SER B 991 71.701 19.740 16.449 1.00 41.99 N ATOM 1161 CA SER B 991 72.037 19.170 17.755 1.00 43.08 C ATOM 1162 C SER B 991 73.532 19.212 18.057 1.00 43.51 C ATOM 1163 O SER B 991 74.363 18.988 17.169 1.00 43.39 O ATOM 1164 CB SER B 991 71.552 17.720 17.838 1.00 43.22 C ATOM 1165 OG SER B 991 71.956 17.102 19.054 1.00 44.08 O ATOM 1166 N GLN B 992 73.855 19.483 19.320 1.00 44.21 N ATOM 1167 CA GLN B 992 75.232 19.466 19.813 1.00 45.18 C ATOM 1168 C GLN B 992 75.850 18.070 19.793 1.00 45.24 C ATOM 1169 O GLN B 992 77.073 17.941 19.803 1.00 45.76 O ATOM 1170 CB GLN B 992 75.316 20.056 21.235 1.00 45.17 C ATOM 1171 CG GLN B 992 74.700 19.193 22.350 1.00 45.61 C ATOM 1172 CD GLN B 992 74.766 19.855 23.714 1.00 46.60 C ATOM 1173 OE1 GLN B 992 75.194 21.002 23.842 1.00 48.78 O ATOM 1174 NE2 GLN B 992 74.332 19.136 24.741 1.00 48.96 N ATOM 1175 N ARG B 993 75.000 17.041 19.776 1.00 45.17 N ATOM 1176 CA ARG B 993 75.428 15.644 19.749 1.00 44.76 C ATOM 1177 C ARG B 993 76.199 15.324 18.472 1.00 44.97 C ATOM 1178 O ARG B 993 77.099 14.476 18.472 1.00 44.89 O ATOM 1179 CB ARG B 993 74.219 14.707 19.870 1.00 44.86 C ATOM 1180 CG ARG B 993 73.405 14.858 21.163 1.00 44.11 C ATOM 1181 CD ARG B 993 72.153 13.973 21.155 1.00 44.18 C ATOM 1182 NE ARG B 993 72.457 12.536 21.194 1.00 43.71 N ATOM 1183 CZ ARG B 993 71.609 11.565 20.838 1.00 44.35 C ATOM 1184 NH1 ARG B 993 70.384 11.852 20.395 1.00 43.35 N ATOM 1185 NH2 ARG B 993 71.986 10.295 20.919 1.00 43.28 N ATOM 1186 N LEU B 994 75.836 16.002 17.386 1.00 45.21 N ATOM 1187 CA LEU B 994 76.445 15.767 16.083 1.00 45.82 C ATOM 1188 C LEU B 994 77.548 16.779 15.806 1.00 46.65 C ATOM 1189 O LEU B 994 77.311 17.984 15.847 1.00 46.63 O ATOM 1190 CB LEU B 994 75.381 15.814 14.971 1.00 45.46 C ATOM 1191 CG LEU B 994 75.813 15.511 13.525 1.00 45.24 C ATOM 1192 CD1 LEU B 994 76.103 14.027 13.313 1.00 43.91 C ATOM 1193 CD2 LEU B 994 74.756 15.989 12.546 1.00 45.13 C ATOM 1194 N ALA B 995 78.746 16.274 15.521 1.00 47.61 N ATOM 1195 CA ALA B 995 79.904 17.113 15.213 1.00 48.49 C ATOM 1196 C ALA B 995 79.741 17.861 13.891 1.00 49.14 C ATOM 1197 O ALA B 995 79.133 17.346 12.948 1.00 49.00 O ATOM 1198 CB ALA B 995 81.180 16.274 15.204 1.00 48.49 C ATOM 1199 N ASP B 996 80.302 19.069 13.835 1.00 49.92 N ATOM 1200 CA ASP B 996 80.179 19.954 12.672 1.00 51.04 C ATOM 1201 C ASP B 996 80.739 19.397 11.367 1.00 51.26 C ATOM 1202 O ASP B 996 80.183 19.653 10.295 1.00 51.13 O ATOM 1203 CB ASP B 996 80.819 21.316 12.959 1.00 51.52 C ATOM 1204 CG ASP B 996 79.874 22.271 13.668 1.00 53.25 C ATOM 1205 OD1 ASP B 996 80.366 23.249 14.273 1.00 54.67 O ATOM 1206 OD2 ASP B 996 78.643 22.046 13.618 1.00 55.34 O ATOM 1207 N GLN B 997 81.838 18.652 11.454 1.00 51.67 N ATOM 1208 CA GLN B 997 82.462 18.046 10.270 1.00 52.30 C ATOM 1209 C GLN B 997 81.461 17.268 9.412 1.00 51.95 C ATOM 1210 O GLN B 997 81.607 17.197 8.192 1.00 51.94 O ATOM 1211 CB GLN B 997 83.622 17.129 10.681 1.00 52.66 C ATOM 1212 CG GLN B 997 83.243 16.042 11.669 1.00 54.37 C ATOM 1213 CD GLN B 997 84.446 15.378 12.305 1.00 56.81 C ATOM 1214 OE1 GLN B 997 84.729 15.589 13.484 1.00 57.57 O ATOM 1215 NE2 GLN B 997 85.167 14.576 11.525 1.00 57.97 N ATOM 1216 N TYR B 998 80.452 16.691 10.062 1.00 51.75 N ATOM 1217 CA TYR B 998 79.463 15.854 9.387 1.00 51.47 C ATOM 1218 C TYR B 998 78.404 16.647 8.630 1.00 51.33 C ATOM 1219 O TYR B 998 77.803 16.138 7.685 1.00 51.30 O ATOM 1220 CB TYR B 998 78.815 14.894 10.381 1.00 51.43 C ATOM 1221 CG TYR B 998 79.808 13.934 10.987 1.00 51.67 C ATOM 1222 CD1 TYR B 998 80.482 13.001 10.189 1.00 50.80 C ATOM 1223 CD2 TYR B 998 80.086 13.960 12.349 1.00 51.47 C ATOM 1224 CE1 TYR B 998 81.401 12.122 10.736 1.00 50.94 C ATOM 1225 CE2 TYR B 998 81.005 13.083 12.906 1.00 51.82 C ATOM 1226 CZ TYR B 998 81.658 12.168 12.091 1.00 51.68 C ATOM 1227 OH TYR B 998 82.572 11.302 12.637 1.00 52.47 O ATOM 1228 N ARG B 999 78.199 17.897 9.035 1.00 51.17 N ATOM 1229 CA ARG B 999 77.252 18.789 8.366 1.00 51.08 C ATOM 1230 C ARG B 999 77.739 19.174 6.970 1.00 51.37 C ATOM 1231 O ARG B 999 77.001 19.772 6.184 1.00 51.48 O ATOM 1232 CB ARG B 999 76.991 20.040 9.217 1.00 51.05 C ATOM 1233 CG ARG B 999 76.364 19.719 10.559 1.00 50.38 C ATOM 1234 CD ARG B 999 75.840 20.940 11.312 1.00 50.74 C ATOM 1235 NE ARG B 999 74.986 20.500 12.415 1.00 49.71 N ATOM 1236 CZ ARG B 999 75.434 20.054 13.586 1.00 50.25 C ATOM 1237 NH1 ARG B 999 76.736 20.017 13.837 1.00 51.21 N ATOM 1238 NH2 ARG B 999 74.578 19.643 14.513 1.00 49.35 N ATOM 1239 N ARG B1000 78.989 18.819 6.679 1.00 51.35 N ATOM 1240 CA ARG B1000 79.604 19.056 5.377 1.00 51.36 C ATOM 1241 C ARG B1000 79.253 17.951 4.384 1.00 50.47 C ATOM 1242 O ARG B1000 79.326 18.162 3.173 1.00 50.60 O ATOM 1243 CB ARG B1000 81.126 19.154 5.516 1.00 51.39 C ATOM 1244 CG ARG B1000 81.615 20.312 6.383 1.00 52.53 C ATOM 1245 CD ARG B1000 83.147 20.413 6.387 1.00 53.00 C ATOM 1246 NE ARG B1000 83.713 20.335 5.036 1.00 55.81 N ATOM 1247 CZ ARG B1000 83.900 21.377 4.224 1.00 56.73 C ATOM 1248 NH1 ARG B1000 83.574 22.607 4.612 1.00 57.07 N ATOM 1249 NH2 ARG B1000 84.418 21.187 3.016 1.00 57.18 N ATOM 1250 N HIS B1001 78.877 16.780 4.895 1.00 49.31 N ATOM 1251 CA HIS B1001 78.572 15.633 4.035 1.00 48.49 C ATOM 1252 C HIS B1001 77.322 15.873 3.199 1.00 48.04 C ATOM 1253 O HIS B1001 76.352 16.457 3.680 1.00 48.27 O ATOM 1254 CB HIS B1001 78.412 14.345 4.849 1.00 48.14 C ATOM 1255 CG HIS B1001 78.529 13.102 4.023 1.00 47.35 C ATOM 1256 ND1 HIS B1001 79.631 12.277 4.078 1.00 47.26 N ATOM 1257 CD2 HIS B1001 77.697 12.557 3.105 1.00 46.65 C ATOM 1258 CE1 HIS B1001 79.471 11.274 3.235 1.00 45.98 C ATOM 1259 NE2 HIS B1001 78.306 11.421 2.630 1.00 47.37 N ATOM 1260 N SER B1002 77.346 15.399 1.956 1.00 47.25 N ATOM 1261 CA SER B1002 76.247 15.630 1.019 1.00 46.76 C ATOM 1262 C SER B1002 74.913 15.019 1.476 1.00 45.95 C ATOM 1263 O SER B1002 73.844 15.492 1.077 1.00 45.74 O ATOM 1264 CB SER B1002 76.617 15.123 -0.378 1.00 46.77 C ATOM 1265 OG SER B1002 76.568 13.707 -0.427 1.00 48.13 O ATOM 1266 N LEU B1003 74.974 13.986 2.318 1.00 44.64 N ATOM 1267 CA LEU B1003 73.759 13.317 2.794 1.00 43.44 C ATOM 1268 C LEU B1003 73.102 13.993 4.003 1.00 42.48 C ATOM 1269 O LEU B1003 71.981 13.639 4.376 1.00 41.54 O ATOM 1270 CB LEU B1003 74.030 11.841 3.100 1.00 43.40 C ATOM 1271 CG LEU B1003 74.167 10.870 1.919 1.00 44.26 C ATOM 1272 CD1 LEU B1003 74.556 9.489 2.421 1.00 44.08 C ATOM 1273 CD2 LEU B1003 72.893 10.775 1.083 1.00 45.04 C ATOM 1274 N PHE B1004 73.806 14.947 4.612 1.00 41.66 N ATOM 1275 CA PHE B1004 73.312 15.649 5.790 1.00 41.32 C ATOM 1276 C PHE B1004 72.014 16.369 5.458 1.00 41.52 C ATOM 1277 O PHE B1004 71.952 17.135 4.491 1.00 41.03 O ATOM 1278 CB PHE B1004 74.356 16.650 6.302 1.00 41.22 C ATOM 1279 CG PHE B1004 73.858 17.538 7.412 1.00 41.09 C ATOM 1280 CD1 PHE B1004 73.657 17.032 8.694 1.00 40.65 C ATOM 1281 CD2 PHE B1004 73.600 18.891 7.178 1.00 41.49 C ATOM 1282 CE1 PHE B1004 73.195 17.856 9.723 1.00 41.10 C ATOM 1283 CE2 PHE B1004 73.141 19.724 8.201 1.00 40.89 C ATOM 1284 CZ PHE B1004 72.936 19.210 9.469 1.00 41.08 C ATOM 1285 N GLY B1005 70.972 16.102 6.239 1.00 41.43 N ATOM 1286 CA GLY B1005 69.675 16.745 6.013 1.00 41.54 C ATOM 1287 C GLY B1005 68.862 16.225 4.835 1.00 41.90 C ATOM 1288 O GLY B1005 67.838 16.820 4.481 1.00 41.86 O ATOM 1289 N THR B1006 69.294 15.125 4.221 1.00 42.14 N ATOM 1290 CA THR B1006 68.589 14.603 3.038 1.00 42.61 C ATOM 1291 C THR B1006 67.445 13.655 3.391 1.00 42.66 C ATOM 1292 O THR B1006 66.775 13.130 2.497 1.00 42.23 O ATOM 1293 CB THR B1006 69.537 13.911 2.023 1.00 42.67 C ATOM 1294 OG1 THR B1006 70.207 12.814 2.651 1.00 43.09 O ATOM 1295 CG2 THR B1006 70.553 14.903 1.469 1.00 43.80 C ATOM 1296 N GLY B1007 67.223 13.450 4.691 1.00 42.42 N ATOM 1297 CA GLY B1007 66.162 12.579 5.176 1.00 42.97 C ATOM 1298 C GLY B1007 65.075 13.329 5.927 1.00 43.76 C ATOM 1299 O GLY B1007 64.349 12.740 6.729 1.00 43.41 O ATOM 1300 N LYS B1008 64.963 14.629 5.662 1.00 44.43 N ATOM 1301 CA LYS B1008 63.959 15.480 6.304 1.00 46.04 C ATOM 1302 C LYS B1008 62.517 15.110 5.955 1.00 46.66 C ATOM 1303 O LYS B1008 61.600 15.437 6.713 1.00 47.60 O ATOM 1304 CB LYS B1008 64.199 16.953 5.958 1.00 46.18 C ATOM 1305 CG LYS B1008 65.469 17.531 6.542 1.00 47.17 C ATOM 1306 CD LYS B1008 65.581 19.020 6.225 1.00 49.17 C ATOM 1307 CE LYS B1008 66.630 19.662 7.118 1.00 50.35 C ATOM 1308 NZ LYS B1008 66.790 21.115 6.851 1.00 52.32 N ATOM 1309 N ASP B1009 62.313 14.450 4.815 1.00 47.29 N ATOM 1310 CA ASP B1009 60.969 14.045 4.373 1.00 47.98 C ATOM 1311 C ASP B1009 60.265 13.165 5.393 1.00 47.68 C ATOM 1312 O ASP B1009 59.040 13.222 5.526 1.00 48.12 O ATOM 1313 CB ASP B1009 61.025 13.286 3.045 1.00 48.70 C ATOM 1314 CG ASP B1009 61.338 14.182 1.865 1.00 50.43 C ATOM 1315 OD1 ASP B1009 60.852 15.338 1.833 1.00 52.88 O ATOM 1316 OD2 ASP B1009 62.066 13.713 0.961 1.00 53.34 O ATOM 1317 N GLN B1010 61.046 12.350 6.097 1.00 46.91 N ATOM 1318 CA GLN B1010 60.520 11.419 7.082 1.00 46.63 C ATOM 1319 C GLN B1010 60.815 11.878 8.506 1.00 45.69 C ATOM 1320 O GLN B1010 61.857 12.480 8.771 1.00 45.55 O ATOM 1321 CB GLN B1010 61.090 10.020 6.840 1.00 46.91 C ATOM 1322 CG GLN B1010 60.221 9.061 5.997 1.00 49.62 C ATOM 1323 CD GLN B1010 59.803 9.594 4.635 1.00 52.40 C ATOM 1324 OE1 GLN B1010 60.249 9.100 3.594 1.00 54.72 O ATOM 1325 NE2 GLN B1010 58.923 10.583 4.634 1.00 53.08 N ATOM 1326 N THR B1011 59.893 11.581 9.417 1.00 44.78 N ATOM 1327 CA THR B1011 60.006 12.006 10.815 1.00 44.05 C ATOM 1328 C THR B1011 61.069 11.197 11.548 1.00 44.00 C ATOM 1329 O THR B1011 61.449 10.118 11.089 1.00 43.33 O ATOM 1330 CB THR B1011 58.661 11.856 11.573 1.00 44.20 C ATOM 1331 OG1 THR B1011 58.317 10.466 11.682 1.00 42.67 O ATOM 1332 CG2 THR B1011 57.537 12.613 10.862 1.00 43.91 C ATOM 1333 N GLU B1012 61.539 11.712 12.687 1.00 43.70 N ATOM 1334 CA GLU B1012 62.503 10.992 13.518 1.00 44.21 C ATOM 1335 C GLU B1012 61.915 9.653 13.948 1.00 43.55 C ATOM 1336 O GLU B1012 62.618 8.646 14.000 1.00 43.81 O ATOM 1337 CB GLU B1012 62.909 11.821 14.755 1.00 44.22 C ATOM 1338 CG GLU B1012 64.078 11.213 15.511 1.00 45.17 C ATOM 1339 CD GLU B1012 64.536 12.003 16.730 1.00 45.74 C ATOM 1340 OE1 GLU B1012 65.663 12.556 16.695 1.00 46.88 O ATOM 1341 OE2 GLU B1012 63.789 12.046 17.734 1.00 48.94 O ATOM 1342 N SER B1013 60.619 9.665 14.261 1.00 43.37 N ATOM 1343 CA SER B1013 59.890 8.464 14.651 1.00 42.89 C ATOM 1344 C SER B1013 59.894 7.420 13.526 1.00 42.14 C ATOM 1345 O SER B1013 60.098 6.230 13.779 1.00 41.24 O ATOM 1346 CB SER B1013 58.458 8.825 15.046 1.00 43.57 C ATOM 1347 OG SER B1013 57.744 7.675 15.456 1.00 45.38 O ATOM 1348 N TRP B1014 59.668 7.874 12.294 1.00 41.18 N ATOM 1349 CA TRP B1014 59.688 6.980 11.146 1.00 40.85 C ATOM 1350 C TRP B1014 61.060 6.324 11.000 1.00 40.45 C ATOM 1351 O TRP B1014 61.149 5.103 10.865 1.00 41.15 O ATOM 1352 CB TRP B1014 59.277 7.700 9.858 1.00 40.92 C ATOM 1353 CG TRP B1014 59.127 6.742 8.693 1.00 40.70 C ATOM 1354 CD1 TRP B1014 57.972 6.155 8.256 1.00 41.55 C ATOM 1355 CD2 TRP B1014 60.172 6.247 7.844 1.00 40.69 C ATOM 1356 NE1 TRP B1014 58.234 5.336 7.182 1.00 41.43 N ATOM 1357 CE2 TRP B1014 59.575 5.376 6.908 1.00 41.42 C ATOM 1358 CE3 TRP B1014 61.555 6.464 7.776 1.00 40.50 C ATOM 1359 CZ2 TRP B1014 60.317 4.715 5.921 1.00 40.48 C ATOM 1360 CZ3 TRP B1014 62.288 5.814 6.791 1.00 40.51 C ATOM 1361 CH2 TRP B1014 61.664 4.951 5.880 1.00 40.89 C ATOM 1362 N TRP B1015 62.123 7.130 11.043 1.00 39.55 N ATOM 1363 CA TRP B1015 63.483 6.614 10.901 1.00 39.32 C ATOM 1364 C TRP B1015 63.809 5.598 11.999 1.00 39.28 C ATOM 1365 O TRP B1015 64.455 4.606 11.742 1.00 38.69 O ATOM 1366 CB TRP B1015 64.511 7.750 10.873 1.00 38.80 C ATOM 1367 CG TRP B1015 64.545 8.501 9.578 1.00 38.48 C ATOM 1368 CD1 TRP B1015 64.085 9.772 9.349 1.00 37.42 C ATOM 1369 CD2 TRP B1015 65.058 8.030 8.322 1.00 37.31 C ATOM 1370 NE1 TRP B1015 64.285 10.120 8.032 1.00 37.33 N ATOM 1371 CE2 TRP B1015 64.876 9.070 7.378 1.00 37.86 C ATOM 1372 CE3 TRP B1015 65.645 6.827 7.901 1.00 37.40 C ATOM 1373 CZ2 TRP B1015 65.271 8.945 6.036 1.00 37.64 C ATOM 1374 CZ3 TRP B1015 66.031 6.703 6.566 1.00 38.20 C ATOM 1375 CH2 TRP B1015 65.846 7.758 5.654 1.00 38.06 C ATOM 1376 N LYS B1016 63.319 5.832 13.214 1.00 39.77 N ATOM 1377 CA LYS B1016 63.500 4.867 14.301 1.00 40.71 C ATOM 1378 C LYS B1016 62.793 3.539 14.008 1.00 40.26 C ATOM 1379 O LYS B1016 63.398 2.472 14.169 1.00 40.93 O ATOM 1380 CB LYS B1016 62.987 5.441 15.636 1.00 41.15 C ATOM 1381 CG LYS B1016 63.777 6.625 16.162 1.00 44.49 C ATOM 1382 CD LYS B1016 65.093 6.213 16.790 1.00 50.06 C ATOM 1383 CE LYS B1016 65.726 7.367 17.568 1.00 51.89 C ATOM 1384 NZ LYS B1016 64.951 7.738 18.788 1.00 54.83 N ATOM 1385 N ALA B1017 61.523 3.616 13.595 1.00 40.10 N ATOM 1386 CA ALA B1017 60.735 2.433 13.234 1.00 39.94 C ATOM 1387 C ALA B1017 61.438 1.665 12.121 1.00 40.04 C ATOM 1388 O ALA B1017 61.543 0.434 12.161 1.00 39.98 O ATOM 1389 CB ALA B1017 59.327 2.829 12.802 1.00 40.12 C ATOM 1390 N PHE B1018 61.939 2.416 11.144 1.00 39.68 N ATOM 1391 CA PHE B1018 62.677 1.846 10.020 1.00 39.26 C ATOM 1392 C PHE B1018 63.939 1.133 10.479 1.00 39.34 C ATOM 1393 O PHE B1018 64.219 0.026 10.028 1.00 39.48 O ATOM 1394 CB PHE B1018 63.018 2.945 9.023 1.00 39.00 C ATOM 1395 CG PHE B1018 63.635 2.445 7.743 1.00 38.76 C ATOM 1396 CD1 PHE B1018 63.035 1.420 7.012 1.00 38.69 C ATOM 1397 CD2 PHE B1018 64.782 3.043 7.248 1.00 36.22 C ATOM 1398 CE1 PHE B1018 63.602 0.974 5.809 1.00 39.78 C ATOM 1399 CE2 PHE B1018 65.344 2.610 6.049 1.00 39.43 C ATOM 1400 CZ PHE B1018 64.748 1.575 5.334 1.00 38.97 C ATOM 1401 N SER B1019 64.698 1.757 11.382 1.00 39.31 N ATOM 1402 CA SER B1019 65.917 1.142 11.900 1.00 39.47 C ATOM 1403 C SER B1019 65.616 -0.176 12.618 1.00 39.78 C ATOM 1404 O SER B1019 66.381 -1.135 12.502 1.00 39.65 O ATOM 1405 CB SER B1019 66.702 2.110 12.805 1.00 39.63 C ATOM 1406 OG SER B1019 66.087 2.273 14.078 1.00 40.72 O ATOM 1407 N ARG B1020 64.500 -0.229 13.345 1.00 39.89 N ATOM 1408 CA ARG B1020 64.094 -1.456 14.037 1.00 40.64 C ATOM 1409 C ARG B1020 63.849 -2.619 13.058 1.00 40.55 C ATOM 1410 O ARG B1020 64.280 -3.749 13.311 1.00 40.76 O ATOM 1411 CB ARG B1020 62.872 -1.213 14.935 1.00 40.67 C ATOM 1412 CG ARG B1020 63.200 -0.378 16.177 1.00 41.30 C ATOM 1413 CD ARG B1020 62.082 -0.401 17.237 1.00 42.25 C ATOM 1414 NE ARG B1020 60.786 0.006 16.694 1.00 47.13 N ATOM 1415 CZ ARG B1020 60.342 1.261 16.628 1.00 48.16 C ATOM 1416 NH1 ARG B1020 61.087 2.274 17.060 1.00 48.52 N ATOM 1417 NH2 ARG B1020 59.143 1.503 16.119 1.00 48.69 N ATOM 1418 N GLN B1021 63.176 -2.341 11.945 1.00 40.30 N ATOM 1419 CA GLN B1021 62.979 -3.351 10.900 1.00 40.89 C ATOM 1420 C GLN B1021 64.309 -3.812 10.290 1.00 40.22 C ATOM 1421 O GLN B1021 64.517 -5.016 10.064 1.00 39.51 O ATOM 1422 CB GLN B1021 62.051 -2.834 9.799 1.00 40.94 C ATOM 1423 CG GLN B1021 60.588 -3.197 10.017 1.00 45.79 C ATOM 1424 CD GLN B1021 60.196 -4.494 9.321 1.00 49.86 C ATOM 1425 OE1 GLN B1021 60.889 -5.516 9.423 1.00 52.57 O ATOM 1426 NE2 GLN B1021 59.080 -4.455 8.602 1.00 51.62 N ATOM 1427 N LEU B1022 65.204 -2.858 10.036 1.00 39.67 N ATOM 1428 CA LEU B1022 66.519 -3.187 9.462 1.00 39.79 C ATOM 1429 C LEU B1022 67.359 -4.054 10.403 1.00 40.26 C ATOM 1430 O LEU B1022 68.175 -4.855 9.950 1.00 40.68 O ATOM 1431 CB LEU B1022 67.286 -1.920 9.049 1.00 39.30 C ATOM 1432 CG LEU B1022 66.726 -1.118 7.867 1.00 38.68 C ATOM 1433 CD1 LEU B1022 67.688 0.012 7.480 1.00 40.32 C ATOM 1434 CD2 LEU B1022 66.498 -2.011 6.665 1.00 38.81 C ATOM 1435 N ILE B1023 67.160 -3.885 11.710 1.00 40.32 N ATOM 1436 CA ILE B1023 67.787 -4.758 12.708 1.00 40.51 C ATOM 1437 C ILE B1023 67.168 -6.162 12.630 1.00 40.68 C ATOM 1438 O ILE B1023 67.881 -7.168 12.525 1.00 40.23 O ATOM 1439 CB ILE B1023 67.662 -4.159 14.136 1.00 40.63 C ATOM 1440 CG1 ILE B1023 68.517 -2.893 14.237 1.00 40.95 C ATOM 1441 CG2 ILE B1023 68.073 -5.175 15.210 1.00 40.81 C ATOM 1442 CD1 ILE B1023 68.313 -2.098 15.507 1.00 44.82 C ATOM 1443 N THR B1024 65.838 -6.222 12.670 1.00 40.23 N ATOM 1444 CA THR B1024 65.120 -7.491 12.501 1.00 40.96 C ATOM 1445 C THR B1024 65.589 -8.250 11.257 1.00 40.97 C ATOM 1446 O THR B1024 65.860 -9.444 11.332 1.00 41.34 O ATOM 1447 CB THR B1024 63.604 -7.260 12.457 1.00 40.21 C ATOM 1448 OG1 THR B1024 63.228 -6.577 13.652 1.00 41.45 O ATOM 1449 CG2 THR B1024 62.842 -8.587 12.391 1.00 41.89 C ATOM 1450 N GLU B1025 65.706 -7.545 10.132 1.00 41.34 N ATOM 1451 CA GLU B1025 66.148 -8.139 8.864 1.00 41.75 C ATOM 1452 C GLU B1025 67.649 -8.420 8.762 1.00 41.18 C ATOM 1453 O GLU B1025 68.109 -8.952 7.744 1.00 41.90 O ATOM 1454 CB GLU B1025 65.738 -7.256 7.682 1.00 42.13 C ATOM 1455 CG GLU B1025 64.240 -7.088 7.513 1.00 44.46 C ATOM 1456 CD GLU B1025 63.510 -8.400 7.313 1.00 47.87 C ATOM 1457 OE1 GLU B1025 63.907 -9.193 6.423 1.00 49.10 O ATOM 1458 OE2 GLU B1025 62.522 -8.621 8.044 1.00 48.82 O ATOM 1459 N GLY B1026 68.408 -8.032 9.784 1.00 41.02 N ATOM 1460 CA GLY B1026 69.837 -8.355 9.872 1.00 39.54 C ATOM 1461 C GLY B1026 70.795 -7.473 9.085 1.00 39.11 C ATOM 1462 O GLY B1026 71.916 -7.906 8.775 1.00 39.19 O ATOM 1463 N PHE B1027 70.380 -6.241 8.783 1.00 38.06 N ATOM 1464 CA PHE B1027 71.260 -5.254 8.131 1.00 37.64 C ATOM 1465 C PHE B1027 72.035 -4.408 9.136 1.00 37.67 C ATOM 1466 O PHE B1027 73.105 -3.870 8.825 1.00 36.85 O ATOM 1467 CB PHE B1027 70.444 -4.336 7.227 1.00 37.22 C ATOM 1468 CG PHE B1027 69.901 -5.034 6.003 1.00 38.54 C ATOM 1469 CD1 PHE B1027 70.651 -5.083 4.836 1.00 38.11 C ATOM 1470 CD2 PHE B1027 68.651 -5.652 6.031 1.00 38.76 C ATOM 1471 CE1 PHE B1027 70.160 -5.728 3.692 1.00 39.24 C ATOM 1472 CE2 PHE B1027 68.152 -6.304 4.902 1.00 39.09 C ATOM 1473 CZ PHE B1027 68.911 -6.344 3.732 1.00 38.97 C ATOM 1474 N LEU B1028 71.450 -4.268 10.318 1.00 37.77 N ATOM 1475 CA LEU B1028 72.037 -3.507 11.420 1.00 37.76 C ATOM 1476 C LEU B1028 71.980 -4.359 12.678 1.00 37.91 C ATOM 1477 O LEU B1028 71.162 -5.277 12.773 1.00 36.57 O ATOM 1478 CB LEU B1028 71.238 -2.217 11.649 1.00 38.25 C ATOM 1479 CG LEU B1028 71.281 -1.126 10.564 1.00 38.34 C ATOM 1480 CD1 LEU B1028 70.256 -0.039 10.896 1.00 37.40 C ATOM 1481 CD2 LEU B1028 72.685 -0.527 10.377 1.00 39.51 C ATOM 1482 N VAL B1029 72.848 -4.064 13.647 1.00 38.65 N ATOM 1483 CA VAL B1029 72.763 -4.686 14.984 1.00 39.66 C ATOM 1484 C VAL B1029 73.120 -3.649 16.009 1.00 39.98 C ATOM 1485 O VAL B1029 73.943 -2.781 15.750 1.00 40.68 O ATOM 1486 CB VAL B1029 73.859 -5.754 15.337 1.00 40.63 C ATOM 1487 CG1 VAL B1029 73.296 -7.094 15.738 1.00 40.59 C ATOM 1488 CG2 VAL B1029 75.087 -5.741 14.453 1.00 40.11 C ATOM 1489 N GLU B1030 72.573 -3.820 17.204 1.00 40.48 N ATOM 1490 CA GLU B1030 72.946 -2.988 18.339 1.00 41.21 C ATOM 1491 C GLU B1030 73.835 -3.806 19.255 1.00 41.07 C ATOM 1492 O GLU B1030 73.556 -4.993 19.499 1.00 41.58 O ATOM 1493 CB GLU B1030 71.683 -2.512 19.065 1.00 41.31 C ATOM 1494 CG GLU B1030 70.909 -1.522 18.193 1.00 44.56 C ATOM 1495 CD GLU B1030 69.786 -0.819 18.919 1.00 50.32 C ATOM 1496 OE1 GLU B1030 69.120 -1.470 19.757 1.00 51.50 O ATOM 1497 OE2 GLU B1030 69.558 0.379 18.613 1.00 52.39 O ATOM 1498 N VAL B1031 74.910 -3.196 19.750 1.00 40.61 N ATOM 1499 CA VAL B1031 75.791 -3.900 20.691 1.00 40.16 C ATOM 1500 C VAL B1031 76.342 -3.008 21.798 1.00 39.11 C ATOM 1501 O VAL B1031 76.606 -1.823 21.591 1.00 38.74 O ATOM 1502 CB VAL B1031 76.949 -4.670 19.997 1.00 40.69 C ATOM 1503 CG1 VAL B1031 76.388 -5.702 19.016 1.00 43.60 C ATOM 1504 CG2 VAL B1031 77.891 -3.731 19.269 1.00 40.61 C ATOM 1505 N SER B1032 76.500 -3.597 22.981 1.00 37.96 N ATOM 1506 CA SER B1032 77.150 -2.917 24.094 1.00 36.72 C ATOM 1507 C SER B1032 78.550 -2.466 23.680 1.00 36.24 C ATOM 1508 O SER B1032 79.271 -3.194 22.985 1.00 36.62 O ATOM 1509 CB SER B1032 77.240 -3.860 25.289 1.00 36.27 C ATOM 1510 OG SER B1032 77.720 -3.198 26.434 1.00 38.00 O ATOM 1511 N ARG B1033 78.925 -1.272 24.107 1.00 36.46 N ATOM 1512 CA ARG B1033 80.263 -0.741 23.870 1.00 37.16 C ATOM 1513 C ARG B1033 80.626 0.249 24.974 1.00 36.26 C ATOM 1514 O ARG B1033 79.748 0.823 25.607 1.00 37.00 O ATOM 1515 CB ARG B1033 80.355 -0.084 22.472 1.00 36.79 C ATOM 1516 CG ARG B1033 81.807 0.136 22.021 1.00 39.47 C ATOM 1517 CD ARG B1033 81.949 0.262 20.512 1.00 41.84 C ATOM 1518 NE ARG B1033 83.363 0.390 20.137 1.00 45.38 N ATOM 1519 CZ ARG B1033 84.219 -0.622 19.940 1.00 50.51 C ATOM 1520 NH1 ARG B1033 83.839 -1.898 20.062 1.00 50.90 N ATOM 1521 NH2 ARG B1033 85.477 -0.358 19.598 0.50 49.37 N ATOM 1522 N TYR B1034 81.931 0.412 25.189 1.00 36.83 N ATOM 1523 CA TYR B1034 82.540 1.400 26.087 1.00 36.17 C ATOM 1524 C TYR B1034 82.372 1.110 27.560 1.00 36.63 C ATOM 1525 O TYR B1034 83.352 0.997 28.298 1.00 36.80 O ATOM 1526 CB TYR B1034 82.032 2.833 25.808 1.00 37.05 C ATOM 1527 CG TYR B1034 82.086 3.212 24.357 1.00 36.76 C ATOM 1528 CD1 TYR B1034 83.298 3.291 23.688 1.00 36.87 C ATOM 1529 CD2 TYR B1034 80.914 3.486 23.651 1.00 38.38 C ATOM 1530 CE1 TYR B1034 83.349 3.633 22.334 1.00 39.52 C ATOM 1531 CE2 TYR B1034 80.948 3.812 22.292 1.00 38.38 C ATOM 1532 CZ TYR B1034 82.169 3.876 21.643 1.00 39.58 C ATOM 1533 OH TYR B1034 82.207 4.235 20.313 1.00 40.00 O ATOM 1534 N ASN B1035 81.123 1.070 28.012 1.00 36.19 N ATOM 1535 CA ASN B1035 80.863 0.927 29.440 1.00 35.69 C ATOM 1536 C ASN B1035 79.470 0.363 29.687 1.00 35.21 C ATOM 1537 O ASN B1035 78.767 0.004 28.731 1.00 34.77 O ATOM 1538 CB ASN B1035 81.142 2.233 30.205 1.00 35.31 C ATOM 1539 CG ASN B1035 80.208 3.386 29.804 1.00 37.09 C ATOM 1540 OD1 ASN B1035 78.983 3.259 29.842 1.00 34.67 O ATOM 1541 ND2 ASN B1035 80.796 4.522 29.468 1.00 32.79 N ATOM 1542 N LYS B1036 79.103 0.237 30.955 1.00 34.38 N ATOM 1543 CA LYS B1036 77.837 -0.407 31.316 1.00 35.27 C ATOM 1544 C LYS B1036 76.610 0.354 30.794 1.00 35.89 C ATOM 1545 O LYS B1036 75.512 -0.212 30.750 1.00 36.71 O ATOM 1546 CB LYS B1036 77.749 -0.571 32.839 1.00 34.19 C ATOM 1547 CG LYS B1036 78.694 -1.692 33.363 1.00 34.15 C ATOM 1548 CD LYS B1036 78.807 -1.692 34.898 1.00 35.98 C ATOM 1549 CE LYS B1036 77.433 -1.837 35.560 1.00 38.99 C ATOM 1550 NZ LYS B1036 77.442 -1.684 37.012 1.00 41.69 N ATOM 1551 N PHE B1037 76.779 1.625 30.412 1.00 34.51 N ATOM 1552 CA PHE B1037 75.633 2.406 29.933 1.00 35.20 C ATOM 1553 C PHE B1037 75.376 2.332 28.426 1.00 36.61 C ATOM 1554 O PHE B1037 74.211 2.376 27.996 1.00 38.29 O ATOM 1555 CB PHE B1037 75.752 3.892 30.338 1.00 34.44 C ATOM 1556 CG PHE B1037 75.620 4.136 31.785 1.00 33.29 C ATOM 1557 CD1 PHE B1037 74.363 4.163 32.406 1.00 32.65 C ATOM 1558 CD2 PHE B1037 76.750 4.377 32.552 1.00 33.27 C ATOM 1559 CE1 PHE B1037 74.247 4.420 33.773 1.00 34.12 C ATOM 1560 CE2 PHE B1037 76.652 4.627 33.898 1.00 31.05 C ATOM 1561 CZ PHE B1037 75.388 4.663 34.526 1.00 35.11 C ATOM 1562 N MET B1038 76.434 2.218 27.634 1.00 36.19 N ATOM 1563 CA MET B1038 76.357 2.565 26.217 1.00 36.63 C ATOM 1564 C MET B1038 76.099 1.405 25.278 1.00 37.15 C ATOM 1565 O MET B1038 76.485 0.282 25.548 1.00 37.06 O ATOM 1566 CB MET B1038 77.655 3.238 25.767 1.00 36.02 C ATOM 1567 CG MET B1038 78.089 4.422 26.608 1.00 34.63 C ATOM 1568 SD MET B1038 76.796 5.664 26.737 1.00 35.21 S ATOM 1569 CE MET B1038 77.470 6.840 27.905 1.00 34.49 C ATOM 1570 N LYS B1039 75.448 1.699 24.159 1.00 37.59 N ATOM 1571 CA LYS B1039 75.370 0.740 23.074 1.00 39.05 C ATOM 1572 C LYS B1039 75.559 1.520 21.775 1.00 39.62 C ATOM 1573 O LYS B1039 75.357 2.740 21.743 1.00 39.90 O ATOM 1574 CB LYS B1039 74.048 -0.023 23.096 1.00 39.51 C ATOM 1575 CG LYS B1039 72.836 0.836 22.898 1.00 40.72 C ATOM 1576 CD LYS B1039 71.590 0.007 22.618 1.00 43.43 C ATOM 1577 CE LYS B1039 70.360 0.897 22.587 1.00 44.24 C ATOM 1578 NZ LYS B1039 69.119 0.133 22.251 1.00 44.61 N ATOM 1579 N ILE B1040 75.966 0.827 20.718 1.00 39.32 N ATOM 1580 CA ILE B1040 76.106 1.470 19.419 1.00 39.55 C ATOM 1581 C ILE B1040 75.273 0.687 18.417 1.00 39.96 C ATOM 1582 O ILE B1040 74.839 -0.431 18.707 1.00 40.26 O ATOM 1583 CB ILE B1040 77.594 1.607 18.981 1.00 39.33 C ATOM 1584 CG1 ILE B1040 78.305 0.249 18.888 1.00 40.78 C ATOM 1585 CG2 ILE B1040 78.365 2.503 19.968 1.00 39.31 C ATOM 1586 CD1 ILE B1040 78.137 -0.450 17.553 1.00 42.84 C ATOM 1587 N CYS B1041 75.042 1.277 17.254 1.00 40.17 N ATOM 1588 CA CYS B1041 74.379 0.565 16.170 1.00 39.78 C ATOM 1589 C CYS B1041 75.385 0.459 15.029 1.00 39.86 C ATOM 1590 O CYS B1041 76.007 1.461 14.637 1.00 39.47 O ATOM 1591 CB CYS B1041 73.120 1.319 15.745 1.00 39.89 C ATOM 1592 SG CYS B1041 72.126 0.440 14.501 1.00 43.64 S ATOM 1593 N ALA B1042 75.561 -0.764 14.527 1.00 39.58 N ATOM 1594 CA ALA B1042 76.560 -1.079 13.522 1.00 39.32 C ATOM 1595 C ALA B1042 75.961 -1.798 12.311 1.00 38.92 C ATOM 1596 O ALA B1042 74.926 -2.473 12.405 1.00 38.02 O ATOM 1597 CB ALA B1042 77.647 -1.957 14.138 1.00 38.83 C ATOM 1598 N LEU B1043 76.634 -1.666 11.173 1.00 38.81 N ATOM 1599 CA LEU B1043 76.319 -2.501 10.022 1.00 38.79 C ATOM 1600 C LEU B1043 76.744 -3.929 10.318 1.00 38.59 C ATOM 1601 O LEU B1043 77.813 -4.147 10.882 1.00 38.40 O ATOM 1602 CB LEU B1043 77.051 -1.991 8.775 1.00 39.76 C ATOM 1603 CG LEU B1043 76.673 -0.584 8.312 1.00 41.26 C ATOM 1604 CD1 LEU B1043 77.741 -0.118 7.332 1.00 45.69 C ATOM 1605 CD2 LEU B1043 75.311 -0.592 7.661 1.00 42.73 C ATOM 1606 N THR B1044 75.899 -4.903 9.963 1.00 37.72 N ATOM 1607 CA THR B1044 76.316 -6.309 9.973 1.00 36.92 C ATOM 1608 C THR B1044 77.105 -6.563 8.697 1.00 37.17 C ATOM 1609 O THR B1044 77.146 -5.703 7.820 1.00 37.04 O ATOM 1610 CB THR B1044 75.108 -7.234 9.945 1.00 35.95 C ATOM 1611 OG1 THR B1044 74.363 -6.942 8.767 1.00 37.08 O ATOM 1612 CG2 THR B1044 74.208 -6.985 11.159 1.00 36.19 C ATOM 1613 N LYS B1045 77.687 -7.754 8.550 1.00 38.04 N ATOM 1614 CA LYS B1045 78.320 -8.099 7.270 1.00 38.19 C ATOM 1615 C LYS B1045 77.338 -7.996 6.117 1.00 38.19 C ATOM 1616 O LYS B1045 77.687 -7.526 5.026 1.00 37.06 O ATOM 1617 CB LYS B1045 78.894 -9.510 7.288 1.00 39.53 C ATOM 1618 CG LYS B1045 80.118 -9.685 8.145 1.00 43.12 C ATOM 1619 CD LYS B1045 81.040 -10.713 7.486 1.00 50.05 C ATOM 1620 CE LYS B1045 82.295 -10.828 8.311 1.00 52.72 C ATOM 1621 NZ LYS B1045 83.478 -10.603 7.467 1.00 54.04 N ATOM 1622 N LYS B1046 76.114 -8.475 6.348 1.00 37.36 N ATOM 1623 CA LYS B1046 75.053 -8.342 5.353 1.00 37.86 C ATOM 1624 C LYS B1046 74.811 -6.883 4.978 1.00 37.03 C ATOM 1625 O LYS B1046 74.649 -6.559 3.795 1.00 36.17 O ATOM 1626 CB LYS B1046 73.756 -8.969 5.883 1.00 37.90 C ATOM 1627 CG LYS B1046 72.566 -8.867 4.948 1.00 40.64 C ATOM 1628 CD LYS B1046 71.409 -9.684 5.539 1.00 39.38 C ATOM 1629 CE LYS B1046 70.117 -9.457 4.800 1.00 43.40 C ATOM 1630 NZ LYS B1046 69.017 -10.245 5.459 1.00 41.62 N ATOM 1631 N GLY B1047 74.772 -6.001 5.985 1.00 36.62 N ATOM 1632 CA GLY B1047 74.566 -4.581 5.722 1.00 36.96 C ATOM 1633 C GLY B1047 75.740 -3.989 4.925 1.00 37.76 C ATOM 1634 O GLY B1047 75.539 -3.186 4.015 1.00 37.46 O ATOM 1635 N ARG B1048 76.962 -4.394 5.265 1.00 37.08 N ATOM 1636 CA ARG B1048 78.149 -3.896 4.530 1.00 37.12 C ATOM 1637 C ARG B1048 78.166 -4.371 3.095 1.00 36.61 C ATOM 1638 O ARG B1048 78.572 -3.616 2.204 1.00 36.65 O ATOM 1639 CB ARG B1048 79.445 -4.314 5.212 1.00 36.82 C ATOM 1640 CG ARG B1048 79.628 -3.645 6.563 1.00 36.56 C ATOM 1641 CD ARG B1048 80.939 -4.084 7.235 1.00 40.64 C ATOM 1642 NE ARG B1048 80.764 -3.901 8.671 1.00 43.04 N ATOM 1643 CZ ARG B1048 80.904 -2.744 9.298 1.00 44.34 C ATOM 1644 NH1 ARG B1048 81.295 -1.680 8.599 1.00 43.88 N ATOM 1645 NH2 ARG B1048 80.646 -2.659 10.617 1.00 40.94 N ATOM 1646 N ASN B1049 77.721 -5.614 2.871 1.00 36.47 N ATOM 1647 CA ASN B1049 77.646 -6.161 1.503 1.00 36.70 C ATOM 1648 C ASN B1049 76.649 -5.393 0.658 1.00 36.63 C ATOM 1649 O ASN B1049 76.918 -5.057 -0.511 1.00 35.52 O ATOM 1650 CB ASN B1049 77.258 -7.653 1.504 1.00 36.52 C ATOM 1651 CG ASN B1049 78.376 -8.562 1.976 1.00 39.22 C ATOM 1652 OD1 ASN B1049 79.542 -8.167 2.017 1.00 40.36 O ATOM 1653 ND2 ASN B1049 78.016 -9.792 2.368 1.00 37.48 N ATOM 1654 N TRP B1050 75.490 -5.105 1.250 1.00 36.14 N ATOM 1655 CA TRP B1050 74.432 -4.380 0.550 1.00 36.54 C ATOM 1656 C TRP B1050 74.932 -2.977 0.214 1.00 36.73 C ATOM 1657 O TRP B1050 74.794 -2.505 -0.918 1.00 36.87 O ATOM 1658 CB TRP B1050 73.159 -4.341 1.416 1.00 36.24 C ATOM 1659 CG TRP B1050 71.962 -3.705 0.771 1.00 36.40 C ATOM 1660 CD1 TRP B1050 70.933 -4.348 0.122 1.00 37.15 C ATOM 1661 CD2 TRP B1050 71.655 -2.310 0.724 1.00 37.60 C ATOM 1662 NE1 TRP B1050 70.018 -3.433 -0.332 1.00 36.10 N ATOM 1663 CE2 TRP B1050 70.437 -2.173 0.017 1.00 37.64 C ATOM 1664 CE3 TRP B1050 72.303 -1.152 1.191 1.00 38.29 C ATOM 1665 CZ2 TRP B1050 69.842 -0.920 -0.224 1.00 36.73 C ATOM 1666 CZ3 TRP B1050 71.714 0.087 0.947 1.00 36.87 C ATOM 1667 CH2 TRP B1050 70.492 0.192 0.248 1.00 37.22 C ATOM 1668 N LEU B1051 75.500 -2.302 1.209 1.00 36.88 N ATOM 1669 CA LEU B1051 75.995 -0.938 1.030 1.00 36.94 C ATOM 1670 C LEU B1051 77.112 -0.843 -0.006 1.00 36.10 C ATOM 1671 O LEU B1051 77.172 0.107 -0.795 1.00 35.55 O ATOM 1672 CB LEU B1051 76.498 -0.394 2.377 1.00 38.33 C ATOM 1673 CG LEU B1051 76.868 1.089 2.391 1.00 39.28 C ATOM 1674 CD1 LEU B1051 75.664 1.938 1.960 1.00 39.11 C ATOM 1675 CD2 LEU B1051 77.394 1.508 3.787 1.00 38.27 C ATOM 1676 N HIS B1052 78.015 -1.822 0.015 1.00 35.25 N ATOM 1677 CA HIS B1052 79.107 -1.873 -0.943 1.00 35.86 C ATOM 1678 C HIS B1052 78.573 -1.890 -2.355 1.00 36.10 C ATOM 1679 O HIS B1052 79.085 -1.194 -3.253 1.00 36.48 O ATOM 1680 CB HIS B1052 80.007 -3.103 -0.676 1.00 35.15 C ATOM 1681 CG HIS B1052 81.249 -3.135 -1.519 1.00 35.80 C ATOM 1682 ND1 HIS B1052 82.391 -2.430 -1.191 1.00 35.03 N ATOM 1683 CD2 HIS B1052 81.534 -3.800 -2.664 1.00 34.87 C ATOM 1684 CE1 HIS B1052 83.325 -2.657 -2.102 1.00 34.60 C ATOM 1685 NE2 HIS B1052 82.830 -3.479 -3.011 1.00 36.49 N ATOM 1686 N LYS B1053 77.520 -2.681 -2.563 1.00 36.25 N ATOM 1687 CA LYS B1053 76.888 -2.752 -3.873 1.00 36.04 C ATOM 1688 C LYS B1053 76.108 -1.489 -4.189 1.00 36.29 C ATOM 1689 O LYS B1053 76.187 -0.970 -5.310 1.00 35.76 O ATOM 1690 CB LYS B1053 75.972 -3.970 -3.946 1.00 36.44 C ATOM 1691 CG LYS B1053 76.760 -5.282 -4.041 1.00 36.74 C ATOM 1692 CD LYS B1053 75.850 -6.489 -4.365 1.00 36.34 C ATOM 1693 CE LYS B1053 74.982 -6.852 -3.152 1.00 38.39 C ATOM 1694 NZ LYS B1053 74.148 -8.078 -3.438 1.00 38.80 N ATOM 1695 N ALA B1054 75.349 -1.009 -3.196 1.00 36.51 N ATOM 1696 CA ALA B1054 74.560 0.206 -3.337 1.00 37.51 C ATOM 1697 C ALA B1054 75.396 1.427 -3.698 1.00 37.79 C ATOM 1698 O ALA B1054 74.884 2.367 -4.330 1.00 38.32 O ATOM 1699 CB ALA B1054 73.758 0.473 -2.066 1.00 37.82 C ATOM 1700 N ASN B1055 76.655 1.431 -3.269 1.00 37.78 N ATOM 1701 CA ASN B1055 77.583 2.515 -3.602 1.00 38.80 C ATOM 1702 C ASN B1055 77.944 2.599 -5.093 1.00 39.02 C ATOM 1703 O ASN B1055 78.492 3.620 -5.541 1.00 39.69 O ATOM 1704 CB ASN B1055 78.827 2.485 -2.690 1.00 38.91 C ATOM 1705 CG ASN B1055 78.574 3.160 -1.339 1.00 40.92 C ATOM 1706 OD1 ASN B1055 77.788 4.103 -1.250 1.00 42.38 O ATOM 1707 ND2 ASN B1055 79.254 2.689 -0.294 1.00 40.43 N ATOM 1708 N THR B1056 77.612 1.563 -5.886 1.00 38.29 N ATOM 1709 CA THR B1056 77.853 1.643 -7.340 1.00 37.91 C ATOM 1710 C THR B1056 76.589 1.596 -8.202 1.00 38.18 C ATOM 1711 O THR B1056 76.586 2.092 -9.324 1.00 37.64 O ATOM 1712 CB THR B1056 78.906 0.610 -7.866 1.00 39.03 C ATOM 1713 OG1 THR B1056 78.370 -0.726 -7.823 1.00 39.02 O ATOM 1714 CG2 THR B1056 80.205 0.676 -7.059 1.00 37.26 C ATOM 1715 N GLU B1057 75.528 0.976 -7.694 1.00 38.17 N ATOM 1716 CA GLU B1057 74.216 1.036 -8.361 1.00 39.55 C ATOM 1717 C GLU B1057 73.116 0.738 -7.350 1.00 39.49 C ATOM 1718 O GLU B1057 73.328 -0.003 -6.399 1.00 39.12 O ATOM 1719 CB GLU B1057 74.132 0.086 -9.568 1.00 39.36 C ATOM 1720 CG GLU B1057 74.163 -1.397 -9.231 1.00 40.33 C ATOM 1721 CD GLU B1057 73.908 -2.307 -10.445 1.00 40.73 C ATOM 1722 OE1 GLU B1057 73.816 -3.531 -10.244 1.00 42.98 O ATOM 1723 OE2 GLU B1057 73.808 -1.822 -11.595 1.00 43.21 O ATOM 1724 N SER B1058 71.955 1.339 -7.568 1.00 39.95 N ATOM 1725 CA SER B1058 70.789 1.188 -6.696 1.00 40.53 C ATOM 1726 C SER B1058 70.467 -0.270 -6.386 1.00 40.05 C ATOM 1727 O SER B1058 70.500 -1.130 -7.267 1.00 38.71 O ATOM 1728 CB SER B1058 69.573 1.841 -7.357 1.00 41.56 C ATOM 1729 OG SER B1058 69.785 3.231 -7.460 1.00 44.96 O ATOM 1730 N GLN B1059 70.174 -0.526 -5.117 1.00 39.78 N ATOM 1731 CA GLN B1059 69.793 -1.842 -4.650 1.00 40.19 C ATOM 1732 C GLN B1059 68.391 -1.757 -4.090 1.00 40.95 C ATOM 1733 O GLN B1059 68.006 -0.735 -3.505 1.00 40.38 O ATOM 1734 CB GLN B1059 70.731 -2.311 -3.535 1.00 40.11 C ATOM 1735 CG GLN B1059 72.195 -2.338 -3.903 1.00 38.91 C ATOM 1736 CD GLN B1059 72.509 -3.404 -4.932 1.00 38.97 C ATOM 1737 OE1 GLN B1059 72.206 -4.574 -4.734 1.00 39.99 O ATOM 1738 NE2 GLN B1059 73.134 -3.005 -6.028 1.00 37.61 N ATOM 1739 N SER B1060 67.628 -2.831 -4.259 1.00 41.24 N ATOM 1740 CA SER B1060 66.352 -2.926 -3.570 1.00 41.57 C ATOM 1741 C SER B1060 66.570 -3.419 -2.142 1.00 41.70 C ATOM 1742 O SER B1060 67.580 -4.078 -1.834 1.00 40.71 O ATOM 1743 CB SER B1060 65.393 -3.851 -4.334 1.00 42.34 C ATOM 1744 OG SER B1060 65.913 -5.165 -4.345 1.00 42.68 O ATOM 1745 N LEU B1061 65.649 -3.051 -1.262 1.00 42.09 N ATOM 1746 CA LEU B1061 65.562 -3.647 0.058 1.00 43.08 C ATOM 1747 C LEU B1061 64.078 -3.721 0.408 1.00 44.43 C ATOM 1748 O LEU B1061 63.485 -2.758 0.898 1.00 44.11 O ATOM 1749 CB LEU B1061 66.379 -2.856 1.093 1.00 42.88 C ATOM 1750 CG LEU B1061 66.806 -3.649 2.324 1.00 42.19 C ATOM 1751 CD1 LEU B1061 67.919 -2.933 3.083 1.00 41.63 C ATOM 1752 CD2 LEU B1061 65.619 -3.923 3.236 1.00 41.50 C ATOM 1753 N ILE B1062 63.483 -4.876 0.120 1.00 45.98 N ATOM 1754 CA ILE B1062 62.036 -5.060 0.232 1.00 47.51 C ATOM 1755 C ILE B1062 61.631 -5.489 1.650 1.00 48.96 C ATOM 1756 O ILE B1062 62.274 -6.348 2.263 1.00 49.23 O ATOM 1757 CB ILE B1062 61.537 -6.024 -0.871 1.00 47.75 C ATOM 1758 CG1 ILE B1062 61.707 -5.348 -2.241 1.00 47.58 C ATOM 1759 CG2 ILE B1062 60.084 -6.433 -0.643 1.00 47.35 C ATOM 1760 CD1 ILE B1062 61.914 -6.297 -3.405 1.00 50.62 C ATOM 1761 N LEU B1063 60.593 -4.850 2.187 1.00 50.38 N ATOM 1762 CA LEU B1063 60.135 -5.145 3.549 1.00 51.71 C ATOM 1763 C LEU B1063 58.671 -5.584 3.581 1.00 52.43 C ATOM 1764 O LEU B1063 57.850 -5.082 2.807 1.00 52.34 O ATOM 1765 CB LEU B1063 60.384 -3.957 4.490 1.00 51.89 C ATOM 1766 CG LEU B1063 61.849 -3.567 4.755 1.00 52.69 C ATOM 1767 CD1 LEU B1063 61.962 -2.320 5.623 1.00 53.93 C ATOM 1768 CD2 LEU B1063 62.649 -4.705 5.378 1.00 53.33 C ATOM 1769 N GLN B1064 58.380 -6.521 4.491 1.00 53.47 N ATOM 1770 CA GLN B1064 57.093 -7.244 4.607 1.00 54.27 C ATOM 1771 C GLN B1064 56.346 -7.486 3.287 1.00 54.43 C ATOM 1772 O GLN B1064 55.366 -8.237 3.236 1.00 54.74 O ATOM 1773 CB GLN B1064 56.177 -6.596 5.658 1.00 54.55 C ATOM 1774 CG GLN B1064 55.188 -5.550 5.126 1.00 56.21 C ATOM 1775 CD GLN B1064 55.815 -4.180 4.921 1.00 57.42 C ATOM 1776 OE1 GLN B1064 56.641 -3.729 5.721 1.00 56.83 O ATOM 1777 NE2 GLN B1064 55.410 -3.504 3.846 1.00 57.78 N TER 1778 GLN B1064 ATOM 1779 O5' DA C 1 52.000 36.170 24.727 1.00 39.00 O ATOM 1780 C5' DA C 1 50.644 35.782 24.825 1.00 36.00 C ATOM 1781 C4' DA C 1 50.326 35.493 26.290 1.00 32.16 C ATOM 1782 O4' DA C 1 50.337 36.705 27.077 1.00 34.13 O ATOM 1783 C3' DA C 1 48.950 34.912 26.549 1.00 32.03 C ATOM 1784 O3' DA C 1 48.992 34.184 27.775 1.00 31.98 O ATOM 1785 C2' DA C 1 48.072 36.172 26.628 1.00 31.48 C ATOM 1786 C1' DA C 1 49.007 37.126 27.380 1.00 31.73 C ATOM 1787 N9 DA C 1 48.965 38.534 27.018 1.00 32.28 N ATOM 1788 C8 DA C 1 49.126 39.558 27.913 1.00 32.15 C ATOM 1789 N7 DA C 1 49.073 40.740 27.364 1.00 31.90 N ATOM 1790 C5 DA C 1 48.890 40.489 26.027 1.00 31.34 C ATOM 1791 C6 DA C 1 48.757 41.332 24.907 1.00 31.62 C ATOM 1792 N6 DA C 1 48.804 42.663 24.987 1.00 31.85 N ATOM 1793 N1 DA C 1 48.591 40.762 23.695 1.00 32.19 N ATOM 1794 C2 DA C 1 48.544 39.428 23.590 1.00 31.68 C ATOM 1795 N3 DA C 1 48.643 38.548 24.576 1.00 30.18 N ATOM 1796 C4 DA C 1 48.828 39.131 25.779 1.00 31.87 C ATOM 1797 P DC C 2 49.322 32.624 27.834 1.00 31.60 P ATOM 1798 OP1 DC C 2 49.110 32.180 29.216 1.00 28.64 O ATOM 1799 OP2 DC C 2 50.603 32.320 27.156 1.00 34.27 O ATOM 1800 O5' DC C 2 48.210 31.975 26.891 1.00 29.69 O ATOM 1801 C5' DC C 2 46.840 31.988 27.269 1.00 29.55 C ATOM 1802 C4' DC C 2 45.972 31.229 26.284 1.00 29.36 C ATOM 1803 O4' DC C 2 45.972 31.910 25.018 1.00 31.17 O ATOM 1804 C3' DC C 2 46.454 29.824 25.970 1.00 31.41 C ATOM 1805 O3' DC C 2 45.859 28.962 26.908 1.00 32.84 O ATOM 1806 C2' DC C 2 45.916 29.575 24.572 1.00 31.44 C ATOM 1807 C1' DC C 2 45.995 30.967 23.967 1.00 31.61 C ATOM 1808 N1 DC C 2 47.186 31.281 23.101 1.00 32.90 N ATOM 1809 C2 DC C 2 47.213 30.826 21.773 1.00 32.92 C ATOM 1810 O2 DC C 2 46.279 30.150 21.346 1.00 33.53 O ATOM 1811 N3 DC C 2 48.268 31.138 20.975 1.00 33.20 N ATOM 1812 C4 DC C 2 49.272 31.872 21.488 1.00 33.57 C ATOM 1813 N4 DC C 2 50.278 32.175 20.663 1.00 34.04 N ATOM 1814 C5 DC C 2 49.283 32.332 22.842 1.00 34.71 C ATOM 1815 C6 DC C 2 48.228 32.023 23.618 1.00 33.68 C ATOM 1816 P DC C 3 46.564 27.629 27.381 1.00 34.64 P ATOM 1817 OP1 DC C 3 45.720 27.118 28.484 1.00 35.90 O ATOM 1818 OP2 DC C 3 47.989 27.915 27.641 1.00 32.87 O ATOM 1819 O5' DC C 3 46.500 26.678 26.099 1.00 35.76 O ATOM 1820 C5' DC C 3 45.247 26.339 25.487 1.00 36.00 C ATOM 1821 C4' DC C 3 45.508 25.593 24.194 1.00 37.41 C ATOM 1822 O4' DC C 3 46.098 26.492 23.221 1.00 36.87 O ATOM 1823 C3' DC C 3 46.467 24.418 24.372 1.00 39.54 C ATOM 1824 O3' DC C 3 45.883 23.229 23.908 1.00 41.84 O ATOM 1825 C2' DC C 3 47.712 24.781 23.570 1.00 38.44 C ATOM 1826 C1' DC C 3 47.281 25.939 22.674 1.00 37.35 C ATOM 1827 N1 DC C 3 48.384 26.969 22.597 1.00 37.25 N ATOM 1828 C2 DC C 3 48.984 27.250 21.356 1.00 36.95 C ATOM 1829 O2 DC C 3 48.600 26.681 20.340 1.00 35.81 O ATOM 1830 N3 DC C 3 49.982 28.157 21.297 1.00 36.36 N ATOM 1831 C4 DC C 3 50.385 28.777 22.402 1.00 36.53 C ATOM 1832 N4 DC C 3 51.372 29.661 22.268 1.00 36.58 N ATOM 1833 C5 DC C 3 49.811 28.511 23.689 1.00 36.46 C ATOM 1834 C6 DC C 3 48.826 27.600 23.730 1.00 36.72 C ATOM 1835 P DC C 4 46.550 21.818 24.286 1.00 45.61 P ATOM 1836 OP1 DC C 4 45.421 20.859 24.312 1.00 46.01 O ATOM 1837 OP2 DC C 4 47.447 22.010 25.451 1.00 44.18 O ATOM 1838 O5' DC C 4 47.457 21.494 23.008 1.00 44.01 O ATOM 1839 C5' DC C 4 46.874 21.589 21.713 1.00 45.37 C ATOM 1840 C4' DC C 4 47.934 21.486 20.634 1.00 46.17 C ATOM 1841 O4' DC C 4 48.588 22.769 20.463 1.00 45.08 O ATOM 1842 C3' DC C 4 49.016 20.450 20.908 1.00 47.97 C ATOM 1843 O3' DC C 4 48.924 19.466 19.907 1.00 51.69 O ATOM 1844 C2' DC C 4 50.342 21.194 20.808 1.00 46.49 C ATOM 1845 C1' DC C 4 49.973 22.570 20.261 1.00 43.85 C ATOM 1846 N1 DC C 4 50.759 23.663 20.922 1.00 42.42 N ATOM 1847 C2 DC C 4 51.593 24.483 20.146 1.00 41.74 C ATOM 1848 O2 DC C 4 51.668 24.300 18.925 1.00 40.93 O ATOM 1849 N3 DC C 4 52.302 25.463 20.765 1.00 41.01 N ATOM 1850 C4 DC C 4 52.217 25.627 22.088 1.00 41.58 C ATOM 1851 N4 DC C 4 52.941 26.606 22.637 1.00 41.31 N ATOM 1852 C5 DC C 4 51.380 24.804 22.903 1.00 41.31 C ATOM 1853 C6 DC C 4 50.679 23.846 22.279 1.00 41.80 C ATOM 1854 P DT C 5 49.691 18.066 19.986 1.00 54.05 P ATOM 1855 OP1 DT C 5 48.840 17.106 19.244 1.00 53.78 O ATOM 1856 OP2 DT C 5 50.137 17.788 21.373 1.00 53.91 O ATOM 1857 O5' DT C 5 51.009 18.347 19.133 1.00 54.00 O ATOM 1858 C5' DT C 5 50.930 18.937 17.828 1.00 52.67 C ATOM 1859 C4' DT C 5 52.329 19.354 17.414 1.00 52.07 C ATOM 1860 O4' DT C 5 52.684 20.574 18.112 1.00 51.53 O ATOM 1861 C3' DT C 5 53.414 18.340 17.772 1.00 51.62 C ATOM 1862 O3' DT C 5 54.273 18.140 16.675 1.00 52.87 O ATOM 1863 C2' DT C 5 54.187 18.995 18.906 1.00 51.71 C ATOM 1864 C1' DT C 5 54.030 20.453 18.497 1.00 49.39 C ATOM 1865 N1 DT C 5 54.344 21.426 19.569 1.00 48.82 N ATOM 1866 C2 DT C 5 55.116 22.521 19.238 1.00 48.25 C ATOM 1867 O2 DT C 5 55.540 22.738 18.108 1.00 47.80 O ATOM 1868 N3 DT C 5 55.364 23.358 20.293 1.00 47.01 N ATOM 1869 C4 DT C 5 54.930 23.224 21.602 1.00 47.73 C ATOM 1870 O4 DT C 5 55.219 24.051 22.462 1.00 47.01 O ATOM 1871 C5 DT C 5 54.131 22.049 21.874 1.00 47.70 C ATOM 1872 C7 DT C 5 53.596 21.772 23.250 1.00 48.08 C ATOM 1873 C6 DT C 5 53.882 21.219 20.858 1.00 48.12 C ATOM 1874 P DA C 6 55.058 16.756 16.486 1.00 51.56 P ATOM 1875 OP1 DA C 6 54.184 15.964 15.591 1.00 52.22 O ATOM 1876 OP2 DA C 6 55.519 16.198 17.783 1.00 51.95 O ATOM 1877 O5' DA C 6 56.391 17.201 15.719 1.00 50.56 O ATOM 1878 C5' DA C 6 56.481 18.430 15.001 1.00 46.28 C ATOM 1879 C4' DA C 6 57.844 19.082 15.186 1.00 43.14 C ATOM 1880 O4' DA C 6 57.842 19.929 16.358 1.00 42.28 O ATOM 1881 C3' DA C 6 59.049 18.159 15.346 1.00 42.03 C ATOM 1882 O3' DA C 6 60.062 18.677 14.491 1.00 39.94 O ATOM 1883 C2' DA C 6 59.383 18.246 16.844 1.00 41.01 C ATOM 1884 C1' DA C 6 58.969 19.681 17.165 1.00 40.64 C ATOM 1885 N9 DA C 6 58.529 19.966 18.535 1.00 40.53 N ATOM 1886 C8 DA C 6 57.695 19.201 19.302 1.00 40.23 C ATOM 1887 N7 DA C 6 57.455 19.700 20.490 1.00 39.78 N ATOM 1888 C5 DA C 6 58.173 20.883 20.503 1.00 39.64 C ATOM 1889 C6 DA C 6 58.330 21.885 21.484 1.00 39.84 C ATOM 1890 N6 DA C 6 57.741 21.838 22.682 1.00 39.46 N ATOM 1891 N1 DA C 6 59.123 22.940 21.183 1.00 40.25 N ATOM 1892 C2 DA C 6 59.714 22.982 19.982 1.00 39.20 C ATOM 1893 N3 DA C 6 59.628 22.105 18.981 1.00 38.64 N ATOM 1894 C4 DA C 6 58.837 21.068 19.304 1.00 39.16 C ATOM 1895 P DA C 7 61.515 18.015 14.369 1.00 40.12 P ATOM 1896 OP1 DA C 7 62.004 18.315 13.002 1.00 40.79 O ATOM 1897 OP2 DA C 7 61.482 16.618 14.864 1.00 39.06 O ATOM 1898 O5' DA C 7 62.352 18.881 15.416 1.00 37.25 O ATOM 1899 C5' DA C 7 62.618 20.244 15.110 1.00 35.12 C ATOM 1900 C4' DA C 7 63.552 20.829 16.145 1.00 33.17 C ATOM 1901 O4' DA C 7 62.823 20.998 17.380 1.00 32.90 O ATOM 1902 C3' DA C 7 64.771 19.955 16.448 1.00 31.87 C ATOM 1903 O3' DA C 7 65.927 20.768 16.262 1.00 29.95 O ATOM 1904 C2' DA C 7 64.561 19.478 17.885 1.00 33.11 C ATOM 1905 C1' DA C 7 63.618 20.551 18.453 1.00 33.50 C ATOM 1906 N9 DA C 7 62.695 20.083 19.486 1.00 34.75 N ATOM 1907 C8 DA C 7 61.908 18.958 19.444 1.00 34.41 C ATOM 1908 N7 DA C 7 61.169 18.790 20.520 1.00 34.80 N ATOM 1909 C5 DA C 7 61.476 19.883 21.321 1.00 34.69 C ATOM 1910 C6 DA C 7 61.038 20.298 22.610 1.00 34.04 C ATOM 1911 N6 DA C 7 60.139 19.642 23.347 1.00 34.39 N ATOM 1912 N1 DA C 7 61.564 21.423 23.127 1.00 33.17 N ATOM 1913 C2 DA C 7 62.460 22.110 22.407 1.00 33.99 C ATOM 1914 N3 DA C 7 62.945 21.837 21.191 1.00 34.11 N ATOM 1915 C4 DA C 7 62.417 20.693 20.698 1.00 35.03 C ATOM 1916 P DT C 8 67.420 20.211 16.372 1.00 30.93 P ATOM 1917 OP1 DT C 8 68.264 21.071 15.503 1.00 30.21 O ATOM 1918 OP2 DT C 8 67.433 18.733 16.201 1.00 30.75 O ATOM 1919 O5' DT C 8 67.749 20.514 17.908 1.00 31.32 O ATOM 1920 C5' DT C 8 67.768 21.855 18.368 1.00 35.08 C ATOM 1921 C4' DT C 8 67.804 21.850 19.883 1.00 36.81 C ATOM 1922 O4' DT C 8 66.599 21.243 20.404 1.00 37.50 O ATOM 1923 C3' DT C 8 68.967 21.064 20.474 1.00 37.74 C ATOM 1924 O3' DT C 8 69.906 22.036 20.923 1.00 38.43 O ATOM 1925 C2' DT C 8 68.332 20.218 21.586 1.00 37.82 C ATOM 1926 C1' DT C 8 66.918 20.796 21.696 1.00 35.93 C ATOM 1927 N1 DT C 8 65.828 19.870 22.177 1.00 35.56 N ATOM 1928 C2 DT C 8 65.214 20.168 23.379 1.00 36.16 C ATOM 1929 O2 DT C 8 65.518 21.130 24.047 1.00 35.69 O ATOM 1930 N3 DT C 8 64.230 19.303 23.780 1.00 35.16 N ATOM 1931 C4 DT C 8 63.813 18.175 23.112 1.00 35.60 C ATOM 1932 O4 DT C 8 62.921 17.465 23.568 1.00 36.00 O ATOM 1933 C5 DT C 8 64.490 17.899 21.853 1.00 35.72 C ATOM 1934 C7 DT C 8 64.119 16.692 21.037 1.00 35.85 C ATOM 1935 C6 DT C 8 65.452 18.749 21.449 1.00 35.71 C ATOM 1936 P DT C 9 71.371 21.684 21.456 1.00 41.46 P ATOM 1937 OP1 DT C 9 72.219 22.877 21.227 1.00 40.27 O ATOM 1938 OP2 DT C 9 71.826 20.364 20.952 1.00 38.85 O ATOM 1939 O5' DT C 9 71.084 21.503 23.012 1.00 41.55 O ATOM 1940 C5' DT C 9 70.740 22.615 23.839 1.00 42.07 C ATOM 1941 C4' DT C 9 70.483 22.088 25.233 1.00 42.02 C ATOM 1942 O4' DT C 9 69.308 21.246 25.207 1.00 41.15 O ATOM 1943 C3' DT C 9 71.609 21.226 25.802 1.00 43.19 C ATOM 1944 O3' DT C 9 72.215 21.976 26.871 1.00 45.60 O ATOM 1945 C2' DT C 9 70.930 19.902 26.192 1.00 41.62 C ATOM 1946 C1' DT C 9 69.446 20.271 26.210 1.00 38.93 C ATOM 1947 N1 DT C 9 68.424 19.189 25.921 1.00 38.99 N ATOM 1948 C2 DT C 9 67.373 19.003 26.805 1.00 38.14 C ATOM 1949 O2 DT C 9 67.230 19.646 27.826 1.00 38.27 O ATOM 1950 N3 DT C 9 66.490 18.009 26.465 1.00 36.75 N ATOM 1951 C4 DT C 9 66.531 17.202 25.340 1.00 37.45 C ATOM 1952 O4 DT C 9 65.675 16.342 25.147 1.00 36.97 O ATOM 1953 C5 DT C 9 67.646 17.447 24.447 1.00 37.90 C ATOM 1954 C7 DT C 9 67.827 16.628 23.197 1.00 38.50 C ATOM 1955 C6 DT C 9 68.520 18.414 24.772 1.00 37.88 C ATOM 1956 P DA C 10 73.372 21.420 27.836 1.00 48.78 P ATOM 1957 OP1 DA C 10 74.114 22.601 28.334 1.00 49.31 O ATOM 1958 OP2 DA C 10 74.125 20.304 27.225 1.00 47.76 O ATOM 1959 O5' DA C 10 72.461 20.839 29.004 1.00 48.67 O ATOM 1960 C5' DA C 10 71.647 21.748 29.742 1.00 48.26 C ATOM 1961 C4' DA C 10 71.391 21.139 31.103 1.00 48.22 C ATOM 1962 O4' DA C 10 70.293 20.209 30.976 1.00 48.14 O ATOM 1963 C3' DA C 10 72.573 20.368 31.697 1.00 48.91 C ATOM 1964 O3' DA C 10 72.750 20.822 33.051 1.00 49.11 O ATOM 1965 C2' DA C 10 72.213 18.885 31.526 1.00 47.81 C ATOM 1966 C1' DA C 10 70.703 18.891 31.271 1.00 47.06 C ATOM 1967 N9 DA C 10 70.258 18.005 30.186 1.00 46.62 N ATOM 1968 C8 DA C 10 70.856 17.783 28.969 1.00 46.35 C ATOM 1969 N7 DA C 10 70.222 16.922 28.205 1.00 45.88 N ATOM 1970 C5 DA C 10 69.128 16.551 28.969 1.00 45.62 C ATOM 1971 C6 DA C 10 68.060 15.663 28.734 1.00 45.87 C ATOM 1972 N6 DA C 10 67.923 14.966 27.608 1.00 45.88 N ATOM 1973 N1 DA C 10 67.131 15.518 29.703 1.00 46.20 N ATOM 1974 C2 DA C 10 67.264 16.215 30.839 1.00 46.24 C ATOM 1975 N3 DA C 10 68.220 17.082 31.182 1.00 46.22 N ATOM 1976 C4 DA C 10 69.132 17.207 30.193 1.00 46.58 C ATOM 1977 P DG C 11 73.761 20.158 34.098 1.00 50.44 P ATOM 1978 OP1 DG C 11 73.808 21.057 35.278 1.00 50.54 O ATOM 1979 OP2 DG C 11 75.028 19.772 33.419 1.00 48.85 O ATOM 1980 O5' DG C 11 72.986 18.801 34.457 1.00 49.21 O ATOM 1981 C5' DG C 11 71.716 18.793 35.102 1.00 47.73 C ATOM 1982 C4' DG C 11 71.371 17.356 35.439 1.00 47.40 C ATOM 1983 O4' DG C 11 70.634 16.814 34.328 1.00 46.52 O ATOM 1984 C3' DG C 11 72.558 16.401 35.572 1.00 48.25 C ATOM 1985 O3' DG C 11 73.182 16.391 36.888 1.00 50.90 O ATOM 1986 C2' DG C 11 72.003 15.050 35.132 1.00 46.39 C ATOM 1987 C1' DG C 11 70.735 15.399 34.358 1.00 43.31 C ATOM 1988 N9 DG C 11 70.743 14.898 32.984 1.00 42.62 N ATOM 1989 C8 DG C 11 71.674 15.243 32.027 1.00 42.16 C ATOM 1990 N7 DG C 11 71.474 14.673 30.875 1.00 42.07 N ATOM 1991 C5 DG C 11 70.336 13.903 31.080 1.00 41.58 C ATOM 1992 C6 DG C 11 69.665 13.063 30.164 1.00 41.39 C ATOM 1993 O6 DG C 11 69.974 12.872 28.984 1.00 41.88 O ATOM 1994 N1 DG C 11 68.555 12.435 30.727 1.00 41.35 N ATOM 1995 C2 DG C 11 68.149 12.618 32.029 1.00 41.65 C ATOM 1996 N2 DG C 11 67.052 11.932 32.389 1.00 42.03 N ATOM 1997 N3 DG C 11 68.769 13.412 32.909 1.00 40.62 N ATOM 1998 C4 DG C 11 69.861 14.022 32.370 1.00 41.29 C ATOM 1999 P DG C 12 72.690 15.738 38.290 1.00 51.63 P ATOM 2000 OP1 DG C 12 71.239 16.044 38.409 1.00 52.39 O ATOM 2001 OP2 DG C 12 73.629 16.247 39.320 1.00 50.46 O ATOM 2002 O5' DG C 12 72.904 14.162 38.223 1.00 47.81 O ATOM 2003 C5' DG C 12 72.055 13.396 37.410 1.00 46.20 C ATOM 2004 C4' DG C 12 71.201 12.331 38.067 1.00 44.38 C ATOM 2005 O4' DG C 12 70.078 12.170 37.155 1.00 44.10 O ATOM 2006 C3' DG C 12 71.848 10.955 38.146 1.00 42.19 C ATOM 2007 O3' DG C 12 72.084 10.494 39.457 1.00 43.60 O ATOM 2008 C2' DG C 12 70.788 10.017 37.588 1.00 42.16 C ATOM 2009 C1' DG C 12 69.979 10.857 36.642 1.00 38.91 C ATOM 2010 N9 DG C 12 70.471 10.807 35.282 1.00 38.96 N ATOM 2011 C8 DG C 12 71.556 11.486 34.784 1.00 38.45 C ATOM 2012 N7 DG C 12 71.779 11.276 33.518 1.00 38.30 N ATOM 2013 C5 DG C 12 70.785 10.390 33.160 1.00 36.88 C ATOM 2014 C6 DG C 12 70.560 9.827 31.903 1.00 36.32 C ATOM 2015 O6 DG C 12 71.229 10.045 30.898 1.00 36.50 O ATOM 2016 N1 DG C 12 69.460 8.965 31.892 1.00 36.89 N ATOM 2017 C2 DG C 12 68.678 8.691 33.001 1.00 38.74 C ATOM 2018 N2 DG C 12 67.672 7.824 32.785 1.00 38.19 N ATOM 2019 N3 DG C 12 68.874 9.234 34.224 1.00 38.08 N ATOM 2020 C4 DG C 12 69.955 10.077 34.223 1.00 38.85 C ATOM 2021 P DG C 13 72.283 8.906 39.628 1.00 40.57 P ATOM 2022 OP1 DG C 13 72.346 8.665 41.105 1.00 43.87 O ATOM 2023 OP2 DG C 13 73.454 8.555 38.797 1.00 37.66 O ATOM 2024 O5' DG C 13 70.939 8.221 39.021 1.00 38.95 O ATOM 2025 C5' DG C 13 70.608 6.803 39.042 1.00 35.65 C ATOM 2026 C4' DG C 13 69.451 6.446 38.092 1.00 32.58 C ATOM 2027 O4' DG C 13 69.617 7.120 36.811 1.00 28.36 O ATOM 2028 C3' DG C 13 69.303 4.977 37.653 1.00 31.71 C ATOM 2029 O3' DG C 13 68.018 4.827 36.918 1.00 35.70 O ATOM 2030 C2' DG C 13 70.515 4.903 36.729 1.00 29.33 C ATOM 2031 C1' DG C 13 70.233 6.177 35.928 1.00 28.98 C ATOM 2032 N9 DG C 13 71.334 6.826 35.222 1.00 29.34 N ATOM 2033 C8 DG C 13 72.272 7.716 35.697 1.00 29.40 C ATOM 2034 N7 DG C 13 73.097 8.145 34.779 1.00 29.85 N ATOM 2035 C5 DG C 13 72.673 7.502 33.615 1.00 29.96 C ATOM 2036 C6 DG C 13 73.168 7.555 32.283 1.00 28.99 C ATOM 2037 O6 DG C 13 74.117 8.211 31.860 1.00 27.00 O ATOM 2038 N1 DG C 13 72.439 6.736 31.406 1.00 28.71 N ATOM 2039 C2 DG C 13 71.362 5.953 31.773 1.00 29.29 C ATOM 2040 N2 DG C 13 70.775 5.209 30.820 1.00 27.89 N ATOM 2041 N3 DG C 13 70.889 5.902 33.014 1.00 28.29 N ATOM 2042 C4 DG C 13 71.587 6.690 33.875 1.00 30.32 C ATOM 2043 P DT C 14 67.377 3.468 36.283 1.00 36.90 P ATOM 2044 OP1 DT C 14 65.995 3.823 35.874 1.00 37.26 O ATOM 2045 OP2 DT C 14 67.674 2.346 37.223 1.00 36.55 O ATOM 2046 O5' DT C 14 68.199 3.200 34.926 1.00 35.54 O ATOM 2047 C5' DT C 14 67.767 3.909 33.720 1.00 33.53 C ATOM 2048 C4' DT C 14 68.096 3.063 32.500 1.00 32.30 C ATOM 2049 O4' DT C 14 69.548 2.925 32.418 1.00 30.20 O ATOM 2050 C3' DT C 14 67.537 1.638 32.582 1.00 32.09 C ATOM 2051 O3' DT C 14 66.923 1.266 31.347 1.00 34.15 O ATOM 2052 C2' DT C 14 68.760 0.767 32.877 1.00 29.72 C ATOM 2053 C1' DT C 14 69.894 1.579 32.252 1.00 26.76 C ATOM 2054 N1 DT C 14 71.271 1.386 32.855 1.00 26.14 N ATOM 2055 C2 DT C 14 72.278 0.905 32.047 1.00 26.57 C ATOM 2056 O2 DT C 14 72.121 0.596 30.867 1.00 27.56 O ATOM 2057 N3 DT C 14 73.496 0.751 32.678 1.00 24.46 N ATOM 2058 C4 DT C 14 73.827 1.051 33.989 1.00 24.73 C ATOM 2059 O4 DT C 14 74.966 0.869 34.432 1.00 22.61 O ATOM 2060 C5 DT C 14 72.728 1.561 34.783 1.00 24.88 C ATOM 2061 C7 DT C 14 72.949 1.922 36.219 1.00 26.34 C ATOM 2062 C6 DT C 14 71.526 1.708 34.189 1.00 25.96 C TER 2063 DT C 14 ATOM 2064 O5' DA D 1 78.304 10.277 24.958 1.00 36.58 O ATOM 2065 C5' DA D 1 77.648 9.018 24.786 1.00 35.16 C ATOM 2066 C4' DA D 1 77.458 8.673 23.312 1.00 35.11 C ATOM 2067 O4' DA D 1 78.725 8.631 22.608 1.00 35.56 O ATOM 2068 C3' DA D 1 76.834 7.311 23.054 1.00 33.34 C ATOM 2069 O3' DA D 1 76.052 7.300 21.849 1.00 33.30 O ATOM 2070 C2' DA D 1 78.041 6.376 22.901 1.00 34.96 C ATOM 2071 C1' DA D 1 79.061 7.307 22.230 1.00 36.11 C ATOM 2072 N9 DA D 1 80.472 7.170 22.572 1.00 36.93 N ATOM 2073 C8 DA D 1 81.519 7.320 21.687 1.00 37.07 C ATOM 2074 N7 DA D 1 82.703 7.179 22.231 1.00 36.99 N ATOM 2075 C5 DA D 1 82.440 6.936 23.570 1.00 36.45 C ATOM 2076 C6 DA D 1 83.288 6.705 24.685 1.00 38.04 C ATOM 2077 N6 DA D 1 84.626 6.687 24.614 1.00 37.06 N ATOM 2078 N1 DA D 1 82.698 6.525 25.898 1.00 38.23 N ATOM 2079 C2 DA D 1 81.355 6.547 25.984 1.00 37.46 C ATOM 2080 N3 DA D 1 80.471 6.749 25.007 1.00 35.79 N ATOM 2081 C4 DA D 1 81.071 6.943 23.810 1.00 37.51 C ATOM 2082 P DC D 2 74.542 7.774 21.776 1.00 35.32 P ATOM 2083 OP1 DC D 2 74.072 7.477 20.396 1.00 32.26 O ATOM 2084 OP2 DC D 2 74.467 9.098 22.345 1.00 34.41 O ATOM 2085 O5' DC D 2 73.799 6.727 22.757 1.00 35.53 O ATOM 2086 C5' DC D 2 73.838 5.351 22.440 1.00 35.45 C ATOM 2087 C4' DC D 2 73.081 4.515 23.463 1.00 34.58 C ATOM 2088 O4' DC D 2 73.805 4.523 24.716 1.00 32.99 O ATOM 2089 C3' DC D 2 71.703 5.029 23.807 1.00 34.64 C ATOM 2090 O3' DC D 2 70.775 4.410 22.949 1.00 36.26 O ATOM 2091 C2' DC D 2 71.479 4.511 25.222 1.00 32.50 C ATOM 2092 C1' DC D 2 72.877 4.631 25.789 1.00 31.83 C ATOM 2093 N1 DC D 2 73.215 5.824 26.617 1.00 32.61 N ATOM 2094 C2 DC D 2 72.836 5.822 27.979 1.00 31.45 C ATOM 2095 O2 DC D 2 72.181 4.872 28.443 1.00 29.71 O ATOM 2096 N3 DC D 2 73.190 6.870 28.746 1.00 30.13 N ATOM 2097 C4 DC D 2 73.880 7.901 28.242 1.00 31.92 C ATOM 2098 N4 DC D 2 74.204 8.889 29.079 1.00 30.70 N ATOM 2099 C5 DC D 2 74.261 7.939 26.857 1.00 31.14 C ATOM 2100 C6 DC D 2 73.920 6.881 26.099 1.00 31.98 C ATOM 2101 P DC D 3 69.496 5.210 22.484 1.00 41.30 P ATOM 2102 OP1 DC D 3 68.879 4.408 21.406 1.00 40.03 O ATOM 2103 OP2 DC D 3 69.866 6.620 22.225 1.00 42.71 O ATOM 2104 O5' DC D 3 68.552 5.180 23.784 1.00 39.68 O ATOM 2105 C5' DC D 3 68.103 3.892 24.260 1.00 41.41 C ATOM 2106 C4' DC D 3 67.530 3.920 25.664 1.00 40.92 C ATOM 2107 O4' DC D 3 68.527 4.393 26.592 1.00 39.40 O ATOM 2108 C3' DC D 3 66.348 4.859 25.835 1.00 41.57 C ATOM 2109 O3' DC D 3 65.171 4.111 25.720 1.00 41.92 O ATOM 2110 C2' DC D 3 66.451 5.389 27.256 1.00 41.60 C ATOM 2111 C1' DC D 3 67.901 5.139 27.618 1.00 41.23 C ATOM 2112 N1 DC D 3 68.676 6.380 27.796 1.00 41.19 N ATOM 2113 C2 DC D 3 68.743 6.949 29.078 1.00 41.82 C ATOM 2114 O2 DC D 3 68.153 6.433 30.052 1.00 42.24 O ATOM 2115 N3 DC D 3 69.485 8.067 29.205 1.00 41.03 N ATOM 2116 C4 DC D 3 70.115 8.593 28.157 1.00 39.76 C ATOM 2117 N4 DC D 3 70.816 9.690 28.396 1.00 42.21 N ATOM 2118 C5 DC D 3 70.059 8.046 26.848 1.00 41.21 C ATOM 2119 C6 DC D 3 69.317 6.942 26.719 1.00 41.10 C ATOM 2120 P DC D 4 63.880 4.873 25.209 1.00 43.24 P ATOM 2121 OP1 DC D 4 62.930 3.852 24.715 1.00 43.96 O ATOM 2122 OP2 DC D 4 64.303 6.008 24.349 1.00 43.53 O ATOM 2123 O5' DC D 4 63.348 5.540 26.557 1.00 43.68 O ATOM 2124 C5' DC D 4 63.052 4.760 27.715 1.00 44.92 C ATOM 2125 C4' DC D 4 62.763 5.725 28.848 1.00 44.80 C ATOM 2126 O4' DC D 4 63.964 6.493 29.118 1.00 44.82 O ATOM 2127 C3' DC D 4 61.662 6.735 28.536 1.00 46.03 C ATOM 2128 O3' DC D 4 60.748 6.752 29.625 1.00 47.65 O ATOM 2129 C2' DC D 4 62.386 8.069 28.349 1.00 44.78 C ATOM 2130 C1' DC D 4 63.648 7.867 29.182 1.00 43.26 C ATOM 2131 N1 DC D 4 64.820 8.710 28.745 1.00 43.06 N ATOM 2132 C2 DC D 4 65.446 9.526 29.703 1.00 42.26 C ATOM 2133 O2 DC D 4 65.015 9.517 30.866 1.00 43.28 O ATOM 2134 N3 DC D 4 66.490 10.305 29.328 1.00 41.23 N ATOM 2135 C4 DC D 4 66.906 10.288 28.059 1.00 41.33 C ATOM 2136 N4 DC D 4 67.933 11.068 27.734 1.00 42.45 N ATOM 2137 C5 DC D 4 66.292 9.474 27.059 1.00 41.63 C ATOM 2138 C6 DC D 4 65.260 8.707 27.447 1.00 42.35 C ATOM 2139 P DT D 5 59.361 7.546 29.555 1.00 49.48 P ATOM 2140 OP1 DT D 5 58.424 6.800 30.427 1.00 48.63 O ATOM 2141 OP2 DT D 5 59.025 7.823 28.136 1.00 49.93 O ATOM 2142 O5' DT D 5 59.729 8.954 30.220 1.00 49.65 O ATOM 2143 C5' DT D 5 60.304 8.998 31.523 1.00 49.64 C ATOM 2144 C4' DT D 5 60.712 10.411 31.888 1.00 49.21 C ATOM 2145 O4' DT D 5 61.946 10.750 31.214 1.00 49.34 O ATOM 2146 C3' DT D 5 59.704 11.508 31.538 1.00 48.67 C ATOM 2147 O3' DT D 5 59.349 12.149 32.753 1.00 47.78 O ATOM 2148 C2' DT D 5 60.482 12.433 30.603 1.00 49.24 C ATOM 2149 C1' DT D 5 61.932 12.139 30.987 1.00 48.63 C ATOM 2150 N1 DT D 5 62.972 12.482 29.957 1.00 48.40 N ATOM 2151 C2 DT D 5 64.083 13.233 30.317 1.00 48.24 C ATOM 2152 O2 DT D 5 64.294 13.653 31.439 1.00 48.80 O ATOM 2153 N3 DT D 5 64.967 13.484 29.300 1.00 48.34 N ATOM 2154 C4 DT D 5 64.855 13.065 27.988 1.00 48.22 C ATOM 2155 O4 DT D 5 65.712 13.346 27.159 1.00 49.24 O ATOM 2156 C5 DT D 5 63.682 12.280 27.676 1.00 48.08 C ATOM 2157 C7 DT D 5 63.437 11.763 26.287 1.00 48.68 C ATOM 2158 C6 DT D 5 62.812 12.031 28.661 1.00 47.92 C ATOM 2159 P DA D 6 58.108 13.153 32.958 1.00 46.60 P ATOM 2160 OP1 DA D 6 57.397 12.635 34.146 1.00 45.89 O ATOM 2161 OP2 DA D 6 57.369 13.406 31.694 1.00 45.95 O ATOM 2162 O5' DA D 6 58.866 14.513 33.328 1.00 45.65 O ATOM 2163 C5' DA D 6 59.856 14.553 34.362 1.00 43.07 C ATOM 2164 C4' DA D 6 60.631 15.863 34.334 1.00 42.20 C ATOM 2165 O4' DA D 6 61.586 15.867 33.244 1.00 41.54 O ATOM 2166 C3' DA D 6 59.797 17.132 34.162 1.00 41.59 C ATOM 2167 O3' DA D 6 60.267 18.086 35.107 1.00 41.16 O ATOM 2168 C2' DA D 6 60.046 17.545 32.707 1.00 41.59 C ATOM 2169 C1' DA D 6 61.454 17.018 32.443 1.00 41.11 C ATOM 2170 N9 DA D 6 61.712 16.602 31.065 1.00 40.81 N ATOM 2171 C8 DA D 6 60.940 15.768 30.308 1.00 41.37 C ATOM 2172 N7 DA D 6 61.402 15.543 29.097 1.00 41.06 N ATOM 2173 C5 DA D 6 62.566 16.286 29.055 1.00 40.47 C ATOM 2174 C6 DA D 6 63.524 16.478 28.042 1.00 40.60 C ATOM 2175 N6 DA D 6 63.444 15.909 26.834 1.00 41.38 N ATOM 2176 N1 DA D 6 64.571 17.283 28.311 1.00 40.85 N ATOM 2177 C2 DA D 6 64.648 17.856 29.518 1.00 40.67 C ATOM 2178 N3 DA D 6 63.808 17.755 30.555 1.00 41.07 N ATOM 2179 C4 DA D 6 62.774 16.946 30.260 1.00 40.54 C ATOM 2180 P DA D 7 59.601 19.532 35.274 1.00 41.78 P ATOM 2181 OP1 DA D 7 59.938 20.013 36.629 1.00 42.59 O ATOM 2182 OP2 DA D 7 58.183 19.490 34.836 1.00 42.42 O ATOM 2183 O5' DA D 7 60.411 20.403 34.202 1.00 40.92 O ATOM 2184 C5' DA D 7 61.801 20.635 34.431 1.00 39.57 C ATOM 2185 C4' DA D 7 62.388 21.533 33.363 1.00 37.35 C ATOM 2186 O4' DA D 7 62.549 20.755 32.151 1.00 37.21 O ATOM 2187 C3' DA D 7 61.568 22.771 33.027 1.00 37.57 C ATOM 2188 O3' DA D 7 62.361 23.902 33.414 1.00 37.17 O ATOM 2189 C2' DA D 7 61.286 22.655 31.527 1.00 35.58 C ATOM 2190 C1' DA D 7 62.273 21.582 31.052 1.00 36.15 C ATOM 2191 N9 DA D 7 61.773 20.695 30.006 1.00 35.78 N ATOM 2192 C8 DA D 7 60.642 19.922 30.026 1.00 35.34 C ATOM 2193 N7 DA D 7 60.475 19.226 28.921 1.00 36.86 N ATOM 2194 C5 DA D 7 61.568 19.558 28.134 1.00 35.76 C ATOM 2195 C6 DA D 7 61.992 19.155 26.839 1.00 35.37 C ATOM 2196 N6 DA D 7 61.331 18.295 26.062 1.00 35.40 N ATOM 2197 N1 DA D 7 63.128 19.692 26.357 1.00 35.40 N ATOM 2198 C2 DA D 7 63.818 20.563 27.110 1.00 35.72 C ATOM 2199 N3 DA D 7 63.526 21.015 28.335 1.00 35.91 N ATOM 2200 C4 DA D 7 62.381 20.464 28.794 1.00 35.65 C ATOM 2201 P DT D 8 61.971 25.431 33.265 1.00 37.52 P ATOM 2202 OP1 DT D 8 62.911 26.182 34.120 1.00 37.07 O ATOM 2203 OP2 DT D 8 60.503 25.584 33.433 1.00 36.70 O ATOM 2204 O5' DT D 8 62.316 25.792 31.745 1.00 38.58 O ATOM 2205 C5' DT D 8 63.660 25.692 31.271 1.00 38.68 C ATOM 2206 C4' DT D 8 63.704 25.882 29.766 1.00 38.41 C ATOM 2207 O4' DT D 8 63.143 24.696 29.174 1.00 39.47 O ATOM 2208 C3' DT D 8 62.923 27.060 29.182 1.00 40.32 C ATOM 2209 O3' DT D 8 63.886 28.046 28.818 1.00 41.65 O ATOM 2210 C2' DT D 8 62.135 26.463 28.009 1.00 38.52 C ATOM 2211 C1' DT D 8 62.718 25.057 27.876 1.00 37.20 C ATOM 2212 N1 DT D 8 61.805 23.985 27.352 1.00 36.55 N ATOM 2213 C2 DT D 8 62.112 23.405 26.132 1.00 36.50 C ATOM 2214 O2 DT D 8 63.086 23.724 25.477 1.00 37.12 O ATOM 2215 N3 DT D 8 61.244 22.432 25.700 1.00 35.04 N ATOM 2216 C4 DT D 8 60.120 21.986 26.361 1.00 35.50 C ATOM 2217 O4 DT D 8 59.411 21.105 25.895 1.00 36.06 O ATOM 2218 C5 DT D 8 59.840 22.631 27.635 1.00 34.84 C ATOM 2219 C7 DT D 8 58.640 22.229 28.438 1.00 35.84 C ATOM 2220 C6 DT D 8 60.681 23.589 28.064 1.00 35.82 C ATOM 2221 P DT D 9 63.588 29.497 28.246 1.00 46.24 P ATOM 2222 OP1 DT D 9 64.823 30.287 28.462 1.00 46.17 O ATOM 2223 OP2 DT D 9 62.287 30.032 28.731 1.00 43.47 O ATOM 2224 O5' DT D 9 63.389 29.224 26.689 1.00 44.98 O ATOM 2225 C5' DT D 9 64.489 28.884 25.859 1.00 44.54 C ATOM 2226 C4' DT D 9 63.986 28.677 24.444 1.00 43.34 C ATOM 2227 O4' DT D 9 63.152 27.503 24.433 1.00 42.40 O ATOM 2228 C3' DT D 9 63.126 29.800 23.875 1.00 45.26 C ATOM 2229 O3' DT D 9 63.737 30.197 22.662 1.00 48.04 O ATOM 2230 C2' DT D 9 61.746 29.166 23.662 1.00 42.88 C ATOM 2231 C1' DT D 9 62.119 27.701 23.492 1.00 39.90 C ATOM 2232 N1 DT D 9 61.051 26.674 23.759 1.00 39.07 N ATOM 2233 C2 DT D 9 60.836 25.657 22.845 1.00 38.92 C ATOM 2234 O2 DT D 9 61.451 25.542 21.802 1.00 40.07 O ATOM 2235 N3 DT D 9 59.844 24.766 23.174 1.00 37.95 N ATOM 2236 C4 DT D 9 59.061 24.790 24.316 1.00 37.53 C ATOM 2237 O4 DT D 9 58.198 23.941 24.499 1.00 37.49 O ATOM 2238 C5 DT D 9 59.329 25.878 25.238 1.00 38.54 C ATOM 2239 C7 DT D 9 58.546 26.040 26.513 1.00 39.11 C ATOM 2240 C6 DT D 9 60.294 26.754 24.919 1.00 38.70 C ATOM 2241 P DA D 10 63.436 31.576 21.919 1.00 49.48 P ATOM 2242 OP1 DA D 10 64.740 32.215 21.638 1.00 50.13 O ATOM 2243 OP2 DA D 10 62.382 32.369 22.598 1.00 49.68 O ATOM 2244 O5' DA D 10 62.812 31.008 20.564 1.00 49.09 O ATOM 2245 C5' DA D 10 63.608 30.233 19.680 1.00 47.26 C ATOM 2246 C4' DA D 10 62.722 29.651 18.600 1.00 46.41 C ATOM 2247 O4' DA D 10 61.822 28.707 19.217 1.00 46.22 O ATOM 2248 C3' DA D 10 61.841 30.666 17.881 1.00 46.32 C ATOM 2249 O3' DA D 10 62.067 30.544 16.478 1.00 45.94 O ATOM 2250 C2' DA D 10 60.412 30.313 18.307 1.00 45.70 C ATOM 2251 C1' DA D 10 60.529 28.839 18.683 1.00 44.38 C ATOM 2252 N9 DA D 10 59.633 28.402 19.753 1.00 44.33 N ATOM 2253 C8 DA D 10 59.475 29.004 20.972 1.00 43.78 C ATOM 2254 N7 DA D 10 58.612 28.411 21.760 1.00 43.33 N ATOM 2255 C5 DA D 10 58.182 27.337 21.010 1.00 42.48 C ATOM 2256 C6 DA D 10 57.253 26.325 21.293 1.00 43.02 C ATOM 2257 N6 DA D 10 56.597 26.254 22.453 1.00 43.52 N ATOM 2258 N1 DA D 10 57.028 25.407 20.333 1.00 43.32 N ATOM 2259 C2 DA D 10 57.688 25.497 19.167 1.00 43.50 C ATOM 2260 N3 DA D 10 58.595 26.406 18.789 1.00 43.45 N ATOM 2261 C4 DA D 10 58.794 27.309 19.768 1.00 43.07 C ATOM 2262 P DG D 11 61.467 31.609 15.440 1.00 47.41 P ATOM 2263 OP1 DG D 11 62.389 31.590 14.277 1.00 48.05 O ATOM 2264 OP2 DG D 11 61.152 32.881 16.121 1.00 44.79 O ATOM 2265 O5' DG D 11 60.091 30.891 15.060 1.00 45.60 O ATOM 2266 C5' DG D 11 60.144 29.654 14.344 1.00 43.18 C ATOM 2267 C4' DG D 11 58.747 29.137 14.066 1.00 41.62 C ATOM 2268 O4' DG D 11 58.176 28.668 15.308 1.00 40.28 O ATOM 2269 C3' DG D 11 57.786 30.176 13.502 1.00 40.79 C ATOM 2270 O3' DG D 11 57.356 29.719 12.221 1.00 41.00 O ATOM 2271 C2' DG D 11 56.663 30.266 14.538 1.00 40.47 C ATOM 2272 C1' DG D 11 56.801 28.964 15.315 1.00 38.76 C ATOM 2273 N9 DG D 11 56.401 29.003 16.724 1.00 38.09 N ATOM 2274 C8 DG D 11 56.841 29.868 17.696 1.00 37.78 C ATOM 2275 N7 DG D 11 56.321 29.641 18.869 1.00 37.58 N ATOM 2276 C5 DG D 11 55.497 28.546 18.665 1.00 36.88 C ATOM 2277 C6 DG D 11 54.675 27.851 19.578 1.00 36.82 C ATOM 2278 O6 DG D 11 54.530 28.091 20.774 1.00 37.95 O ATOM 2279 N1 DG D 11 53.979 26.803 18.981 1.00 37.02 N ATOM 2280 C2 DG D 11 54.100 26.461 17.651 1.00 37.82 C ATOM 2281 N2 DG D 11 53.363 25.424 17.220 1.00 37.89 N ATOM 2282 N3 DG D 11 54.874 27.104 16.783 1.00 37.55 N ATOM 2283 C4 DG D 11 55.539 28.135 17.358 1.00 37.20 C ATOM 2284 P DG D 12 56.499 30.648 11.255 1.00 41.50 P ATOM 2285 OP1 DG D 12 56.802 30.268 9.860 1.00 41.89 O ATOM 2286 OP2 DG D 12 56.604 32.070 11.676 1.00 40.13 O ATOM 2287 O5' DG D 12 55.012 30.209 11.633 1.00 41.73 O ATOM 2288 C5' DG D 12 54.577 28.853 11.472 1.00 40.02 C ATOM 2289 C4' DG D 12 53.144 28.775 11.980 1.00 38.21 C ATOM 2290 O4' DG D 12 53.210 28.708 13.429 1.00 37.13 O ATOM 2291 C3' DG D 12 52.245 29.968 11.648 1.00 37.49 C ATOM 2292 O3' DG D 12 50.909 29.555 11.370 1.00 37.20 O ATOM 2293 C2' DG D 12 52.223 30.765 12.944 1.00 36.44 C ATOM 2294 C1' DG D 12 52.230 29.597 13.918 1.00 34.73 C ATOM 2295 N9 DG D 12 52.532 30.001 15.276 1.00 34.80 N ATOM 2296 C8 DG D 12 53.386 30.991 15.693 1.00 34.41 C ATOM 2297 N7 DG D 12 53.419 31.117 16.989 1.00 35.02 N ATOM 2298 C5 DG D 12 52.524 30.151 17.448 1.00 35.16 C ATOM 2299 C6 DG D 12 52.124 29.808 18.762 1.00 34.45 C ATOM 2300 O6 DG D 12 52.504 30.321 19.818 1.00 35.12 O ATOM 2301 N1 DG D 12 51.192 28.768 18.783 1.00 33.89 N ATOM 2302 C2 DG D 12 50.698 28.141 17.661 1.00 34.07 C ATOM 2303 N2 DG D 12 49.803 27.162 17.840 1.00 34.21 N ATOM 2304 N3 DG D 12 51.057 28.461 16.430 1.00 33.79 N ATOM 2305 C4 DG D 12 51.966 29.464 16.403 1.00 33.94 C ATOM 2306 P DG D 13 49.939 30.323 10.380 1.00 37.40 P ATOM 2307 OP1 DG D 13 50.406 30.022 8.996 1.00 37.29 O ATOM 2308 OP2 DG D 13 49.702 31.724 10.787 1.00 35.53 O ATOM 2309 O5' DG D 13 48.560 29.533 10.617 1.00 37.87 O ATOM 2310 C5' DG D 13 48.552 28.086 10.812 1.00 38.05 C ATOM 2311 C4' DG D 13 47.424 27.678 11.756 1.00 38.16 C ATOM 2312 O4' DG D 13 47.780 27.968 13.140 1.00 36.53 O ATOM 2313 C3' DG D 13 46.101 28.387 11.521 1.00 40.40 C ATOM 2314 O3' DG D 13 45.033 27.504 11.815 1.00 45.95 O ATOM 2315 C2' DG D 13 46.156 29.559 12.501 1.00 38.09 C ATOM 2316 C1' DG D 13 46.888 28.928 13.674 1.00 34.19 C ATOM 2317 N9 DG D 13 47.719 29.831 14.469 1.00 34.33 N ATOM 2318 C8 DG D 13 48.694 30.693 14.025 1.00 33.56 C ATOM 2319 N7 DG D 13 49.287 31.349 14.983 1.00 33.05 N ATOM 2320 C5 DG D 13 48.679 30.874 16.134 1.00 33.17 C ATOM 2321 C6 DG D 13 48.910 31.225 17.480 1.00 32.26 C ATOM 2322 O6 DG D 13 49.737 32.046 17.883 1.00 32.09 O ATOM 2323 N1 DG D 13 48.087 30.516 18.363 1.00 32.28 N ATOM 2324 C2 DG D 13 47.138 29.590 17.974 1.00 33.79 C ATOM 2325 N2 DG D 13 46.408 29.007 18.939 1.00 32.94 N ATOM 2326 N3 DG D 13 46.906 29.259 16.699 1.00 33.30 N ATOM 2327 C4 DG D 13 47.717 29.932 15.842 1.00 33.88 C ATOM 2328 P DT D 14 43.678 27.538 10.976 1.00 51.03 P ATOM 2329 OP1 DT D 14 42.770 26.579 11.641 1.00 52.34 O ATOM 2330 OP2 DT D 14 44.024 27.358 9.548 1.00 52.07 O ATOM 2331 O5' DT D 14 43.108 29.021 11.179 1.00 52.64 O ATOM 2332 C5' DT D 14 41.705 29.283 11.316 1.00 58.28 C ATOM 2333 C4' DT D 14 41.400 30.330 12.387 1.00 60.93 C ATOM 2334 O4' DT D 14 41.263 29.688 13.687 1.00 62.35 O ATOM 2335 C3' DT D 14 42.438 31.440 12.547 1.00 61.77 C ATOM 2336 O3' DT D 14 41.798 32.711 12.614 1.00 63.26 O ATOM 2337 C2' DT D 14 43.149 31.102 13.853 1.00 62.83 C ATOM 2338 C1' DT D 14 42.150 30.255 14.638 1.00 63.14 C ATOM 2339 N1 DT D 14 42.807 29.165 15.475 1.00 63.50 N ATOM 2340 C2 DT D 14 43.036 29.358 16.834 1.00 63.61 C ATOM 2341 O2 DT D 14 42.743 30.366 17.458 1.00 63.69 O ATOM 2342 N3 DT D 14 43.636 28.297 17.469 1.00 63.70 N ATOM 2343 C4 DT D 14 44.028 27.090 16.917 1.00 63.51 C ATOM 2344 O4 DT D 14 44.559 26.219 17.602 1.00 63.49 O ATOM 2345 C5 DT D 14 43.764 26.947 15.501 1.00 63.53 C ATOM 2346 C7 DT D 14 44.133 25.690 14.762 1.00 63.65 C ATOM 2347 C6 DT D 14 43.179 27.975 14.865 1.00 63.55 C TER 2348 DT D 14 HETATM 2349 C ACT A 1 41.734 39.907 47.463 1.00 36.82 C HETATM 2350 O ACT A 1 41.349 40.408 46.389 1.00 36.95 O HETATM 2351 OXT ACT A 1 41.433 40.532 48.510 1.00 36.95 O1- HETATM 2352 CH3 ACT A 1 42.496 38.621 47.484 1.00 36.40 C HETATM 2353 C ACT B 2 81.626 0.466 0.573 1.00 23.43 C HETATM 2354 O ACT B 2 81.787 1.071 -0.526 1.00 25.03 O HETATM 2355 OXT ACT B 2 82.424 -0.457 0.854 1.00 24.26 O1- HETATM 2356 CH3 ACT B 2 80.469 0.739 1.460 1.00 24.76 C HETATM 2357 O HOH A 4 45.964 33.295 35.123 1.00 18.65 O HETATM 2358 O HOH A 11 49.388 38.896 20.478 1.00 16.18 O HETATM 2359 O HOH A 15 44.312 41.053 31.427 1.00 28.45 O HETATM 2360 O HOH A 16 47.430 35.355 35.857 1.00 24.21 O HETATM 2361 O HOH A 17 37.405 32.512 57.629 1.00 22.40 O HETATM 2362 O HOH A 18 42.446 39.353 53.030 1.00 22.80 O HETATM 2363 O HOH A 27 33.684 32.607 47.762 1.00 19.13 O HETATM 2364 O HOH A 29 43.212 28.236 52.570 1.00 24.97 O HETATM 2365 O HOH A 31 44.370 42.341 34.449 0.50 21.49 O HETATM 2366 O HOH A 34 35.582 29.376 31.774 1.00 25.15 O HETATM 2367 O HOH A 35 38.621 31.730 63.365 1.00 21.79 O HETATM 2368 O HOH A 38 55.899 37.282 33.562 1.00 32.63 O HETATM 2369 O HOH A 44 40.278 35.874 22.260 1.00 27.02 O HETATM 2370 O HOH A 46 36.779 41.192 29.831 1.00 27.99 O HETATM 2371 O HOH A 48 38.761 41.489 47.220 1.00 37.11 O HETATM 2372 O HOH A 52 31.461 34.129 41.075 1.00 22.24 O HETATM 2373 O HOH A 53 44.954 29.771 59.475 1.00 26.78 O HETATM 2374 O HOH A 55 42.517 42.206 18.655 0.50 12.66 O HETATM 2375 O HOH A 56 43.425 39.698 50.623 1.00 26.28 O HETATM 2376 O HOH A 59 45.007 40.391 39.801 1.00 39.20 O HETATM 2377 O HOH A 62 38.501 40.743 27.730 1.00 23.39 O HETATM 2378 O HOH A 64 51.604 41.241 38.391 1.00 28.33 O HETATM 2379 O HOH A 65 48.777 26.802 51.056 1.00 27.07 O HETATM 2380 O HOH A 67 52.678 25.658 32.840 1.00 31.75 O HETATM 2381 O HOH A 76 44.093 36.563 10.641 1.00 30.32 O HETATM 2382 O HOH A 79 42.838 25.209 32.916 1.00 29.58 O HETATM 2383 O HOH A 80 51.185 15.492 41.031 1.00 38.86 O HETATM 2384 O HOH A 82 31.417 31.612 40.369 1.00 26.16 O HETATM 2385 O HOH A 83 40.403 40.431 18.141 0.50 24.29 O HETATM 2386 O HOH A 85 39.239 38.933 20.021 1.00 26.44 O HETATM 2387 O HOH A 86 34.194 31.560 50.270 1.00 34.38 O HETATM 2388 O HOH A 87 56.510 37.356 49.019 1.00 39.84 O HETATM 2389 O HOH A 93 58.443 27.908 29.587 1.00 31.34 O HETATM 2390 O HOH A 97 55.322 18.396 35.411 1.00 40.83 O HETATM 2391 O HOH A 99 53.274 33.227 27.701 1.00 31.45 O HETATM 2392 O HOH A 100 61.135 33.254 46.154 1.00 39.81 O HETATM 2393 O HOH A 103 35.208 35.464 27.139 1.00 31.55 O HETATM 2394 O HOH A 104 46.301 17.756 33.205 1.00 38.81 O HETATM 2395 O HOH A 108 39.146 38.905 39.041 1.00 35.49 O HETATM 2396 O HOH A 109 33.512 28.767 33.439 1.00 31.62 O HETATM 2397 O HOH A 111 33.916 29.287 36.022 1.00 35.73 O HETATM 2398 O HOH A 112 36.198 37.606 36.558 1.00 36.53 O HETATM 2399 O HOH A 113 36.133 40.369 42.237 1.00 42.68 O HETATM 2400 O HOH A 117 46.847 28.159 52.886 1.00 42.89 O HETATM 2401 O HOH A 120 42.834 27.883 31.847 1.00 35.71 O HETATM 2402 O HOH A 121 38.659 40.222 34.486 1.00 41.85 O HETATM 2403 O HOH A 122 34.714 31.005 54.969 1.00 29.25 O HETATM 2404 O HOH A 123 53.256 17.220 33.859 1.00 35.68 O HETATM 2405 O HOH A 124 43.292 19.375 32.346 1.00 40.91 O HETATM 2406 O HOH A 130 43.229 26.238 28.263 1.00 35.18 O HETATM 2407 O HOH A 136 37.679 36.947 19.414 1.00 38.80 O HETATM 2408 O HOH A 138 36.993 22.941 33.302 1.00 36.40 O HETATM 2409 O HOH A 145 51.657 21.976 46.783 1.00 45.42 O HETATM 2410 O HOH A 147 48.526 35.990 55.330 0.50 29.36 O HETATM 2411 O HOH A 160 55.685 27.152 28.663 1.00 40.54 O HETATM 2412 O HOH A 161 61.542 41.551 36.723 0.50 36.47 O HETATM 2413 O HOH A 162 32.496 36.067 38.796 1.00 35.98 O HETATM 2414 O HOH A 164 29.420 30.336 41.731 1.00 43.98 O HETATM 2415 O HOH A 165 47.788 35.421 48.606 1.00 36.27 O HETATM 2416 O HOH A 167 47.769 30.210 54.015 1.00 57.68 O HETATM 2417 O HOH A 169 42.253 28.383 23.874 1.00 51.57 O HETATM 2418 O HOH A 170 52.457 40.765 41.914 1.00 32.85 O HETATM 2419 O HOH A 171 43.367 25.430 53.446 1.00 32.25 O HETATM 2420 O HOH A 174 30.994 39.103 45.593 1.00 37.58 O HETATM 2421 O HOH A 175 45.636 26.336 53.992 1.00 47.20 O HETATM 2422 O HOH A 176 32.112 32.014 35.979 1.00 38.18 O HETATM 2423 O HOH A 179 35.825 39.540 39.691 1.00 65.60 O HETATM 2424 O HOH A 182 50.766 28.595 50.624 1.00 32.35 O HETATM 2425 O HOH A 183 41.621 30.900 23.145 1.00 50.44 O HETATM 2426 O HOH A 184 40.604 38.566 12.502 1.00 38.95 O HETATM 2427 O HOH A 188 38.667 34.277 19.495 1.00 43.00 O HETATM 2428 O HOH A 189 51.599 38.511 48.392 1.00 35.93 O HETATM 2429 O HOH A 196 29.318 37.567 43.925 1.00 37.44 O HETATM 2430 O HOH A 199 54.606 35.228 28.639 1.00 39.58 O HETATM 2431 O HOH A 200 35.476 37.539 21.205 1.00 52.07 O HETATM 2432 O HOH A 203 58.860 30.305 25.702 1.00 44.70 O HETATM 2433 O HOH A 204 36.058 10.023 50.327 1.00 52.77 O HETATM 2434 O HOH A 208 55.193 40.734 42.468 1.00 37.67 O HETATM 2435 O HOH A 211 40.167 33.080 22.385 1.00 53.95 O HETATM 2436 O HOH A 212 40.994 16.317 53.221 1.00 44.05 O HETATM 2437 O HOH A 214 41.108 28.326 59.579 1.00 35.25 O HETATM 2438 O HOH A 225 41.955 17.468 33.489 1.00 44.78 O HETATM 2439 O HOH A 228 36.878 27.238 30.508 1.00 44.68 O HETATM 2440 O HOH A 230 44.648 14.056 43.164 1.00 51.72 O HETATM 2441 O HOH A 231 33.658 37.021 36.750 1.00 47.62 O HETATM 2442 O HOH A 234 43.493 30.189 20.605 1.00 37.50 O HETATM 2443 O HOH A 236 35.737 38.591 26.732 1.00 44.37 O HETATM 2444 O HOH A 241 39.575 39.286 22.189 1.00 36.34 O HETATM 2445 O HOH A 245 34.337 10.210 48.016 1.00 49.45 O HETATM 2446 O HOH A 247 60.283 23.451 37.235 1.00 46.53 O HETATM 2447 O HOH A 255 42.326 23.415 54.730 1.00 38.79 O HETATM 2448 O HOH A 256 62.915 24.419 37.341 1.00 52.15 O HETATM 2449 O HOH A 257 40.416 17.941 36.396 1.00 36.16 O HETATM 2450 O HOH A 262 43.302 13.121 45.620 1.00 44.08 O HETATM 2451 O HOH A 263 30.148 31.532 37.859 1.00 38.26 O HETATM 2452 O HOH A 267 55.160 40.601 47.856 1.00 38.20 O HETATM 2453 O HOH A 269 48.213 32.878 54.089 1.00 55.60 O HETATM 2454 O HOH A 271 39.872 35.987 12.043 1.00 42.78 O HETATM 2455 O HOH A 272 48.675 39.268 45.545 1.00 39.43 O HETATM 2456 O HOH A 273 45.920 36.143 60.210 1.00 41.50 O HETATM 2457 O HOH A 276 51.006 43.181 28.423 1.00 48.50 O HETATM 2458 O HOH A 281 42.783 31.427 62.455 1.00 36.91 O HETATM 2459 O HOH A 287 32.953 40.799 44.526 1.00 52.79 O HETATM 2460 O HOH A 288 35.260 32.416 26.832 1.00 57.40 O HETATM 2461 O HOH A 290 50.067 42.048 36.314 0.50 65.53 O HETATM 2462 O HOH A 295 62.769 39.503 34.089 1.00 52.90 O HETATM 2463 O HOH A 296 34.883 26.975 51.629 1.00 45.51 O HETATM 2464 O HOH A 298 35.111 39.415 44.393 1.00 46.75 O HETATM 2465 O HOH A 299 37.674 31.745 26.022 1.00 59.34 O HETATM 2466 O HOH A 301 51.133 39.184 46.267 1.00 42.65 O HETATM 2467 O HOH A 305 34.619 34.504 30.027 1.00 41.74 O HETATM 2468 O HOH A 314 51.056 35.090 49.779 1.00 55.13 O HETATM 2469 O HOH A 318 32.200 24.384 45.094 1.00 48.68 O HETATM 2470 O HOH A 324 57.501 39.894 46.236 1.00 53.85 O HETATM 2471 O HOH A 325 65.581 42.715 44.974 1.00 55.52 O HETATM 2472 O HOH A 326 45.027 19.180 50.309 1.00 38.84 O HETATM 2473 O HOH A 329 30.088 28.676 37.756 1.00 58.80 O HETATM 2474 O HOH A 331 51.280 33.090 51.435 1.00 63.57 O HETATM 2475 O HOH A 332 62.916 35.184 33.263 1.00 52.68 O HETATM 2476 O HOH A 335 59.887 42.051 36.321 0.50 62.19 O HETATM 2477 O HOH B 1 80.865 7.349 29.106 1.00 15.40 O HETATM 2478 O HOH B 5 76.575 -1.214 27.751 1.00 19.96 O HETATM 2479 O HOH B 6 74.285 -4.571 -7.934 1.00 19.93 O HETATM 2480 O HOH B 7 75.520 -10.530 8.370 1.00 20.16 O HETATM 2481 O HOH B 8 83.107 0.114 12.091 1.00 21.86 O HETATM 2482 O HOH B 9 76.006 -6.461 23.207 1.00 20.89 O HETATM 2483 O HOH B 10 81.474 0.126 -3.502 1.00 15.98 O HETATM 2484 O HOH B 12 77.348 5.350 13.209 1.00 26.17 O HETATM 2485 O HOH B 13 57.581 10.242 8.156 1.00 31.50 O HETATM 2486 O HOH B 14 81.897 -3.263 21.687 1.00 31.52 O HETATM 2487 O HOH B 20 73.582 -3.354 -13.735 1.00 18.56 O HETATM 2488 O HOH B 22 67.571 10.716 16.819 1.00 34.13 O HETATM 2489 O HOH B 23 72.813 -10.290 9.237 1.00 25.71 O HETATM 2490 O HOH B 24 77.716 -9.666 10.703 1.00 21.99 O HETATM 2491 O HOH B 26 81.868 2.975 9.790 1.00 31.51 O HETATM 2492 O HOH B 28 78.825 6.467 14.981 1.00 34.50 O HETATM 2493 O HOH B 30 71.933 3.099 -10.042 1.00 25.58 O HETATM 2494 O HOH B 32 70.892 2.669 18.844 1.00 36.25 O HETATM 2495 O HOH B 33 79.997 -11.455 3.509 1.00 31.10 O HETATM 2496 O HOH B 36 84.079 0.414 31.000 1.00 23.36 O HETATM 2497 O HOH B 41 68.633 7.176 -1.386 1.00 23.02 O HETATM 2498 O HOH B 42 70.721 -7.851 13.494 1.00 27.46 O HETATM 2499 O HOH B 43 78.083 -5.278 13.383 1.00 30.65 O HETATM 2500 O HOH B 49 82.336 -1.833 4.864 1.00 27.58 O HETATM 2501 O HOH B 50 75.731 -9.351 14.290 1.00 26.28 O HETATM 2502 O HOH B 51 80.430 -1.599 3.036 1.00 25.70 O HETATM 2503 O HOH B 54 70.306 1.621 -3.175 1.00 25.45 O HETATM 2504 O HOH B 57 72.451 -7.148 -5.527 1.00 21.80 O HETATM 2505 O HOH B 60 59.491 -1.149 13.000 1.00 34.98 O HETATM 2506 O HOH B 68 70.433 -5.765 17.808 1.00 25.22 O HETATM 2507 O HOH B 69 81.765 -9.411 2.828 1.00 36.96 O HETATM 2508 O HOH B 70 64.389 -4.650 16.093 1.00 38.71 O HETATM 2509 O HOH B 72 70.404 9.089 -0.983 1.00 31.76 O HETATM 2510 O HOH B 73 77.314 5.473 0.925 1.00 29.05 O HETATM 2511 O HOH B 75 59.437 5.060 16.172 1.00 33.06 O HETATM 2512 O HOH B 77 83.309 2.464 5.133 1.00 36.80 O HETATM 2513 O HOH B 84 72.892 -9.495 13.740 1.00 30.00 O HETATM 2514 O HOH B 88 68.603 4.141 -4.539 1.00 46.40 O HETATM 2515 O HOH B 89 67.617 2.028 21.277 1.00 35.85 O HETATM 2516 O HOH B 91 59.207 12.263 15.117 1.00 39.39 O HETATM 2517 O HOH B 92 72.174 3.235 -4.231 1.00 31.48 O HETATM 2518 O HOH B 94 71.605 -12.517 8.078 1.00 37.80 O HETATM 2519 O HOH B 95 83.165 8.928 11.313 1.00 34.07 O HETATM 2520 O HOH B 96 72.447 -7.757 -1.114 1.00 35.60 O HETATM 2521 O HOH B 101 77.066 12.963 21.003 1.00 39.98 O HETATM 2522 O HOH B 102 84.779 -11.340 9.855 1.00 51.25 O HETATM 2523 O HOH B 107 69.729 16.806 20.105 1.00 34.27 O HETATM 2524 O HOH B 110 60.819 3.607 -0.874 1.00 33.74 O HETATM 2525 O HOH B 115 68.367 -4.412 18.790 1.00 33.06 O HETATM 2526 O HOH B 119 73.853 -8.277 1.925 1.00 31.54 O HETATM 2527 O HOH B 125 67.300 1.960 -3.972 1.00 34.91 O HETATM 2528 O HOH B 126 79.576 4.163 2.379 1.00 37.29 O HETATM 2529 O HOH B 131 68.836 -4.923 -6.068 1.00 39.85 O HETATM 2530 O HOH B 133 68.612 14.111 20.988 1.00 38.61 O HETATM 2531 O HOH B 135 70.823 5.602 -4.099 1.00 53.97 O HETATM 2532 O HOH B 143 81.702 20.075 16.086 1.00 44.57 O HETATM 2533 O HOH B 144 75.886 -3.171 31.309 1.00 50.88 O HETATM 2534 O HOH B 149 82.931 9.770 7.634 1.00 31.92 O HETATM 2535 O HOH B 150 74.296 -7.684 19.619 1.00 48.87 O HETATM 2536 O HOH B 152 79.037 13.467 16.439 1.00 36.04 O HETATM 2537 O HOH B 154 72.380 17.275 23.969 1.00 43.68 O HETATM 2538 O HOH B 155 80.348 -11.156 11.644 1.00 51.50 O HETATM 2539 O HOH B 156 70.101 -4.082 -8.118 1.00 45.11 O HETATM 2540 O HOH B 157 80.605 8.773 2.058 1.00 49.41 O HETATM 2541 O HOH B 158 66.291 -0.944 18.495 1.00 44.90 O HETATM 2542 O HOH B 159 79.831 14.006 0.546 1.00 47.46 O HETATM 2543 O HOH B 166 65.670 16.408 2.961 1.00 40.51 O HETATM 2544 O HOH B 172 69.675 -7.942 16.134 1.00 32.60 O HETATM 2545 O HOH B 178 82.868 3.644 -6.193 1.00 51.41 O HETATM 2546 O HOH B 181 56.262 5.646 13.750 1.00 49.56 O HETATM 2547 O HOH B 187 81.853 -2.854 18.400 0.50 32.95 O HETATM 2548 O HOH B 190 68.015 10.078 19.370 1.00 38.47 O HETATM 2549 O HOH B 191 81.920 13.095 17.192 1.00 48.68 O HETATM 2550 O HOH B 192 71.271 -6.001 -2.673 1.00 40.44 O HETATM 2551 O HOH B 193 65.506 3.087 17.761 1.00 53.49 O HETATM 2552 O HOH B 195 72.973 -11.274 11.798 1.00 39.34 O HETATM 2553 O HOH B 197 68.794 -9.681 13.112 1.00 53.60 O HETATM 2554 O HOH B 198 56.005 3.334 6.151 1.00 44.19 O HETATM 2555 O HOH B 205 70.315 -3.319 22.479 1.00 55.46 O HETATM 2556 O HOH B 215 66.779 1.018 16.606 1.00 46.51 O HETATM 2557 O HOH B 220 72.372 -10.593 16.125 1.00 41.64 O HETATM 2558 O HOH B 221 85.884 0.617 27.240 1.00 43.55 O HETATM 2559 O HOH B 222 84.374 5.811 7.636 1.00 51.78 O HETATM 2560 O HOH B 226 66.887 16.438 0.527 1.00 48.24 O HETATM 2561 O HOH B 229 70.504 1.227 26.059 1.00 44.12 O HETATM 2562 O HOH B 232 85.451 7.591 14.127 1.00 62.59 O HETATM 2563 O HOH B 237 77.871 6.139 -3.528 1.00 54.38 O HETATM 2564 O HOH B 239 81.245 5.362 0.505 1.00 48.61 O HETATM 2565 O HOH B 242 65.219 15.215 17.920 1.00 43.52 O HETATM 2566 O HOH B 248 75.536 5.008 -6.959 1.00 47.56 O HETATM 2567 O HOH B 249 80.714 2.383 -10.487 1.00 46.38 O HETATM 2568 O HOH B 250 55.754 2.366 8.645 1.00 50.36 O HETATM 2569 O HOH B 252 73.862 0.698 -13.079 1.00 31.06 O HETATM 2570 O HOH B 253 68.789 -6.251 -2.805 1.00 46.09 O HETATM 2571 O HOH B 258 74.237 -9.769 18.150 0.50 37.84 O HETATM 2572 O HOH B 261 70.311 -1.174 -9.881 1.00 31.21 O HETATM 2573 O HOH B 265 65.640 -3.218 17.801 1.00 42.18 O HETATM 2574 O HOH B 266 78.476 4.259 -9.809 1.00 44.51 O HETATM 2575 O HOH B 268 53.643 2.021 6.131 1.00 65.06 O HETATM 2576 O HOH B 274 58.125 -0.033 -4.213 1.00 46.10 O HETATM 2577 O HOH B 275 84.834 6.927 11.701 1.00 64.64 O HETATM 2578 O HOH B 278 81.003 7.941 -0.480 1.00 59.35 O HETATM 2579 O HOH B 282 81.460 -0.499 6.404 1.00 48.24 O HETATM 2580 O HOH B 283 68.322 0.047 25.066 1.00 52.73 O HETATM 2581 O HOH B 284 73.225 5.967 -6.200 1.00 52.60 O HETATM 2582 O HOH B 285 66.168 -11.312 6.338 1.00 57.66 O HETATM 2583 O HOH B 286 51.638 -6.627 -0.269 1.00 61.78 O HETATM 2584 O HOH B 289 69.656 20.796 6.503 1.00 42.00 O HETATM 2585 O HOH B 291 52.439 1.993 10.221 1.00 51.23 O HETATM 2586 O HOH B 292 54.791 2.157 3.291 1.00 44.04 O HETATM 2587 O HOH B 293 84.470 1.761 13.597 1.00 51.50 O HETATM 2588 O HOH B 294 83.026 12.646 7.589 1.00 62.13 O HETATM 2589 O HOH B 297 86.439 2.202 20.482 1.00 57.64 O HETATM 2590 O HOH B 302 81.356 -13.556 10.402 1.00 62.95 O HETATM 2591 O HOH B 304 51.794 3.817 7.823 1.00 54.70 O HETATM 2592 O HOH B 310 64.298 15.409 1.240 1.00 65.02 O HETATM 2593 O HOH B 311 65.430 0.510 -5.329 1.00 42.97 O HETATM 2594 O HOH B 312 66.772 -0.967 -7.641 1.00 43.80 O HETATM 2595 O HOH B 313 82.861 2.168 2.752 1.00 48.61 O HETATM 2596 O HOH B 316 53.877 -2.785 7.119 1.00 71.20 O HETATM 2597 O HOH B 317 81.477 10.065 14.576 1.00 42.94 O HETATM 2598 O HOH B 320 75.463 6.514 -4.771 1.00 46.57 O HETATM 2599 O HOH B 327 74.694 3.421 -11.216 1.00 43.85 O HETATM 2600 O HOH B 328 60.783 -8.899 3.640 1.00 60.47 O HETATM 2601 O HOH B 333 72.154 9.394 -2.916 1.00 47.37 O HETATM 2602 O HOH B 334 54.718 -1.890 9.500 1.00 58.80 O HETATM 2603 O HOH B 336 58.669 0.617 8.330 1.00 51.83 O HETATM 2604 O HOH B 338 64.078 13.082 2.816 1.00 48.36 O HETATM 2605 O HOH B1080 75.166 4.091 14.450 1.00 21.19 O HETATM 2606 O HOH C 15 68.535 8.367 40.762 1.00 34.64 O HETATM 2607 O HOH C 19 48.509 29.477 29.848 1.00 26.52 O HETATM 2608 O HOH C 21 51.916 30.981 25.153 1.00 24.85 O HETATM 2609 O HOH C 25 68.580 15.192 39.714 1.00 33.64 O HETATM 2610 O HOH C 39 44.719 28.716 30.490 1.00 21.95 O HETATM 2611 O HOH C 58 72.430 11.413 29.720 1.00 38.24 O HETATM 2612 O HOH C 61 67.902 14.377 35.223 1.00 75.83 O HETATM 2613 O HOH C 63 73.604 12.652 33.749 1.00 29.42 O HETATM 2614 O HOH C 66 70.915 18.209 22.015 1.00 37.04 O HETATM 2615 O HOH C 78 52.003 34.450 21.437 1.00 27.53 O HETATM 2616 O HOH C 81 66.196 17.065 14.304 1.00 34.98 O HETATM 2617 O HOH C 90 77.139 18.868 35.030 1.00 35.81 O HETATM 2618 O HOH C 105 62.340 15.944 17.757 1.00 41.24 O HETATM 2619 O HOH C 106 65.496 -1.062 31.631 1.00 39.14 O HETATM 2620 O HOH C 118 60.534 14.269 13.860 1.00 37.64 O HETATM 2621 O HOH C 127 75.415 9.560 35.826 1.00 32.82 O HETATM 2622 O HOH C 132 65.191 18.746 12.506 1.00 45.24 O HETATM 2623 O HOH C 134 67.484 17.480 18.671 1.00 34.49 O HETATM 2624 O HOH C 141 43.257 30.598 29.728 1.00 45.03 O HETATM 2625 O HOH C 146 66.076 -0.069 37.101 0.50 33.77 O HETATM 2626 O HOH C 148 64.477 23.790 19.988 1.00 37.07 O HETATM 2627 O HOH C 151 75.449 13.901 30.973 1.00 40.56 O HETATM 2628 O HOH C 153 68.904 15.721 37.211 1.00 56.96 O HETATM 2629 O HOH C 168 68.484 1.491 28.598 1.00 45.83 O HETATM 2630 O HOH C 173 44.654 23.735 31.549 1.00 47.38 O HETATM 2631 O HOH C 201 46.488 24.866 29.909 1.00 41.51 O HETATM 2632 O HOH C 202 60.740 23.190 16.813 1.00 36.67 O HETATM 2633 O HOH C 206 65.626 6.411 34.692 1.00 37.15 O HETATM 2634 O HOH C 209 67.617 6.257 41.578 1.00 58.25 O HETATM 2635 O HOH C 213 52.470 26.965 25.467 1.00 35.85 O HETATM 2636 O HOH C 217 59.307 22.107 14.594 1.00 52.92 O HETATM 2637 O HOH C 218 67.491 3.017 39.711 1.00 55.68 O HETATM 2638 O HOH C 219 70.770 11.657 41.482 1.00 41.00 O HETATM 2639 O HOH C 223 42.948 21.997 24.240 1.00 65.38 O HETATM 2640 O HOH C 224 68.033 12.962 39.110 1.00 41.22 O HETATM 2641 O HOH C 233 70.773 15.606 25.038 1.00 53.17 O HETATM 2642 O HOH C 240 54.525 18.065 22.174 1.00 59.15 O HETATM 2643 O HOH C 243 74.214 12.563 28.411 1.00 54.78 O HETATM 2644 O HOH C 251 69.715 -2.027 31.064 1.00 50.44 O HETATM 2645 O HOH C 270 75.613 12.978 37.275 1.00 40.47 O HETATM 2646 O HOH C 277 75.399 18.227 40.507 1.00 55.28 O HETATM 2647 O HOH C 279 61.954 21.227 11.890 1.00 57.79 O HETATM 2648 O HOH C 280 71.221 5.419 41.968 1.00 33.55 O HETATM 2649 O HOH C 300 58.027 15.691 12.580 1.00 51.83 O HETATM 2650 O HOH C 303 76.534 17.032 36.886 1.00 51.05 O HETATM 2651 O HOH C 307 70.926 2.073 39.107 1.00 31.42 O HETATM 2652 O HOH C 308 69.780 0.982 37.024 0.50 25.45 O HETATM 2653 O HOH C 309 56.437 19.522 23.600 1.00 52.64 O HETATM 2654 O HOH C 315 44.184 27.831 21.729 1.00 39.73 O HETATM 2655 O HOH C 319 63.932 2.942 33.820 1.00 54.13 O HETATM 2656 O HOH C 321 73.798 16.417 27.896 1.00 56.18 O HETATM 2657 O HOH C 322 62.975 24.236 15.869 1.00 54.03 O HETATM 2658 O HOH C 323 67.815 10.274 39.594 1.00 45.54 O HETATM 2659 O HOH C 330 66.237 21.138 11.969 1.00 68.70 O HETATM 2660 O HOH C 337 67.553 11.211 37.391 1.00 39.36 O HETATM 2661 O HOH D 37 71.514 7.104 19.516 1.00 28.65 O HETATM 2662 O HOH D 40 71.104 2.450 28.600 1.00 28.22 O HETATM 2663 O HOH D 45 75.142 11.626 22.036 1.00 27.45 O HETATM 2664 O HOH D 47 76.786 10.352 28.406 1.00 24.74 O HETATM 2665 O HOH D 71 73.091 10.275 24.427 1.00 40.80 O HETATM 2666 O HOH D 74 58.637 23.982 35.315 1.00 37.37 O HETATM 2667 O HOH D 98 57.651 20.440 31.745 1.00 42.03 O HETATM 2668 O HOH D 114 60.200 29.203 27.605 1.00 40.42 O HETATM 2669 O HOH D 116 50.301 26.720 14.444 1.00 41.50 O HETATM 2670 O HOH D 128 48.899 29.743 6.730 1.00 32.40 O HETATM 2671 O HOH D 129 71.894 10.521 26.672 1.00 32.59 O HETATM 2672 O HOH D 137 52.654 28.564 8.228 1.00 39.07 O HETATM 2673 O HOH D 139 65.777 22.744 29.357 1.00 45.77 O HETATM 2674 O HOH D 140 54.409 32.003 20.897 1.00 47.44 O HETATM 2675 O HOH D 142 47.129 26.109 15.887 1.00 49.58 O HETATM 2676 O HOH D 163 54.872 33.033 18.441 1.00 30.26 O HETATM 2677 O HOH D 177 59.082 25.321 30.974 1.00 30.39 O HETATM 2678 O HOH D 180 63.003 7.668 32.796 1.00 55.48 O HETATM 2679 O HOH D 185 58.235 17.768 28.457 1.00 40.13 O HETATM 2680 O HOH D 186 57.121 27.249 9.747 1.00 44.44 O HETATM 2681 O HOH D 194 58.513 33.050 16.969 1.00 36.63 O HETATM 2682 O HOH D 207 65.360 19.355 32.939 1.00 39.99 O HETATM 2683 O HOH D 210 59.563 25.921 15.999 1.00 42.69 O HETATM 2684 O HOH D 216 84.695 6.662 20.185 1.00 42.93 O HETATM 2685 O HOH D 227 65.945 5.349 30.928 1.00 42.13 O HETATM 2686 O HOH D 235 55.051 30.011 22.422 1.00 43.24 O HETATM 2687 O HOH D 238 57.223 19.829 26.336 1.00 46.41 O HETATM 2688 O HOH D 244 82.784 10.579 20.738 1.00 47.13 O HETATM 2689 O HOH D 246 65.065 2.013 22.644 1.00 59.35 O HETATM 2690 O HOH D 254 56.239 28.553 24.921 1.00 56.93 O HETATM 2691 O HOH D 259 60.374 34.682 14.428 1.00 39.34 O HETATM 2692 O HOH D 260 58.705 34.198 12.529 1.00 43.20 O HETATM 2693 O HOH D 264 59.912 31.799 22.490 1.00 56.07 O HETATM 2694 O HOH D 306 65.075 24.980 35.052 1.00 54.99 O CONECT 2349 2350 2351 2352 CONECT 2350 2349 CONECT 2351 2349 CONECT 2352 2349 CONECT 2353 2354 2355 2356 CONECT 2354 2353 CONECT 2355 2353 CONECT 2356 2353 MASTER 496 0 2 10 8 0 3 6 2690 4 8 26 END
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Related entries of code: 3aaf
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3bep
RCSB PDB
PDBbind
14-mer
3lnq
RCSB PDB
PDBbind
14-mer
3lrn
RCSB PDB
PDBbind
14-mer
4z7l
RCSB PDB
PDBbind
14-mer
Entry Information
PDB ID
3aaf
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Werner syndrome ATP-dependent helicase, RQC domain
Ligand Name
14-mer
EC.Number
E.C.3.6.1.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=253nM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Structure Vol. 18: pp. 177-187
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):
Q14191
Entrez Gene ID
NCBI Entrez Gene ID:
7486
ASD
Information of known allosteric effects of PDB entries
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