Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION REGULATOR/DNA 11-DEC-14 4X9J TITLE EGR-1 WITH DOUBLY METHYLATED DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: EARLY GROWTH RESPONSE PROTEIN 1; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 335-423; COMPND 5 SYNONYM: EGR-1,AT225,NERVE GROWTH FACTOR-INDUCED PROTEIN A,NGFI-A, COMPND 6 TRANSCRIPTION FACTOR ETR103,TRANSCRIPTION FACTOR ZIF268,ZINC FINGER COMPND 7 PROTEIN 225,ZINC FINGER PROTEIN KROX-24; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 2; COMPND 10 MOLECULE: DNA (5'-D(*AP*GP*(5CM)P*GP*TP*GP*GP*GP*(5CM)P*GP*T)-3'); COMPND 11 CHAIN: B; COMPND 12 ENGINEERED: YES; COMPND 13 MOL_ID: 3; COMPND 14 MOLECULE: DNA (5'-D(*TP*AP*(5CM)P*GP*CP*CP*CP*AP*(5CM)P*GP*C)-3'); COMPND 15 CHAIN: C; COMPND 16 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: EGR1, KROX24, ZNF225; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 10 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 11 ORGANISM_TAXID: 32630; SOURCE 12 MOL_ID: 3; SOURCE 13 SYNTHETIC: YES; SOURCE 14 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 15 ORGANISM_TAXID: 32630 KEYWDS DNA BINDING, METHYLATED DNA, ZINC FINGER, TRANSCRIPTION, KEYWDS 2 TRANSCRIPTION REGULATOR-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR M.A.WHITE,L.ZANDARASHVILI,J.IWAHARA REVDAT 4 27-SEP-17 4X9J 1 SOURCE JRNL REMARK REVDAT 3 15-JUL-15 4X9J 1 JRNL REVDAT 2 03-JUN-15 4X9J 1 JRNL REVDAT 1 13-MAY-15 4X9J 0 JRNL AUTH L.ZANDARASHVILI,M.A.WHITE,A.ESADZE,J.IWAHARA JRNL TITL STRUCTURAL IMPACT OF COMPLETE CPG METHYLATION WITHIN TARGET JRNL TITL 2 DNA ON SPECIFIC COMPLEX FORMATION OF THE INDUCIBLE JRNL TITL 3 TRANSCRIPTION FACTOR EGR-1. JRNL REF FEBS LETT. V. 589 1748 2015 JRNL REFN ISSN 0014-5793 JRNL PMID 25999311 JRNL DOI 10.1016/J.FEBSLET.2015.05.022 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH H.HASHIMOTO,Y.O.OLANREWAJU,Y.ZHENG,G.G.WILSON,X.ZHANG, REMARK 1 AUTH 2 X.CHENG REMARK 1 TITL WILMS TUMOR PROTEIN RECOGNIZES 5-CARBOXYLCYTOSINE WITHIN A REMARK 1 TITL 2 SPECIFIC DNA SEQUENCE. REMARK 1 REF GENES DEV. V. 28 2304 2014 REMARK 1 REFN ISSN 1549-5477 REMARK 1 PMID 25258363 REMARK 1 DOI 10.1101/GAD.250746.114 REMARK 2 REMARK 2 RESOLUTION. 1.41 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: DEV_1810) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.41 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 27.36 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.370 REMARK 3 COMPLETENESS FOR RANGE (%) : 78.8 REMARK 3 NUMBER OF REFLECTIONS : 46626 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.174 REMARK 3 R VALUE (WORKING SET) : 0.172 REMARK 3 FREE R VALUE : 0.200 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 7.480 REMARK 3 FREE R VALUE TEST SET COUNT : 3489 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 27.3624 - 4.1238 0.97 2126 177 0.1453 0.1643 REMARK 3 2 4.1238 - 3.2749 0.99 2145 171 0.1467 0.1785 REMARK 3 3 3.2749 - 2.8615 1.00 2213 181 0.1756 0.2207 REMARK 3 4 2.8615 - 2.6001 1.00 2183 176 0.1842 0.2199 REMARK 3 5 2.6001 - 2.4138 1.00 2183 175 0.1775 0.2143 REMARK 3 6 2.4138 - 2.2716 1.00 2181 177 0.1626 0.1760 REMARK 3 7 2.2716 - 2.1579 1.00 2200 178 0.1646 0.1861 REMARK 3 8 2.1579 - 2.0640 1.00 2175 179 0.1755 0.2006 REMARK 3 9 2.0640 - 1.9845 1.00 2180 177 0.1752 0.1908 REMARK 3 10 1.9845 - 1.9161 1.00 2206 179 0.1905 0.2108 REMARK 3 11 1.9161 - 1.8562 1.00 2173 182 0.1824 0.2033 REMARK 3 12 1.8562 - 1.8031 1.00 2172 175 0.1766 0.2310 REMARK 3 13 1.8031 - 1.7557 1.00 2191 176 0.1801 0.1998 REMARK 3 14 1.7557 - 1.7128 0.98 2145 171 0.1749 0.2672 REMARK 3 15 1.7128 - 1.6739 0.96 2098 172 0.1871 0.1808 REMARK 3 16 1.6739 - 1.6383 0.96 2094 169 0.1847 0.2228 REMARK 3 17 1.6383 - 1.6055 0.90 1979 163 0.1921 0.2020 REMARK 3 18 1.6055 - 1.5752 0.79 1750 132 0.1904 0.2235 REMARK 3 19 1.5752 - 1.5471 0.67 1457 118 0.1966 0.2346 REMARK 3 20 1.5471 - 1.5209 0.50 1091 84 0.2256 0.2560 REMARK 3 21 1.5209 - 1.4963 0.37 816 66 0.2350 0.2356 REMARK 3 22 1.4963 - 1.4733 0.30 663 54 0.2466 0.2765 REMARK 3 23 1.4733 - 1.4517 0.21 464 37 0.2539 0.2572 REMARK 3 24 1.4517 - 1.4312 0.10 219 17 0.2704 0.3119 REMARK 3 25 1.4312 - 1.4119 0.01 33 3 0.3055 0.3441 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.130 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 21.460 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 10.75 REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.013 1283 REMARK 3 ANGLE : 1.338 1827 REMARK 3 CHIRALITY : 0.071 190 REMARK 3 PLANARITY : 0.032 163 REMARK 3 DIHEDRAL : 22.003 505 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 10 REMARK 3 TLS GROUP : 1 REMARK 3 SELECTION: (CHAIN A AND RESID 102:125) REMARK 3 ORIGIN FOR THE GROUP (A): 6.4181 -6.2665 -3.4961 REMARK 3 T TENSOR REMARK 3 T11: 0.2102 T22: 0.1615 REMARK 3 T33: 0.0661 T12: -0.0224 REMARK 3 T13: -0.0399 T23: -0.0193 REMARK 3 L TENSOR REMARK 3 L11: 0.0059 L22: 0.0089 REMARK 3 L33: 0.0101 L12: -0.0068 REMARK 3 L13: 0.0063 L23: -0.0086 REMARK 3 S TENSOR REMARK 3 S11: -0.0244 S12: -0.0201 S13: 0.0094 REMARK 3 S21: 0.0315 S22: 0.0029 S23: -0.0002 REMARK 3 S31: 0.0382 S32: 0.0191 S33: -0.0107 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: (CHAIN A AND RESID 126:133) REMARK 3 ORIGIN FOR THE GROUP (A): -5.5280 -2.5466 -5.0991 REMARK 3 T TENSOR REMARK 3 T11: 0.2525 T22: 0.2810 REMARK 3 T33: 0.1470 T12: -0.0512 REMARK 3 T13: -0.0103 T23: -0.0827 REMARK 3 L TENSOR REMARK 3 L11: 0.0011 L22: 0.0007 REMARK 3 L33: 0.0018 L12: -0.0003 REMARK 3 L13: 0.0013 L23: 0.0000 REMARK 3 S TENSOR REMARK 3 S11: -0.0025 S12: -0.0024 S13: 0.0014 REMARK 3 S21: -0.0037 S22: -0.0129 S23: 0.0056 REMARK 3 S31: -0.0044 S32: -0.0047 S33: -0.0000 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: (CHAIN A AND RESID 134:143) REMARK 3 ORIGIN FOR THE GROUP (A): -15.7982 -1.6767 -17.0065 REMARK 3 T TENSOR REMARK 3 T11: 0.1381 T22: 0.1949 REMARK 3 T33: 0.1460 T12: -0.0398 REMARK 3 T13: -0.0064 T23: -0.0740 REMARK 3 L TENSOR REMARK 3 L11: 0.0003 L22: 0.0011 REMARK 3 L33: 0.0005 L12: -0.0005 REMARK 3 L13: -0.0001 L23: 0.0002 REMARK 3 S TENSOR REMARK 3 S11: -0.0098 S12: 0.0066 S13: 0.0108 REMARK 3 S21: 0.0104 S22: -0.0106 S23: -0.0052 REMARK 3 S31: -0.0156 S32: -0.0056 S33: 0.0000 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: (CHAIN A AND RESID 144:166) REMARK 3 ORIGIN FOR THE GROUP (A): -9.8020 -10.5535 -24.3116 REMARK 3 T TENSOR REMARK 3 T11: 0.0907 T22: 0.1131 REMARK 3 T33: 0.0845 T12: -0.0293 REMARK 3 T13: 0.0013 T23: -0.0048 REMARK 3 L TENSOR REMARK 3 L11: 0.0018 L22: 0.0089 REMARK 3 L33: 0.0029 L12: -0.0001 REMARK 3 L13: -0.0012 L23: -0.0022 REMARK 3 S TENSOR REMARK 3 S11: 0.0134 S12: -0.0205 S13: 0.0415 REMARK 3 S21: -0.0069 S22: -0.0562 S23: -0.0088 REMARK 3 S31: -0.0440 S32: 0.0681 S33: -0.0097 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: (CHAIN A AND RESID 167:178) REMARK 3 ORIGIN FOR THE GROUP (A): -7.3987 -20.7040 -29.4115 REMARK 3 T TENSOR REMARK 3 T11: 0.0635 T22: 0.1171 REMARK 3 T33: 0.0730 T12: -0.0113 REMARK 3 T13: -0.0000 T23: -0.0006 REMARK 3 L TENSOR REMARK 3 L11: 0.0004 L22: 0.0009 REMARK 3 L33: 0.0008 L12: -0.0003 REMARK 3 L13: -0.0000 L23: -0.0001 REMARK 3 S TENSOR REMARK 3 S11: -0.0091 S12: 0.0117 S13: -0.0049 REMARK 3 S21: 0.0114 S22: -0.0188 S23: -0.0110 REMARK 3 S31: -0.0152 S32: 0.0097 S33: -0.0019 REMARK 3 TLS GROUP : 6 REMARK 3 SELECTION: (CHAIN A AND RESID 179:187) REMARK 3 ORIGIN FOR THE GROUP (A): -3.5278 -30.2563 -27.6462 REMARK 3 T TENSOR REMARK 3 T11: 0.0556 T22: 0.0904 REMARK 3 T33: 0.0800 T12: 0.0035 REMARK 3 T13: 0.0332 T23: 0.0110 REMARK 3 L TENSOR REMARK 3 L11: 0.0095 L22: 0.0112 REMARK 3 L33: 0.0062 L12: -0.0020 REMARK 3 L13: -0.0069 L23: -0.0002 REMARK 3 S TENSOR REMARK 3 S11: -0.0033 S12: -0.0084 S13: -0.0105 REMARK 3 S21: 0.0046 S22: -0.0137 S23: -0.0073 REMARK 3 S31: 0.0111 S32: 0.0106 S33: 0.0012 REMARK 3 TLS GROUP : 7 REMARK 3 SELECTION: (CHAIN B AND RESID 1:5) REMARK 3 ORIGIN FOR THE GROUP (A): -12.0992 -17.7784 -17.8239 REMARK 3 T TENSOR REMARK 3 T11: 0.1367 T22: 0.1164 REMARK 3 T33: 0.0960 T12: -0.1482 REMARK 3 T13: -0.0015 T23: 0.0047 REMARK 3 L TENSOR REMARK 3 L11: 0.0130 L22: 0.0016 REMARK 3 L33: 0.0018 L12: 0.0035 REMARK 3 L13: -0.0008 L23: -0.0014 REMARK 3 S TENSOR REMARK 3 S11: -0.0014 S12: -0.0100 S13: -0.0115 REMARK 3 S21: -0.0035 S22: -0.0056 S23: 0.0196 REMARK 3 S31: 0.0037 S32: 0.0003 S33: -0.0110 REMARK 3 TLS GROUP : 8 REMARK 3 SELECTION: (CHAIN B AND RESID 6:11) REMARK 3 ORIGIN FOR THE GROUP (A): 5.8325 -9.5535 -16.1096 REMARK 3 T TENSOR REMARK 3 T11: 0.1461 T22: 0.1111 REMARK 3 T33: 0.1365 T12: -0.1292 REMARK 3 T13: 0.0199 T23: 0.0372 REMARK 3 L TENSOR REMARK 3 L11: 0.0002 L22: 0.0011 REMARK 3 L33: 0.0060 L12: 0.0000 REMARK 3 L13: 0.0019 L23: -0.0018 REMARK 3 S TENSOR REMARK 3 S11: 0.0079 S12: -0.0278 S13: -0.0256 REMARK 3 S21: -0.0108 S22: -0.0013 S23: -0.0227 REMARK 3 S31: 0.0149 S32: -0.0111 S33: 0.0254 REMARK 3 TLS GROUP : 9 REMARK 3 SELECTION: (CHAIN C AND RESID 51:56) REMARK 3 ORIGIN FOR THE GROUP (A): 1.9398 -5.6107 -21.0824 REMARK 3 T TENSOR REMARK 3 T11: 0.1443 T22: 0.1010 REMARK 3 T33: 0.1127 T12: -0.1285 REMARK 3 T13: 0.0084 T23: -0.0215 REMARK 3 L TENSOR REMARK 3 L11: 0.0034 L22: 0.0083 REMARK 3 L33: 0.0075 L12: 0.0036 REMARK 3 L13: 0.0011 L23: -0.0036 REMARK 3 S TENSOR REMARK 3 S11: -0.0112 S12: -0.0029 S13: 0.0118 REMARK 3 S21: -0.0030 S22: -0.0139 S23: 0.0020 REMARK 3 S31: -0.0086 S32: 0.0056 S33: -0.0337 REMARK 3 TLS GROUP : 10 REMARK 3 SELECTION: (CHAIN C AND RESID 57:61) REMARK 3 ORIGIN FOR THE GROUP (A): -3.4961 -20.8602 -13.7105 REMARK 3 T TENSOR REMARK 3 T11: 0.1344 T22: 0.1201 REMARK 3 T33: 0.0946 T12: -0.1056 REMARK 3 T13: -0.0128 T23: 0.0360 REMARK 3 L TENSOR REMARK 3 L11: 0.0167 L22: 0.0121 REMARK 3 L33: 0.0004 L12: 0.0107 REMARK 3 L13: 0.0004 L23: -0.0004 REMARK 3 S TENSOR REMARK 3 S11: 0.0020 S12: -0.0158 S13: -0.0018 REMARK 3 S21: 0.0055 S22: -0.0056 S23: -0.0160 REMARK 3 S31: 0.0039 S32: 0.0001 S33: -0.0048 REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 4X9J COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 12-DEC-14. REMARK 100 THE DEPOSITION ID IS D_1000204827. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 02-NOV-14 REMARK 200 TEMPERATURE (KELVIN) : 90 REMARK 200 PH : 7-8 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 21-ID-F REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97872 REMARK 200 MONOCHROMATOR : SI DCM REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 29071 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.400 REMARK 200 RESOLUTION RANGE LOW (A) : 43.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 90.6 REMARK 200 DATA REDUNDANCY : 15.40 REMARK 200 R MERGE (I) : 0.12700 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 10.7000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.40 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.42 REMARK 200 COMPLETENESS FOR SHELL (%) : 46.0 REMARK 200 DATA REDUNDANCY IN SHELL : 5.70 REMARK 200 R MERGE FOR SHELL (I) : 0.65300 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHENIX REMARK 200 STARTING MODEL: PDB ENTRY 4R2A REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 47.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.32 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 25MM BISTRIS PH8, 10% PEG-600, 450MM REMARK 280 NACL, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 290K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 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 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z 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 64.47600 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 64.47600 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 22.00450 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 27.99450 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 22.00450 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 27.99450 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 64.47600 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 22.00450 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 27.99450 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 64.47600 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 22.00450 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 27.99450 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 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: TRIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C 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 642 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 GLN A 188 REMARK 465 LYS A 189 REMARK 465 ASP A 190 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 OP2 5CM B 3 O HOH B 132 1.99 REMARK 500 NH1 ARG A 178 O HOH A 601 2.13 REMARK 500 OP2 DC C 57 O HOH C 101 2.13 REMARK 500 OP2 DA C 58 O HOH C 146 2.15 REMARK 500 OE2 GLU A 177 O HOH A 691 2.16 REMARK 500 O HOH C 129 O HOH C 139 2.18 REMARK 500 OP1 DC C 56 O HOH C 102 2.18 REMARK 500 OP2 DG B 7 O HOH B 143 2.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS 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,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) 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 RES CSSEQI ATM2 DEVIATION REMARK 500 DG C 54 O3' DG C 54 C3' -0.062 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 DT B 5 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DT B 11 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DG C 54 O4' - C1' - N9 ANGL. DEV. = 3.3 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 501 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 107 SG REMARK 620 2 CYS A 112 SG 112.7 REMARK 620 3 HIS A 125 NE2 109.0 109.9 REMARK 620 4 HIS A 129 NE2 105.2 121.4 97.1 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 502 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 137 SG REMARK 620 2 CYS A 140 SG 114.9 REMARK 620 3 HIS A 153 NE2 108.7 108.4 REMARK 620 4 HIS A 157 NE2 111.5 111.1 101.2 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 503 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 165 SG REMARK 620 2 CYS A 168 SG 113.4 REMARK 620 3 HIS A 181 NE2 106.5 107.0 REMARK 620 4 HIS A 185 NE2 108.2 115.2 105.9 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 501 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 502 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 503 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4R2A RELATED DB: PDB REMARK 900 SAME PROTEIN WITH SINGLY METHYLATED DNA DBREF 4X9J A 102 190 UNP P18146 EGR1_HUMAN 335 423 DBREF 4X9J B 1 11 PDB 4X9J 4X9J 1 11 DBREF 4X9J C 51 61 PDB 4X9J 4X9J 1 11 SEQRES 1 A 89 GLU ARG PRO TYR ALA CYS PRO VAL GLU SER CYS ASP ARG SEQRES 2 A 89 ARG PHE SER ARG SER ASP GLU LEU THR ARG HIS ILE ARG SEQRES 3 A 89 ILE HIS THR GLY GLN LYS PRO PHE GLN CYS ARG ILE CYS SEQRES 4 A 89 MET ARG ASN PHE SER ARG SER ASP HIS LEU THR THR HIS SEQRES 5 A 89 ILE ARG THR HIS THR GLY GLU LYS PRO PHE ALA CYS ASP SEQRES 6 A 89 ILE CYS GLY ARG LYS PHE ALA ARG SER ASP GLU ARG LYS SEQRES 7 A 89 ARG HIS THR LYS ILE HIS LEU ARG GLN LYS ASP SEQRES 1 B 11 DA DG 5CM DG DT DG DG DG 5CM DG DT SEQRES 1 C 11 DT DA 5CM DG DC DC DC DA 5CM DG DC HET 5CM B 3 33 HET 5CM B 9 33 HET 5CM C 53 33 HET 5CM C 59 33 HET ZN A 501 1 HET ZN A 502 1 HET ZN A 503 1 HETNAM 5CM 5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE HETNAM ZN ZINC ION FORMUL 2 5CM 4(C10 H16 N3 O7 P) FORMUL 4 ZN 3(ZN 2+) FORMUL 7 HOH *208(H2 O) HELIX 1 AA1 ARG A 118 GLY A 131 1 14 HELIX 2 AA2 ARG A 146 GLY A 159 1 14 HELIX 3 AA3 ARG A 174 LYS A 183 1 10 HELIX 4 AA4 ILE A 184 LEU A 186 5 3 SHEET 1 AA1 2 TYR A 105 ALA A 106 0 SHEET 2 AA1 2 ARG A 115 PHE A 116 -1 O PHE A 116 N TYR A 105 SHEET 1 AA2 2 PHE A 135 GLN A 136 0 SHEET 2 AA2 2 ASN A 143 PHE A 144 -1 O PHE A 144 N PHE A 135 SHEET 1 AA3 2 PHE A 163 ALA A 164 0 SHEET 2 AA3 2 LYS A 171 PHE A 172 -1 O PHE A 172 N PHE A 163 LINK SG CYS A 107 ZN ZN A 501 1555 1555 2.28 LINK SG CYS A 112 ZN ZN A 501 1555 1555 2.30 LINK NE2 HIS A 125 ZN ZN A 501 1555 1555 2.03 LINK NE2 HIS A 129 ZN ZN A 501 1555 1555 1.91 LINK SG CYS A 137 ZN ZN A 502 1555 1555 2.34 LINK SG CYS A 140 ZN ZN A 502 1555 1555 2.29 LINK NE2 HIS A 153 ZN ZN A 502 1555 1555 2.07 LINK NE2 HIS A 157 ZN ZN A 502 1555 1555 2.04 LINK SG CYS A 165 ZN ZN A 503 1555 1555 2.35 LINK SG CYS A 168 ZN ZN A 503 1555 1555 2.29 LINK NE2 HIS A 181 ZN ZN A 503 1555 1555 2.03 LINK NE2 HIS A 185 ZN ZN A 503 1555 1555 2.01 LINK O3' DG B 2 P 5CM B 3 1555 1555 1.60 LINK O3' 5CM B 3 P DG B 4 1555 1555 1.59 LINK O3' DG B 8 P 5CM B 9 1555 1555 1.60 LINK O3' 5CM B 9 P DG B 10 1555 1555 1.59 LINK O3' DA C 52 P 5CM C 53 1555 1555 1.61 LINK O3' 5CM C 53 P DG C 54 1555 1555 1.58 LINK O3' DA C 58 P 5CM C 59 1555 1555 1.60 LINK O3' 5CM C 59 P DG C 60 1555 1555 1.60 SITE 1 AC1 4 CYS A 107 CYS A 112 HIS A 125 HIS A 129 SITE 1 AC2 4 CYS A 137 CYS A 140 HIS A 153 HIS A 157 SITE 1 AC3 4 CYS A 165 CYS A 168 HIS A 181 HIS A 185 CRYST1 44.009 55.989 128.952 90.00 90.00 90.00 C 2 2 21 8 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 0.022723 0.000000 0.000000 0.00000 SCALE2 0.000000 0.017861 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007755 0.00000 ATOM 1 N GLU A 102 17.237 -10.574 -6.996 1.00 74.53 N ANISOU 1 N GLU A 102 10047 9626 8644 -142 -403 -130 N ATOM 2 CA GLU A 102 16.788 -10.149 -5.676 1.00 74.08 C ANISOU 2 CA GLU A 102 9991 9569 8585 -141 -403 -135 C ATOM 3 C GLU A 102 15.430 -9.453 -5.761 1.00 70.82 C ANISOU 3 C GLU A 102 9575 9152 8180 -152 -402 -142 C ATOM 4 O GLU A 102 15.022 -9.005 -6.835 1.00 67.32 O ANISOU 4 O GLU A 102 9124 8707 7746 -161 -403 -143 O ATOM 5 CB GLU A 102 17.819 -9.205 -5.047 1.00 73.81 C ANISOU 5 CB GLU A 102 9946 9544 8553 -134 -415 -136 C ATOM 6 CG GLU A 102 17.489 -8.777 -3.623 1.00 75.33 C ANISOU 6 CG GLU A 102 10142 9738 8743 -132 -416 -140 C ATOM 7 CD GLU A 102 17.255 -9.961 -2.695 1.00 80.30 C ANISOU 7 CD GLU A 102 10787 10363 9359 -125 -406 -139 C ATOM 8 OE1 GLU A 102 18.191 -10.771 -2.512 1.00 80.52 O ANISOU 8 OE1 GLU A 102 10821 10392 9379 -116 -405 -133 O ATOM 9 OE2 GLU A 102 16.131 -10.085 -2.156 1.00 79.85 O ANISOU 9 OE2 GLU A 102 10737 10301 9301 -130 -400 -144 O ATOM 10 HA GLU A 102 16.697 -10.926 -5.103 1.00 88.89 H ATOM 11 HB2 GLU A 102 18.679 -9.653 -5.029 1.00 88.57 H ATOM 12 HB3 GLU A 102 17.878 -8.404 -5.590 1.00 88.57 H ATOM 13 HG2 GLU A 102 18.229 -8.259 -3.269 1.00 90.40 H ATOM 14 HG3 GLU A 102 16.682 -8.239 -3.633 1.00 90.40 H ATOM 15 N ARG A 103 14.739 -9.373 -4.624 1.00 63.02 N ANISOU 15 N ARG A 103 8593 8163 7189 -152 -399 -147 N ATOM 16 CA ARG A 103 13.447 -8.695 -4.533 1.00 43.01 C ANISOU 16 CA ARG A 103 6056 5625 4662 -162 -397 -154 C ATOM 17 C ARG A 103 13.485 -7.605 -3.476 1.00 34.16 C ANISOU 17 C ARG A 103 4927 4509 3544 -160 -405 -159 C ATOM 18 O ARG A 103 12.952 -7.769 -2.388 1.00 36.21 O ANISOU 18 O ARG A 103 5195 4767 3798 -158 -401 -162 O ATOM 19 CB ARG A 103 12.350 -9.695 -4.187 1.00 34.93 C ANISOU 19 CB ARG A 103 5047 4593 3631 -165 -384 -155 C ATOM 20 CG ARG A 103 12.195 -10.796 -5.198 1.00 39.97 C ANISOU 20 CG ARG A 103 5694 5226 4267 -167 -376 -150 C ATOM 21 CD ARG A 103 10.781 -11.317 -5.159 1.00 45.01 C ANISOU 21 CD ARG A 103 6342 5856 4905 -174 -365 -153 C ATOM 22 NE ARG A 103 10.709 -12.745 -5.427 1.00 54.78 N ANISOU 22 NE ARG A 103 7593 7088 6133 -172 -355 -148 N ATOM 23 CZ ARG A 103 9.572 -13.421 -5.560 1.00 65.69 C ANISOU 23 CZ ARG A 103 8985 8462 7513 -178 -344 -150 C ATOM 24 NH1 ARG A 103 8.405 -12.790 -5.457 1.00 64.11 N ANISOU 24 NH1 ARG A 103 8781 8258 7319 -187 -343 -155 N ATOM 25 NH2 ARG A 103 9.603 -14.728 -5.804 1.00 72.90 N ANISOU 25 NH2 ARG A 103 9911 9371 8419 -174 -335 -145 N ATOM 26 H ARG A 103 15.003 -9.710 -3.878 1.00 75.62 H ATOM 27 HA ARG A 103 13.235 -8.288 -5.387 1.00 51.62 H ATOM 28 HB2 ARG A 103 12.557 -10.104 -3.332 1.00 41.92 H ATOM 29 HB3 ARG A 103 11.504 -9.224 -4.130 1.00 41.92 H ATOM 30 HG2 ARG A 103 12.375 -10.451 -6.086 1.00 47.96 H ATOM 31 HG3 ARG A 103 12.799 -11.524 -4.984 1.00 47.96 H ATOM 32 HD2 ARG A 103 10.407 -11.156 -4.279 1.00 54.02 H ATOM 33 HD3 ARG A 103 10.255 -10.857 -5.833 1.00 54.02 H ATOM 34 HE ARG A 103 11.445 -13.188 -5.449 1.00 65.73 H ATOM 35 HH11 ARG A 103 8.386 -11.945 -5.300 1.00 76.93 H ATOM 36 HH12 ARG A 103 7.670 -13.228 -5.545 1.00 76.93 H ATOM 37 HH21 ARG A 103 10.358 -15.135 -5.872 1.00 87.49 H ATOM 38 HH22 ARG A 103 8.869 -15.167 -5.892 1.00 87.49 H ATOM 39 N PRO A 104 14.110 -6.475 -3.796 1.00 28.90 N ANISOU 39 N PRO A 104 4246 3849 2887 -161 -416 -160 N ATOM 40 CA PRO A 104 14.272 -5.418 -2.794 1.00 37.72 C ANISOU 40 CA PRO A 104 5354 4970 4006 -159 -424 -164 C ATOM 41 C PRO A 104 12.977 -4.698 -2.413 1.00 39.72 C ANISOU 41 C PRO A 104 5605 5221 4266 -167 -422 -171 C ATOM 42 O PRO A 104 12.985 -3.993 -1.410 1.00 34.68 O ANISOU 42 O PRO A 104 4963 4585 3627 -164 -427 -175 O ATOM 43 CB PRO A 104 15.248 -4.445 -3.470 1.00 37.55 C ANISOU 43 CB PRO A 104 5316 4956 3994 -158 -436 -162 C ATOM 44 CG PRO A 104 15.091 -4.683 -4.904 1.00 32.62 C ANISOU 44 CG PRO A 104 4690 4329 3376 -165 -433 -160 C ATOM 45 CD PRO A 104 14.723 -6.120 -5.083 1.00 27.76 C ANISOU 45 CD PRO A 104 4091 3708 2751 -164 -422 -156 C ATOM 46 HA PRO A 104 14.684 -5.777 -1.993 1.00 45.26 H ATOM 47 HB2 PRO A 104 15.008 -3.533 -3.245 1.00 45.06 H ATOM 48 HB3 PRO A 104 16.154 -4.642 -3.186 1.00 45.06 H ATOM 49 HG2 PRO A 104 14.388 -4.110 -5.248 1.00 39.15 H ATOM 50 HG3 PRO A 104 15.930 -4.492 -5.353 1.00 39.15 H ATOM 51 HD2 PRO A 104 14.079 -6.218 -5.802 1.00 33.32 H ATOM 52 HD3 PRO A 104 15.516 -6.656 -5.239 1.00 33.32 H ATOM 53 N TYR A 105 11.900 -4.868 -3.183 1.00 39.14 N ANISOU 53 N TYR A 105 5533 5141 4197 -177 -416 -173 N ATOM 54 CA TYR A 105 10.673 -4.087 -2.974 1.00 28.67 C ANISOU 54 CA TYR A 105 4203 3812 2879 -186 -415 -180 C ATOM 55 C TYR A 105 9.612 -4.854 -2.191 1.00 26.18 C ANISOU 55 C TYR A 105 3903 3491 2555 -187 -404 -182 C ATOM 56 O TYR A 105 8.886 -5.665 -2.751 1.00 25.22 O ANISOU 56 O TYR A 105 3789 3362 2431 -192 -395 -181 O ATOM 57 CB TYR A 105 10.101 -3.636 -4.319 1.00 19.76 C ANISOU 57 CB TYR A 105 3066 2681 1762 -196 -415 -181 C ATOM 58 CG TYR A 105 11.073 -2.798 -5.089 1.00 17.64 C ANISOU 58 CG TYR A 105 2781 2419 1502 -196 -426 -179 C ATOM 59 CD1 TYR A 105 11.225 -1.448 -4.815 1.00 22.06 C ANISOU 59 CD1 TYR A 105 3327 2984 2071 -197 -435 -183 C ATOM 60 CD2 TYR A 105 11.846 -3.356 -6.093 1.00 23.40 C ANISOU 60 CD2 TYR A 105 3510 3149 2230 -194 -426 -173 C ATOM 61 CE1 TYR A 105 12.117 -0.675 -5.526 1.00 27.33 C ANISOU 61 CE1 TYR A 105 3979 3656 2747 -196 -445 -182 C ATOM 62 CE2 TYR A 105 12.739 -2.588 -6.810 1.00 23.61 C ANISOU 62 CE2 TYR A 105 3523 3181 2266 -194 -436 -171 C ATOM 63 CZ TYR A 105 12.874 -1.257 -6.523 1.00 24.40 C ANISOU 63 CZ TYR A 105 3608 3286 2375 -195 -445 -175 C ATOM 64 OH TYR A 105 13.769 -0.490 -7.239 1.00 37.79 O ANISOU 64 OH TYR A 105 5290 4988 4080 -194 -454 -173 O ATOM 65 H TYR A 105 11.852 -5.428 -3.833 1.00 46.96 H ATOM 66 HA TYR A 105 10.895 -3.291 -2.466 1.00 34.41 H ATOM 67 HB2 TYR A 105 9.887 -4.418 -4.852 1.00 23.72 H ATOM 68 HB3 TYR A 105 9.302 -3.108 -4.165 1.00 23.72 H ATOM 69 HD1 TYR A 105 10.714 -1.057 -4.144 1.00 26.47 H ATOM 70 HD2 TYR A 105 11.757 -4.260 -6.292 1.00 28.07 H ATOM 71 HE1 TYR A 105 12.211 0.230 -5.335 1.00 32.79 H ATOM 72 HE2 TYR A 105 13.252 -2.974 -7.482 1.00 28.33 H ATOM 73 HH TYR A 105 14.161 -0.964 -7.811 1.00 45.35 H ATOM 74 N ALA A 106 9.511 -4.582 -0.894 1.00 28.04 N ANISOU 74 N ALA A 106 4140 3728 2786 -182 -405 -186 N ATOM 75 CA ALA A 106 8.627 -5.359 -0.028 1.00 25.07 C ANISOU 75 CA ALA A 106 3779 3346 2401 -181 -395 -187 C ATOM 76 C ALA A 106 7.266 -4.712 0.111 1.00 21.20 C ANISOU 76 C ALA A 106 3286 2852 1918 -191 -393 -194 C ATOM 77 O ALA A 106 7.156 -3.476 0.108 1.00 22.76 O ANISOU 77 O ALA A 106 3470 3053 2125 -194 -401 -198 O ATOM 78 CB ALA A 106 9.259 -5.526 1.339 1.00 32.92 C ANISOU 78 CB ALA A 106 4779 4344 3386 -171 -397 -187 C ATOM 79 H ALA A 106 9.942 -3.956 -0.491 1.00 33.65 H ATOM 80 HA ALA A 106 8.502 -6.241 -0.412 1.00 30.08 H ATOM 81 HB1 ALA A 106 8.661 -6.042 1.901 1.00 39.51 H ATOM 82 HB2 ALA A 106 10.105 -5.990 1.240 1.00 39.51 H ATOM 83 HB3 ALA A 106 9.405 -4.649 1.728 1.00 39.51 H ATOM 84 N CYS A 107 6.225 -5.530 0.226 1.00 20.72 N ANISOU 84 N CYS A 107 3236 2784 1851 -195 -382 -194 N ATOM 85 CA CYS A 107 4.896 -4.978 0.431 1.00 16.55 C ANISOU 85 CA CYS A 107 2707 2252 1329 -203 -379 -200 C ATOM 86 C CYS A 107 4.782 -4.490 1.873 1.00 23.07 C ANISOU 86 C CYS A 107 3533 3080 2151 -198 -381 -205 C ATOM 87 O CYS A 107 5.083 -5.243 2.805 1.00 19.30 O ANISOU 87 O CYS A 107 3067 2603 1662 -190 -377 -203 O ATOM 88 CB CYS A 107 3.799 -5.984 0.144 1.00 19.57 C ANISOU 88 CB CYS A 107 3101 2626 1708 -209 -366 -200 C ATOM 89 SG CYS A 107 2.172 -5.240 0.402 1.00 20.31 S ANISOU 89 SG CYS A 107 3192 2716 1809 -220 -363 -207 S ATOM 90 H CYS A 107 6.261 -6.388 0.189 1.00 24.86 H ATOM 91 HA CYS A 107 4.771 -4.218 -0.158 1.00 19.86 H ATOM 92 HB2 CYS A 107 3.861 -6.275 -0.779 1.00 23.48 H ATOM 93 HB3 CYS A 107 3.890 -6.740 0.745 1.00 23.48 H ATOM 94 N PRO A 108 4.369 -3.221 2.073 1.00 17.56 N ANISOU 94 N PRO A 108 2823 2385 1462 -203 -387 -210 N ATOM 95 CA PRO A 108 4.335 -2.681 3.444 1.00 15.15 C ANISOU 95 CA PRO A 108 2518 2083 1154 -197 -391 -214 C ATOM 96 C PRO A 108 3.087 -2.989 4.251 1.00 25.19 C ANISOU 96 C PRO A 108 3801 3350 2422 -200 -382 -218 C ATOM 97 O PRO A 108 2.989 -2.597 5.417 1.00 24.14 O ANISOU 97 O PRO A 108 3668 3219 2285 -196 -384 -221 O ATOM 98 CB PRO A 108 4.434 -1.170 3.215 1.00 21.32 C ANISOU 98 CB PRO A 108 3282 2869 1948 -201 -402 -219 C ATOM 99 CG PRO A 108 3.778 -0.966 1.893 1.00 22.61 C ANISOU 99 CG PRO A 108 3439 3029 2122 -212 -400 -219 C ATOM 100 CD PRO A 108 4.176 -2.158 1.071 1.00 20.41 C ANISOU 100 CD PRO A 108 3169 2747 1838 -211 -394 -213 C ATOM 101 HA PRO A 108 5.115 -2.978 3.939 1.00 18.18 H ATOM 102 HB2 PRO A 108 3.957 -0.697 3.915 1.00 25.58 H ATOM 103 HB3 PRO A 108 5.365 -0.900 3.185 1.00 25.58 H ATOM 104 HG2 PRO A 108 2.815 -0.934 2.007 1.00 27.13 H ATOM 105 HG3 PRO A 108 4.104 -0.146 1.489 1.00 27.13 H ATOM 106 HD2 PRO A 108 3.464 -2.398 0.457 1.00 24.49 H ATOM 107 HD3 PRO A 108 5.006 -1.982 0.601 1.00 24.49 H ATOM 108 N VAL A 109 2.139 -3.676 3.650 1.00 20.80 N ANISOU 108 N VAL A 109 3251 2787 1865 -207 -372 -217 N ATOM 109 CA VAL A 109 0.943 -4.090 4.372 1.00 28.28 C ANISOU 109 CA VAL A 109 4209 3729 2808 -210 -363 -220 C ATOM 110 C VAL A 109 1.263 -5.246 5.330 1.00 33.90 C ANISOU 110 C VAL A 109 4936 4440 3505 -201 -356 -217 C ATOM 111 O VAL A 109 1.963 -6.195 4.976 1.00 36.27 O ANISOU 111 O VAL A 109 5242 4739 3798 -196 -353 -211 O ATOM 112 CB VAL A 109 -0.174 -4.453 3.381 1.00 22.82 C ANISOU 112 CB VAL A 109 3519 3031 2121 -221 -355 -220 C ATOM 113 CG1 VAL A 109 -1.438 -4.843 4.119 1.00 28.68 C ANISOU 113 CG1 VAL A 109 4271 3767 2858 -224 -345 -223 C ATOM 114 CG2 VAL A 109 -0.415 -3.294 2.479 1.00 24.28 C ANISOU 114 CG2 VAL A 109 3688 3217 2321 -230 -362 -224 C ATOM 115 H VAL A 109 2.157 -3.918 2.825 1.00 24.96 H ATOM 116 HA VAL A 109 0.630 -3.343 4.906 1.00 33.94 H ATOM 117 HB VAL A 109 0.109 -5.207 2.840 1.00 27.39 H ATOM 118 HG11 VAL A 109 -2.125 -5.067 3.472 1.00 34.41 H ATOM 119 HG12 VAL A 109 -1.251 -5.610 4.682 1.00 34.41 H ATOM 120 HG13 VAL A 109 -1.729 -4.095 4.664 1.00 34.41 H ATOM 121 HG21 VAL A 109 -1.120 -3.523 1.853 1.00 29.14 H ATOM 122 HG22 VAL A 109 -0.682 -2.529 3.012 1.00 29.14 H ATOM 123 HG23 VAL A 109 0.403 -3.094 1.997 1.00 29.14 H ATOM 124 N GLU A 110 0.721 -5.154 6.545 1.00 46.78 N ANISOU 124 N GLU A 110 6573 6071 5132 -198 -354 -220 N ATOM 125 CA GLU A 110 1.180 -5.950 7.699 1.00 54.24 C ANISOU 125 CA GLU A 110 7529 7017 6063 -187 -350 -218 C ATOM 126 C GLU A 110 1.101 -7.448 7.477 1.00 47.70 C ANISOU 126 C GLU A 110 6715 6182 5225 -185 -339 -212 C ATOM 127 O GLU A 110 2.068 -8.175 7.700 1.00 44.86 O ANISOU 127 O GLU A 110 6361 5824 4858 -177 -339 -208 O ATOM 128 CB GLU A 110 0.369 -5.630 8.968 1.00 57.67 C ANISOU 128 CB GLU A 110 7967 7450 6493 -186 -347 -223 C ATOM 129 CG GLU A 110 -0.025 -4.176 9.149 1.00 60.08 C ANISOU 129 CG GLU A 110 8260 7759 6810 -191 -356 -229 C ATOM 130 CD GLU A 110 -1.245 -3.794 8.328 1.00 58.52 C ANISOU 130 CD GLU A 110 8057 7556 6621 -203 -352 -232 C ATOM 131 OE1 GLU A 110 -1.135 -2.840 7.538 1.00 50.90 O ANISOU 131 OE1 GLU A 110 7079 6594 5667 -209 -360 -234 O ATOM 132 OE2 GLU A 110 -2.298 -4.454 8.454 1.00 65.85 O ANISOU 132 OE2 GLU A 110 8995 8478 7545 -208 -342 -233 O ATOM 133 H GLU A 110 0.070 -4.625 6.736 1.00 56.14 H ATOM 134 HA GLU A 110 2.107 -5.728 7.878 1.00 65.09 H ATOM 135 HB2 GLU A 110 -0.448 -6.152 8.948 1.00 69.20 H ATOM 136 HB3 GLU A 110 0.897 -5.885 9.741 1.00 69.20 H ATOM 137 HG2 GLU A 110 -0.231 -4.018 10.083 1.00 72.10 H ATOM 138 HG3 GLU A 110 0.713 -3.611 8.871 1.00 72.10 H ATOM 139 N SER A 111 -0.063 -7.904 7.037 1.00 48.83 N ANISOU 139 N SER A 111 6864 6319 5370 -194 -330 -213 N ATOM 140 CA SER A 111 -0.326 -9.329 6.880 1.00 56.41 C ANISOU 140 CA SER A 111 7839 7273 6322 -193 -318 -208 C ATOM 141 C SER A 111 0.474 -9.945 5.732 1.00 56.33 C ANISOU 141 C SER A 111 7828 7262 6313 -192 -318 -203 C ATOM 142 O SER A 111 0.399 -11.156 5.497 1.00 52.36 O ANISOU 142 O SER A 111 7337 6755 5804 -191 -309 -198 O ATOM 143 CB SER A 111 -1.818 -9.539 6.620 1.00 57.56 C ANISOU 143 CB SER A 111 7989 7411 6471 -203 -309 -211 C ATOM 144 OG SER A 111 -2.507 -8.301 6.638 1.00 56.37 O ANISOU 144 OG SER A 111 7827 7262 6330 -210 -314 -217 O ATOM 145 H SER A 111 -0.727 -7.402 6.820 1.00 58.60 H ATOM 146 HA SER A 111 -0.090 -9.791 7.700 1.00 67.70 H ATOM 147 HB2 SER A 111 -1.932 -9.953 5.750 1.00 69.07 H ATOM 148 HB3 SER A 111 -2.181 -10.114 7.312 1.00 69.07 H ATOM 149 HG SER A 111 -3.325 -8.426 6.495 1.00 67.65 H ATOM 150 N CYS A 112 1.246 -9.110 5.038 1.00 51.47 N ANISOU 150 N CYS A 112 7200 6652 5705 -193 -329 -203 N ATOM 151 CA CYS A 112 1.823 -9.468 3.752 1.00 41.95 C ANISOU 151 CA CYS A 112 5991 5446 4502 -195 -330 -198 C ATOM 152 C CYS A 112 3.345 -9.486 3.774 1.00 35.34 C ANISOU 152 C CYS A 112 5150 4614 3661 -185 -338 -194 C ATOM 153 O CYS A 112 3.986 -8.506 4.141 1.00 36.45 O ANISOU 153 O CYS A 112 5281 4762 3806 -182 -348 -196 O ATOM 154 CB CYS A 112 1.345 -8.463 2.705 1.00 38.63 C ANISOU 154 CB CYS A 112 5558 5025 4096 -206 -335 -202 C ATOM 155 SG CYS A 112 1.652 -8.965 1.035 1.00 34.47 S ANISOU 155 SG CYS A 112 5029 4496 3574 -211 -334 -197 S ATOM 156 H CYS A 112 1.452 -8.317 5.300 1.00 61.76 H ATOM 157 HA CYS A 112 1.511 -10.349 3.494 1.00 50.34 H ATOM 158 HB2 CYS A 112 0.388 -8.338 2.806 1.00 46.36 H ATOM 159 HB3 CYS A 112 1.803 -7.620 2.850 1.00 46.36 H ATOM 160 N ASP A 113 3.918 -10.599 3.331 1.00 46.98 N ANISOU 160 N ASP A 113 6633 6087 5130 -181 -333 -188 N ATOM 161 CA ASP A 113 5.371 -10.762 3.281 1.00 52.29 C ANISOU 161 CA ASP A 113 7303 6765 5798 -171 -339 -183 C ATOM 162 C ASP A 113 5.882 -10.843 1.837 1.00 47.57 C ANISOU 162 C ASP A 113 6700 6167 5206 -175 -342 -180 C ATOM 163 O ASP A 113 7.007 -11.287 1.592 1.00 45.32 O ANISOU 163 O ASP A 113 6415 5886 4918 -168 -344 -175 O ATOM 164 CB ASP A 113 5.784 -12.016 4.059 1.00 62.72 C ANISOU 164 CB ASP A 113 8639 8085 7107 -161 -331 -179 C ATOM 165 CG ASP A 113 4.862 -13.196 3.800 1.00 70.21 C ANISOU 165 CG ASP A 113 9601 9026 8051 -165 -318 -177 C ATOM 166 OD1 ASP A 113 4.185 -13.216 2.748 1.00 69.05 O ANISOU 166 OD1 ASP A 113 9452 8874 7911 -175 -315 -177 O ATOM 167 OD2 ASP A 113 4.812 -14.104 4.656 1.00 76.21 O ANISOU 167 OD2 ASP A 113 10372 9782 8800 -159 -311 -175 O ATOM 168 H ASP A 113 3.482 -11.285 3.050 1.00 56.38 H ATOM 169 HA ASP A 113 5.789 -9.995 3.703 1.00 62.74 H ATOM 170 HB2 ASP A 113 6.681 -12.272 3.793 1.00 75.26 H ATOM 171 HB3 ASP A 113 5.763 -11.820 5.009 1.00 75.26 H ATOM 172 N ARG A 114 5.054 -10.408 0.888 1.00 30.30 N ANISOU 172 N ARG A 114 4506 3977 3029 -186 -341 -182 N ATOM 173 CA ARG A 114 5.424 -10.442 -0.521 1.00 25.58 C ANISOU 173 CA ARG A 114 3903 3379 2437 -190 -343 -179 C ATOM 174 C ARG A 114 6.548 -9.458 -0.807 1.00 27.32 C ANISOU 174 C ARG A 114 4109 3607 2664 -187 -356 -179 C ATOM 175 O ARG A 114 6.634 -8.383 -0.193 1.00 25.51 O ANISOU 175 O ARG A 114 3871 3383 2439 -187 -364 -183 O ATOM 176 CB ARG A 114 4.222 -10.123 -1.414 1.00 26.24 C ANISOU 176 CB ARG A 114 3983 3458 2530 -203 -340 -183 C ATOM 177 CG ARG A 114 3.037 -11.076 -1.276 1.00 37.44 C ANISOU 177 CG ARG A 114 5413 4867 3943 -208 -327 -183 C ATOM 178 CD ARG A 114 3.395 -12.501 -1.665 1.00 37.85 C ANISOU 178 CD ARG A 114 5478 4915 3987 -203 -319 -176 C ATOM 179 NE ARG A 114 4.055 -12.551 -2.963 1.00 37.54 N ANISOU 179 NE ARG A 114 5433 4877 3952 -205 -322 -173 N ATOM 180 CZ ARG A 114 3.424 -12.407 -4.122 1.00 41.57 C ANISOU 180 CZ ARG A 114 5939 5384 4472 -215 -321 -173 C ATOM 181 NH1 ARG A 114 2.115 -12.200 -4.137 1.00 43.24 N ANISOU 181 NH1 ARG A 114 6151 5590 4687 -225 -315 -178 N ATOM 182 NH2 ARG A 114 4.100 -12.472 -5.264 1.00 42.71 N ANISOU 182 NH2 ARG A 114 6079 5530 4620 -216 -324 -170 N ATOM 183 H ARG A 114 4.270 -10.087 1.038 1.00 36.36 H ATOM 184 HA ARG A 114 5.738 -11.332 -0.745 1.00 30.70 H ATOM 185 HB2 ARG A 114 3.907 -9.232 -1.199 1.00 31.49 H ATOM 186 HB3 ARG A 114 4.511 -10.150 -2.340 1.00 31.49 H ATOM 187 HG2 ARG A 114 2.740 -11.081 -0.352 1.00 44.92 H ATOM 188 HG3 ARG A 114 2.319 -10.776 -1.856 1.00 44.92 H ATOM 189 HD2 ARG A 114 3.999 -12.871 -1.002 1.00 45.42 H ATOM 190 HD3 ARG A 114 2.585 -13.032 -1.715 1.00 45.42 H ATOM 191 HE ARG A 114 4.890 -12.754 -2.982 1.00 45.04 H ATOM 192 HH11 ARG A 114 1.678 -12.160 -3.397 1.00 51.88 H ATOM 193 HH12 ARG A 114 1.703 -12.106 -4.886 1.00 51.88 H ATOM 194 HH21 ARG A 114 4.949 -12.605 -5.255 1.00 51.26 H ATOM 195 HH22 ARG A 114 3.688 -12.376 -6.013 1.00 51.26 H ATOM 196 N ARG A 115 7.419 -9.841 -1.738 1.00 23.67 N ANISOU 196 N ARG A 115 3645 3146 2201 -185 -358 -174 N ATOM 197 CA ARG A 115 8.507 -8.982 -2.190 1.00 21.00 C ANISOU 197 CA ARG A 115 3293 2815 1870 -182 -370 -172 C ATOM 198 C ARG A 115 8.547 -9.010 -3.721 1.00 23.20 C ANISOU 198 C ARG A 115 3566 3092 2155 -189 -370 -170 C ATOM 199 O ARG A 115 7.978 -9.918 -4.332 1.00 35.80 O ANISOU 199 O ARG A 115 5171 4682 3750 -193 -361 -168 O ATOM 200 CB ARG A 115 9.851 -9.444 -1.628 1.00 33.96 C ANISOU 200 CB ARG A 115 4938 4462 3502 -170 -373 -168 C ATOM 201 CG ARG A 115 9.856 -9.693 -0.135 1.00 39.80 C ANISOU 201 CG ARG A 115 5686 5203 4233 -162 -371 -169 C ATOM 202 CD ARG A 115 11.273 -9.963 0.368 1.00 40.36 C ANISOU 202 CD ARG A 115 5758 5280 4296 -150 -376 -164 C ATOM 203 NE ARG A 115 12.073 -8.744 0.403 1.00 42.97 N ANISOU 203 NE ARG A 115 6074 5618 4635 -148 -389 -166 N ATOM 204 CZ ARG A 115 12.057 -7.867 1.404 1.00 41.25 C ANISOU 204 CZ ARG A 115 5851 5404 4418 -146 -394 -170 C ATOM 205 NH1 ARG A 115 11.279 -8.076 2.464 1.00 44.29 N ANISOU 205 NH1 ARG A 115 6244 5786 4798 -146 -389 -174 N ATOM 206 NH2 ARG A 115 12.814 -6.777 1.343 1.00 36.40 N ANISOU 206 NH2 ARG A 115 5223 4797 3811 -145 -406 -171 N ATOM 207 H ARG A 115 7.399 -10.607 -2.128 1.00 28.40 H ATOM 208 HA ARG A 115 8.346 -8.070 -1.900 1.00 25.20 H ATOM 209 HB2 ARG A 115 10.102 -10.273 -2.065 1.00 40.75 H ATOM 210 HB3 ARG A 115 10.516 -8.763 -1.814 1.00 40.75 H ATOM 211 HG2 ARG A 115 9.513 -8.910 0.323 1.00 47.76 H ATOM 212 HG3 ARG A 115 9.308 -10.468 0.064 1.00 47.76 H ATOM 213 HD2 ARG A 115 11.229 -10.323 1.268 1.00 48.43 H ATOM 214 HD3 ARG A 115 11.708 -10.595 -0.226 1.00 48.43 H ATOM 215 HE ARG A 115 12.609 -8.595 -0.253 1.00 51.56 H ATOM 216 HH11 ARG A 115 10.786 -8.779 2.504 1.00 53.15 H ATOM 217 HH12 ARG A 115 11.271 -7.508 3.110 1.00 53.15 H ATOM 218 HH21 ARG A 115 13.317 -6.641 0.659 1.00 43.68 H ATOM 219 HH22 ARG A 115 12.806 -6.212 1.991 1.00 43.68 H ATOM 220 N PHE A 116 9.217 -8.017 -4.316 1.00 24.07 N ANISOU 220 N PHE A 116 3662 3209 2276 -190 -381 -170 N ATOM 221 CA PHE A 116 9.243 -7.854 -5.777 1.00 20.85 C ANISOU 221 CA PHE A 116 3246 2800 1876 -197 -382 -168 C ATOM 222 C PHE A 116 10.598 -7.368 -6.288 1.00 21.46 C ANISOU 222 C PHE A 116 3312 2884 1956 -192 -393 -165 C ATOM 223 O PHE A 116 11.323 -6.639 -5.594 1.00 24.26 O ANISOU 223 O PHE A 116 3659 3245 2311 -186 -401 -166 O ATOM 224 CB PHE A 116 8.107 -6.916 -6.209 1.00 22.51 C ANISOU 224 CB PHE A 116 3447 3008 2098 -209 -383 -174 C ATOM 225 CG PHE A 116 6.740 -7.396 -5.778 1.00 22.80 C ANISOU 225 CG PHE A 116 3494 3037 2131 -215 -373 -178 C ATOM 226 CD1 PHE A 116 6.039 -8.311 -6.542 1.00 24.31 C ANISOU 226 CD1 PHE A 116 3694 3221 2322 -220 -363 -176 C ATOM 227 CD2 PHE A 116 6.181 -6.977 -4.580 1.00 23.54 C ANISOU 227 CD2 PHE A 116 3590 3131 2224 -214 -373 -183 C ATOM 228 CE1 PHE A 116 4.788 -8.774 -6.132 1.00 26.11 C ANISOU 228 CE1 PHE A 116 3931 3442 2547 -225 -354 -179 C ATOM 229 CE2 PHE A 116 4.934 -7.441 -4.172 1.00 22.35 C ANISOU 229 CE2 PHE A 116 3449 2974 2071 -219 -363 -185 C ATOM 230 CZ PHE A 116 4.244 -8.332 -4.942 1.00 24.34 C ANISOU 230 CZ PHE A 116 3708 3218 2321 -225 -354 -183 C ATOM 231 H PHE A 116 9.667 -7.420 -3.893 1.00 28.89 H ATOM 232 HA PHE A 116 9.075 -8.719 -6.184 1.00 25.02 H ATOM 233 HB2 PHE A 116 8.254 -6.042 -5.815 1.00 27.01 H ATOM 234 HB3 PHE A 116 8.107 -6.846 -7.177 1.00 27.01 H ATOM 235 HD1 PHE A 116 6.400 -8.612 -7.344 1.00 29.17 H ATOM 236 HD2 PHE A 116 6.641 -6.370 -4.046 1.00 28.25 H ATOM 237 HE1 PHE A 116 4.321 -9.381 -6.659 1.00 31.33 H ATOM 238 HE2 PHE A 116 4.568 -7.141 -3.372 1.00 26.83 H ATOM 239 HZ PHE A 116 3.410 -8.637 -4.667 1.00 29.21 H ATOM 240 N SER A 117 10.939 -7.800 -7.511 1.00 28.63 N ANISOU 240 N SER A 117 4220 3792 2868 -194 -392 -160 N ATOM 241 CA SER A 117 12.158 -7.363 -8.191 1.00 29.03 C ANISOU 241 CA SER A 117 4260 3849 2922 -190 -401 -156 C ATOM 242 C SER A 117 12.002 -5.951 -8.709 1.00 26.90 C ANISOU 242 C SER A 117 3973 3583 2667 -198 -410 -161 C ATOM 243 O SER A 117 12.967 -5.172 -8.739 1.00 31.90 O ANISOU 243 O SER A 117 4594 4223 3304 -194 -420 -159 O ATOM 244 CB SER A 117 12.474 -8.258 -9.392 1.00 30.63 C ANISOU 244 CB SER A 117 4466 4048 3122 -191 -397 -151 C ATOM 245 OG SER A 117 12.958 -9.518 -8.975 1.00 49.27 O ANISOU 245 OG SER A 117 6842 6409 5471 -182 -390 -146 O ATOM 246 H SER A 117 10.469 -8.355 -7.971 1.00 34.36 H ATOM 247 HA SER A 117 12.906 -7.390 -7.574 1.00 34.84 H ATOM 248 HB2 SER A 117 11.664 -8.387 -9.910 1.00 36.75 H ATOM 249 HB3 SER A 117 13.149 -7.825 -9.937 1.00 36.75 H ATOM 250 HG SER A 117 13.661 -9.422 -8.526 1.00 59.13 H ATOM 251 N ARG A 118 10.786 -5.625 -9.132 1.00 24.96 N ANISOU 251 N ARG A 118 3724 3331 2428 -208 -406 -165 N ATOM 252 CA ARG A 118 10.516 -4.326 -9.722 1.00 18.75 C ANISOU 252 CA ARG A 118 2921 2548 1656 -216 -413 -169 C ATOM 253 C ARG A 118 9.504 -3.505 -8.953 1.00 18.00 C ANISOU 253 C ARG A 118 2823 2451 1566 -221 -414 -176 C ATOM 254 O ARG A 118 8.482 -4.025 -8.502 1.00 18.74 O ANISOU 254 O ARG A 118 2927 2539 1655 -224 -405 -179 O ATOM 255 CB ARG A 118 10.034 -4.508 -11.149 1.00 17.27 C ANISOU 255 CB ARG A 118 2732 2356 1476 -225 -410 -168 C ATOM 256 CG ARG A 118 11.135 -4.304 -12.127 1.00 22.66 C ANISOU 256 CG ARG A 118 3405 3044 2163 -222 -417 -163 C ATOM 257 CD ARG A 118 10.788 -4.761 -13.503 1.00 22.30 C ANISOU 257 CD ARG A 118 3359 2993 2121 -229 -412 -160 C ATOM 258 NE ARG A 118 9.557 -4.178 -14.015 1.00 14.84 N ANISOU 258 NE ARG A 118 2409 2044 1187 -241 -410 -165 N ATOM 259 CZ ARG A 118 9.149 -4.348 -15.264 1.00 11.64 C ANISOU 259 CZ ARG A 118 2001 1635 787 -248 -407 -164 C ATOM 260 NH1 ARG A 118 9.879 -5.062 -16.116 1.00 14.88 N ANISOU 260 NH1 ARG A 118 2414 2045 1194 -245 -406 -158 N ATOM 261 NH2 ARG A 118 8.014 -3.798 -15.663 1.00 13.74 N ANISOU 261 NH2 ARG A 118 2261 1897 1063 -259 -404 -169 N ATOM 262 H ARG A 118 10.099 -6.141 -9.086 1.00 29.95 H ATOM 263 HA ARG A 118 11.344 -3.821 -9.752 1.00 22.50 H ATOM 264 HB2 ARG A 118 9.693 -5.409 -11.259 1.00 20.73 H ATOM 265 HB3 ARG A 118 9.337 -3.860 -11.337 1.00 20.73 H ATOM 266 HG2 ARG A 118 11.346 -3.358 -12.171 1.00 27.20 H ATOM 267 HG3 ARG A 118 11.913 -4.803 -11.834 1.00 27.20 H ATOM 268 HD2 ARG A 118 11.507 -4.516 -14.105 1.00 26.76 H ATOM 269 HD3 ARG A 118 10.679 -5.725 -13.494 1.00 26.76 H ATOM 270 HE ARG A 118 9.179 -3.563 -13.549 1.00 17.81 H ATOM 271 HH11 ARG A 118 10.616 -5.421 -15.855 1.00 17.85 H ATOM 272 HH12 ARG A 118 9.612 -5.168 -16.926 1.00 17.85 H ATOM 273 HH21 ARG A 118 7.545 -3.333 -15.112 1.00 16.49 H ATOM 274 HH22 ARG A 118 7.749 -3.901 -16.474 1.00 16.49 H ATOM 275 N SER A 119 9.767 -2.205 -8.865 1.00 15.68 N ANISOU 275 N SER A 119 2513 2162 1281 -222 -423 -179 N ATOM 276 CA SER A 119 8.934 -1.312 -8.056 1.00 14.59 C ANISOU 276 CA SER A 119 2370 2024 1148 -226 -425 -186 C ATOM 277 C SER A 119 7.531 -1.238 -8.616 1.00 12.63 C ANISOU 277 C SER A 119 2122 1769 907 -237 -418 -190 C ATOM 278 O SER A 119 6.563 -1.166 -7.846 1.00 13.73 O ANISOU 278 O SER A 119 2266 1905 1045 -240 -413 -194 O ATOM 279 CB SER A 119 9.528 0.099 -7.960 1.00 19.95 C ANISOU 279 CB SER A 119 3032 2710 1838 -225 -436 -188 C ATOM 280 OG SER A 119 9.555 0.736 -9.228 1.00 21.11 O ANISOU 280 OG SER A 119 3165 2857 1997 -231 -440 -188 O ATOM 281 H SER A 119 10.421 -1.813 -9.263 1.00 18.81 H ATOM 282 HA SER A 119 8.875 -1.670 -7.157 1.00 17.50 H ATOM 283 HB2 SER A 119 8.985 0.627 -7.355 1.00 23.94 H ATOM 284 HB3 SER A 119 10.434 0.035 -7.620 1.00 23.94 H ATOM 285 HG SER A 119 9.883 1.506 -9.156 1.00 25.33 H ATOM 286 N ASP A 120 7.402 -1.278 -9.939 1.00 12.94 N ANISOU 286 N ASP A 120 2157 1807 954 -244 -417 -188 N ATOM 287 CA ASP A 120 6.090 -1.173 -10.543 1.00 11.05 C ANISOU 287 CA ASP A 120 1917 1561 722 -255 -411 -191 C ATOM 288 C ASP A 120 5.263 -2.415 -10.247 1.00 12.46 C ANISOU 288 C ASP A 120 2112 1731 889 -256 -399 -191 C ATOM 289 O ASP A 120 4.038 -2.327 -10.251 1.00 14.16 O ANISOU 289 O ASP A 120 2330 1942 1109 -264 -393 -195 O ATOM 290 CB ASP A 120 6.164 -0.924 -12.047 1.00 12.99 C ANISOU 290 CB ASP A 120 2153 1806 978 -261 -413 -189 C ATOM 291 CG ASP A 120 6.957 -1.973 -12.779 1.00 17.33 C ANISOU 291 CG ASP A 120 2710 2355 1521 -257 -410 -183 C ATOM 292 OD1 ASP A 120 8.135 -2.184 -12.455 1.00 15.45 O ANISOU 292 OD1 ASP A 120 2472 2122 1276 -248 -415 -179 O ATOM 293 OD2 ASP A 120 6.400 -2.598 -13.703 1.00 18.11 O ANISOU 293 OD2 ASP A 120 2813 2448 1620 -263 -403 -181 O ATOM 294 H ASP A 120 8.050 -1.364 -10.497 1.00 15.53 H ATOM 295 HA ASP A 120 5.630 -0.417 -10.146 1.00 13.26 H ATOM 296 HB2 ASP A 120 5.265 -0.921 -12.410 1.00 15.59 H ATOM 297 HB3 ASP A 120 6.588 -0.065 -12.203 1.00 15.59 H ATOM 298 N GLU A 121 5.916 -3.554 -10.037 1.00 13.05 N ANISOU 298 N GLU A 121 2200 1806 952 -249 -395 -186 N ATOM 299 CA GLU A 121 5.179 -4.788 -9.707 1.00 14.72 C ANISOU 299 CA GLU A 121 2429 2010 1153 -249 -383 -185 C ATOM 300 C GLU A 121 4.604 -4.673 -8.294 1.00 14.47 C ANISOU 300 C GLU A 121 2403 1978 1116 -247 -381 -189 C ATOM 301 O GLU A 121 3.488 -5.128 -8.037 1.00 16.81 O ANISOU 301 O GLU A 121 2708 2268 1410 -252 -372 -191 O ATOM 302 CB GLU A 121 6.034 -6.050 -9.860 1.00 16.86 C ANISOU 302 CB GLU A 121 2712 2281 1413 -241 -379 -178 C ATOM 303 CG GLU A 121 5.178 -7.325 -9.873 1.00 18.05 C ANISOU 303 CG GLU A 121 2879 2424 1556 -244 -367 -177 C ATOM 304 CD GLU A 121 5.965 -8.625 -10.068 1.00 27.79 C ANISOU 304 CD GLU A 121 4124 3656 2778 -236 -362 -170 C ATOM 305 OE1 GLU A 121 7.198 -8.589 -10.275 1.00 28.75 O ANISOU 305 OE1 GLU A 121 4241 3783 2898 -229 -368 -166 O ATOM 306 OE2 GLU A 121 5.336 -9.705 -9.980 1.00 27.31 O ANISOU 306 OE2 GLU A 121 4077 3589 2710 -237 -351 -169 O ATOM 307 H GLU A 121 6.770 -3.647 -10.078 1.00 15.66 H ATOM 308 HA GLU A 121 4.431 -4.870 -10.319 1.00 17.66 H ATOM 309 HB2 GLU A 121 6.523 -6.004 -10.696 1.00 20.23 H ATOM 310 HB3 GLU A 121 6.652 -6.108 -9.114 1.00 20.23 H ATOM 311 HG2 GLU A 121 4.709 -7.391 -9.027 1.00 21.66 H ATOM 312 HG3 GLU A 121 4.537 -7.259 -10.597 1.00 21.66 H ATOM 313 N LEU A 122 5.355 -4.068 -7.371 1.00 14.12 N ANISOU 313 N LEU A 122 2354 1940 1070 -239 -389 -190 N ATOM 314 CA LEU A 122 4.819 -3.782 -6.044 1.00 16.06 C ANISOU 314 CA LEU A 122 2604 2186 1312 -237 -387 -195 C ATOM 315 C LEU A 122 3.632 -2.812 -6.147 1.00 15.80 C ANISOU 315 C LEU A 122 2562 2151 1291 -247 -388 -201 C ATOM 316 O LEU A 122 2.609 -3.014 -5.511 1.00 13.62 O ANISOU 316 O LEU A 122 2293 1870 1011 -250 -381 -204 O ATOM 317 CB LEU A 122 5.888 -3.206 -5.109 1.00 14.05 C ANISOU 317 CB LEU A 122 2344 1939 1055 -227 -397 -195 C ATOM 318 CG LEU A 122 5.347 -2.651 -3.795 1.00 13.18 C ANISOU 318 CG LEU A 122 2235 1830 943 -226 -397 -200 C ATOM 319 CD1 LEU A 122 4.695 -3.776 -3.038 1.00 19.16 C ANISOU 319 CD1 LEU A 122 3010 2582 1689 -224 -386 -200 C ATOM 320 CD2 LEU A 122 6.449 -2.002 -2.959 1.00 20.50 C ANISOU 320 CD2 LEU A 122 3156 2765 1869 -217 -407 -200 C ATOM 321 H LEU A 122 6.169 -3.816 -7.489 1.00 16.94 H ATOM 322 HA LEU A 122 4.495 -4.608 -5.653 1.00 19.27 H ATOM 323 HB2 LEU A 122 6.522 -3.908 -4.893 1.00 16.86 H ATOM 324 HB3 LEU A 122 6.345 -2.483 -5.568 1.00 16.86 H ATOM 325 HG LEU A 122 4.673 -1.980 -3.983 1.00 15.81 H ATOM 326 HD11 LEU A 122 4.348 -3.433 -2.200 1.00 23.00 H ATOM 327 HD12 LEU A 122 3.972 -4.138 -3.573 1.00 23.00 H ATOM 328 HD13 LEU A 122 5.356 -4.465 -2.865 1.00 23.00 H ATOM 329 HD21 LEU A 122 6.063 -1.664 -2.136 1.00 24.60 H ATOM 330 HD22 LEU A 122 7.126 -2.668 -2.759 1.00 24.60 H ATOM 331 HD23 LEU A 122 6.841 -1.273 -3.465 1.00 24.60 H ATOM 332 N THR A 123 3.739 -1.766 -6.959 1.00 12.28 N ANISOU 332 N THR A 123 2101 1708 858 -252 -395 -203 N ATOM 333 CA THR A 123 2.648 -0.803 -7.081 1.00 12.78 C ANISOU 333 CA THR A 123 2155 1769 932 -261 -395 -209 C ATOM 334 C THR A 123 1.371 -1.489 -7.609 1.00 14.37 C ANISOU 334 C THR A 123 2364 1962 1133 -270 -384 -209 C ATOM 335 O THR A 123 0.272 -1.261 -7.126 1.00 16.57 O ANISOU 335 O THR A 123 2644 2237 1414 -275 -380 -214 O ATOM 336 CB THR A 123 3.106 0.385 -7.955 1.00 14.82 C ANISOU 336 CB THR A 123 2394 2032 1204 -265 -405 -209 C ATOM 337 OG1 THR A 123 4.106 1.106 -7.218 1.00 18.92 O ANISOU 337 OG1 THR A 123 2906 2559 1723 -256 -415 -210 O ATOM 338 CG2 THR A 123 1.940 1.300 -8.286 1.00 18.26 C ANISOU 338 CG2 THR A 123 2820 2465 1653 -275 -404 -215 C ATOM 339 H THR A 123 4.426 -1.591 -7.446 1.00 14.74 H ATOM 340 HA THR A 123 2.447 -0.454 -6.199 1.00 15.34 H ATOM 341 HB THR A 123 3.486 0.054 -8.784 1.00 17.78 H ATOM 342 HG1 THR A 123 4.757 0.603 -7.050 1.00 22.70 H ATOM 343 HG21 THR A 123 2.245 2.039 -8.834 1.00 21.91 H ATOM 344 HG22 THR A 123 1.260 0.807 -8.771 1.00 21.91 H ATOM 345 HG23 THR A 123 1.553 1.651 -7.469 1.00 21.91 H ATOM 346 N ARG A 124 1.530 -2.378 -8.571 1.00 12.31 N ANISOU 346 N ARG A 124 2108 1697 870 -272 -380 -205 N ATOM 347 CA ARG A 124 0.393 -3.167 -9.077 1.00 11.80 C ANISOU 347 CA ARG A 124 2053 1625 805 -280 -369 -205 C ATOM 348 C ARG A 124 -0.184 -4.069 -7.970 1.00 15.27 C ANISOU 348 C ARG A 124 2509 2060 1232 -277 -360 -205 C ATOM 349 O ARG A 124 -1.407 -4.146 -7.782 1.00 15.50 O ANISOU 349 O ARG A 124 2542 2084 1263 -284 -353 -208 O ATOM 350 CB ARG A 124 0.805 -3.982 -10.288 1.00 13.80 C ANISOU 350 CB ARG A 124 2310 1876 1058 -281 -366 -199 C ATOM 351 CG ARG A 124 -0.326 -4.825 -10.894 1.00 14.43 C ANISOU 351 CG ARG A 124 2399 1947 1137 -290 -355 -199 C ATOM 352 CD ARG A 124 0.156 -5.555 -12.151 1.00 13.77 C ANISOU 352 CD ARG A 124 2317 1862 1053 -291 -353 -193 C ATOM 353 NE ARG A 124 1.069 -6.630 -11.820 1.00 15.63 N ANISOU 353 NE ARG A 124 2565 2098 1275 -281 -350 -188 N ATOM 354 CZ ARG A 124 1.708 -7.377 -12.711 1.00 14.97 C ANISOU 354 CZ ARG A 124 2485 2015 1190 -279 -349 -183 C ATOM 355 NH1 ARG A 124 1.584 -7.132 -13.997 1.00 14.08 N ANISOU 355 NH1 ARG A 124 2364 1900 1085 -286 -350 -182 N ATOM 356 NH2 ARG A 124 2.500 -8.361 -12.305 1.00 18.28 N ANISOU 356 NH2 ARG A 124 2915 2434 1596 -270 -347 -178 N ATOM 357 H ARG A 124 2.279 -2.553 -8.955 1.00 14.77 H ATOM 358 HA ARG A 124 -0.308 -2.558 -9.357 1.00 14.16 H ATOM 359 HB2 ARG A 124 1.124 -3.378 -10.976 1.00 16.56 H ATOM 360 HB3 ARG A 124 1.517 -4.587 -10.027 1.00 16.56 H ATOM 361 HG2 ARG A 124 -0.617 -5.488 -10.248 1.00 17.32 H ATOM 362 HG3 ARG A 124 -1.064 -4.246 -11.140 1.00 17.32 H ATOM 363 HD2 ARG A 124 -0.607 -5.934 -12.614 1.00 16.52 H ATOM 364 HD3 ARG A 124 0.621 -4.928 -12.727 1.00 16.52 H ATOM 365 HE ARG A 124 1.206 -6.796 -10.987 1.00 18.75 H ATOM 366 HH11 ARG A 124 1.067 -6.500 -14.266 1.00 16.89 H ATOM 367 HH12 ARG A 124 2.007 -7.614 -14.570 1.00 16.89 H ATOM 368 HH21 ARG A 124 2.594 -8.518 -11.464 1.00 21.94 H ATOM 369 HH22 ARG A 124 2.930 -8.833 -12.881 1.00 21.94 H ATOM 370 N HIS A 125 0.699 -4.740 -7.255 1.00 14.64 N ANISOU 370 N HIS A 125 2438 1983 1141 -267 -360 -202 N ATOM 371 CA HIS A 125 0.303 -5.622 -6.159 1.00 15.12 C ANISOU 371 CA HIS A 125 2514 2040 1189 -262 -352 -202 C ATOM 372 C HIS A 125 -0.499 -4.901 -5.098 1.00 18.50 C ANISOU 372 C HIS A 125 2941 2470 1620 -264 -352 -208 C ATOM 373 O HIS A 125 -1.426 -5.474 -4.556 1.00 19.63 O ANISOU 373 O HIS A 125 3094 2607 1757 -266 -344 -209 O ATOM 374 CB HIS A 125 1.517 -6.255 -5.512 1.00 14.21 C ANISOU 374 CB HIS A 125 2407 1930 1063 -250 -354 -197 C ATOM 375 CG HIS A 125 1.226 -6.888 -4.189 1.00 16.06 C ANISOU 375 CG HIS A 125 2654 2163 1286 -244 -348 -198 C ATOM 376 ND1 HIS A 125 0.698 -8.157 -4.076 1.00 19.28 N ANISOU 376 ND1 HIS A 125 3077 2564 1685 -244 -336 -195 N ATOM 377 CD2 HIS A 125 1.364 -6.415 -2.928 1.00 22.55 C ANISOU 377 CD2 HIS A 125 3476 2989 2105 -238 -351 -201 C ATOM 378 CE1 HIS A 125 0.536 -8.442 -2.792 1.00 23.62 C ANISOU 378 CE1 HIS A 125 3635 3113 2226 -238 -333 -196 C ATOM 379 NE2 HIS A 125 0.940 -7.404 -2.078 1.00 15.63 N ANISOU 379 NE2 HIS A 125 2615 2108 1217 -235 -342 -200 N ATOM 380 H HIS A 125 1.549 -4.704 -7.381 1.00 17.57 H ATOM 381 HA HIS A 125 -0.249 -6.335 -6.516 1.00 18.14 H ATOM 382 HB2 HIS A 125 1.863 -6.944 -6.102 1.00 17.06 H ATOM 383 HB3 HIS A 125 2.191 -5.572 -5.373 1.00 17.06 H ATOM 384 HD1 HIS A 125 0.508 -8.680 -4.732 1.00 23.14 H ATOM 385 HD2 HIS A 125 1.698 -5.583 -2.684 1.00 27.07 H ATOM 386 HE1 HIS A 125 0.202 -9.240 -2.451 1.00 28.34 H ATOM 387 N ILE A 126 -0.144 -3.658 -4.784 1.00 17.85 N ANISOU 387 N ILE A 126 2523 2801 1459 -518 -96 -800 N ATOM 388 CA ILE A 126 -0.819 -2.908 -3.730 1.00 17.86 C ANISOU 388 CA ILE A 126 2523 2803 1460 -518 -98 -804 C ATOM 389 C ILE A 126 -2.304 -2.737 -4.031 1.00 18.93 C ANISOU 389 C ILE A 126 2657 2939 1597 -516 -100 -811 C ATOM 390 O ILE A 126 -3.110 -2.628 -3.113 1.00 17.88 O ANISOU 390 O ILE A 126 2522 2808 1465 -517 -100 -815 O ATOM 391 CB ILE A 126 -0.161 -1.538 -3.510 1.00 20.12 C ANISOU 391 CB ILE A 126 2811 3089 1746 -518 -102 -801 C ATOM 392 CG1 ILE A 126 1.187 -1.724 -2.804 1.00 26.76 C ANISOU 392 CG1 ILE A 126 3652 3930 2586 -521 -99 -794 C ATOM 393 CG2 ILE A 126 -1.070 -0.606 -2.690 1.00 32.38 C ANISOU 393 CG2 ILE A 126 4362 4642 3299 -518 -104 -806 C ATOM 394 CD1 ILE A 126 1.091 -1.817 -1.283 1.00 30.01 C ANISOU 394 CD1 ILE A 126 4062 4343 2998 -523 -98 -795 C ATOM 395 H ILE A 126 0.490 -3.224 -5.171 1.00 21.42 H ATOM 396 HA ILE A 126 -0.743 -3.405 -2.901 1.00 21.43 H ATOM 397 HB ILE A 126 -0.002 -1.130 -4.376 1.00 24.15 H ATOM 398 HG12 ILE A 126 1.596 -2.543 -3.125 1.00 32.11 H ATOM 399 HG13 ILE A 126 1.757 -0.969 -3.018 1.00 32.11 H ATOM 400 HG21 ILE A 126 -0.623 0.247 -2.572 1.00 38.86 H ATOM 401 HG22 ILE A 126 -1.904 -0.478 -3.169 1.00 38.86 H ATOM 402 HG23 ILE A 126 -1.242 -1.012 -1.827 1.00 38.86 H ATOM 403 HD11 ILE A 126 1.981 -1.933 -0.917 1.00 36.02 H ATOM 404 HD12 ILE A 126 0.696 -0.999 -0.942 1.00 36.02 H ATOM 405 HD13 ILE A 126 0.534 -2.576 -1.048 1.00 36.02 H ATOM 406 N ARG A 127 -2.681 -2.727 -5.305 1.00 17.92 N ANISOU 406 N ARG A 127 2530 2810 1469 -514 -101 -813 N ATOM 407 CA ARG A 127 -4.089 -2.614 -5.657 1.00 17.94 C ANISOU 407 CA ARG A 127 2531 2812 1472 -512 -103 -819 C ATOM 408 C ARG A 127 -4.934 -3.727 -5.045 1.00 19.51 C ANISOU 408 C ARG A 127 2728 3013 1672 -513 -99 -823 C ATOM 409 O ARG A 127 -6.130 -3.564 -4.872 1.00 27.21 O ANISOU 409 O ARG A 127 3701 3989 2648 -513 -100 -829 O ATOM 410 CB ARG A 127 -4.252 -2.605 -7.190 1.00 22.00 C ANISOU 410 CB ARG A 127 3047 3325 1986 -509 -104 -820 C ATOM 411 CG ARG A 127 -3.524 -1.445 -7.815 1.00 20.91 C ANISOU 411 CG ARG A 127 2912 3186 1848 -508 -108 -817 C ATOM 412 CD ARG A 127 -3.863 -1.205 -9.305 1.00 26.46 C ANISOU 412 CD ARG A 127 3616 3887 2550 -504 -111 -818 C ATOM 413 NE ARG A 127 -3.293 0.087 -9.710 1.00 33.81 N ANISOU 413 NE ARG A 127 4549 4816 3480 -503 -115 -816 N ATOM 414 CZ ARG A 127 -2.333 0.255 -10.622 1.00 40.86 C ANISOU 414 CZ ARG A 127 5444 5707 4372 -502 -116 -811 C ATOM 415 NH1 ARG A 127 -1.837 -0.776 -11.286 1.00 24.08 N ANISOU 415 NH1 ARG A 127 3320 3583 2247 -502 -113 -808 N ATOM 416 NH2 ARG A 127 -1.879 1.473 -10.888 1.00 47.50 N ANISOU 416 NH2 ARG A 127 6288 6548 5213 -501 -119 -809 N ATOM 417 H ARG A 127 -2.147 -2.785 -5.977 1.00 21.51 H ATOM 418 HA ARG A 127 -4.426 -1.770 -5.320 1.00 21.52 H ATOM 419 HB2 ARG A 127 -3.887 -3.426 -7.555 1.00 26.40 H ATOM 420 HB3 ARG A 127 -5.193 -2.528 -7.411 1.00 26.40 H ATOM 421 HG2 ARG A 127 -3.750 -0.638 -7.328 1.00 25.09 H ATOM 422 HG3 ARG A 127 -2.570 -1.608 -7.753 1.00 25.09 H ATOM 423 HD2 ARG A 127 -3.470 -1.905 -9.849 1.00 31.75 H ATOM 424 HD3 ARG A 127 -4.825 -1.174 -9.423 1.00 31.75 H ATOM 425 HE ARG A 127 -3.603 0.793 -9.329 1.00 40.57 H ATOM 426 HH11 ARG A 127 -2.119 -1.571 -11.119 1.00 28.90 H ATOM 427 HH12 ARG A 127 -1.223 -0.652 -11.876 1.00 28.90 H ATOM 428 HH21 ARG A 127 -2.201 2.153 -10.470 1.00 57.00 H ATOM 429 HH22 ARG A 127 -1.272 1.585 -11.486 1.00 57.00 H ATOM 430 N ILE A 128 -4.328 -4.874 -4.748 1.00 20.93 N ANISOU 430 N ILE A 128 2907 3194 1852 -515 -95 -820 N ATOM 431 CA ILE A 128 -5.084 -5.967 -4.167 1.00 18.46 C ANISOU 431 CA ILE A 128 2591 2882 1539 -517 -92 -823 C ATOM 432 C ILE A 128 -5.570 -5.535 -2.793 1.00 26.01 C ANISOU 432 C ILE A 128 3546 3840 2496 -519 -92 -826 C ATOM 433 O ILE A 128 -6.734 -5.748 -2.430 1.00 26.19 O ANISOU 433 O ILE A 128 3567 3865 2521 -518 -92 -832 O ATOM 434 CB ILE A 128 -4.233 -7.233 -4.040 1.00 22.48 C ANISOU 434 CB ILE A 128 3100 3392 2048 -519 -87 -819 C ATOM 435 CG1 ILE A 128 -3.846 -7.753 -5.421 1.00 32.40 C ANISOU 435 CG1 ILE A 128 4358 4647 3304 -517 -87 -816 C ATOM 436 CG2 ILE A 128 -5.003 -8.325 -3.311 1.00 35.14 C ANISOU 436 CG2 ILE A 128 4701 4998 3653 -520 -83 -822 C ATOM 437 CD1 ILE A 128 -2.661 -8.709 -5.401 1.00 42.25 C ANISOU 437 CD1 ILE A 128 5606 5895 4551 -519 -83 -810 C ATOM 438 H ILE A 128 -3.493 -5.039 -4.872 1.00 25.12 H ATOM 439 HA ILE A 128 -5.854 -6.165 -4.723 1.00 22.15 H ATOM 440 HB ILE A 128 -3.427 -7.025 -3.542 1.00 26.97 H ATOM 441 HG12 ILE A 128 -4.603 -8.226 -5.801 1.00 38.88 H ATOM 442 HG13 ILE A 128 -3.611 -7.000 -5.985 1.00 38.88 H ATOM 443 HG21 ILE A 128 -4.443 -9.115 -3.244 1.00 42.17 H ATOM 444 HG22 ILE A 128 -5.236 -8.008 -2.424 1.00 42.17 H ATOM 445 HG23 ILE A 128 -5.808 -8.532 -3.811 1.00 42.17 H ATOM 446 HD11 ILE A 128 -2.473 -8.997 -6.308 1.00 50.70 H ATOM 447 HD12 ILE A 128 -1.891 -8.249 -5.034 1.00 50.70 H ATOM 448 HD13 ILE A 128 -2.884 -9.475 -4.849 1.00 50.70 H ATOM 449 N HIS A 129 -4.673 -4.902 -2.050 1.00 24.34 N ANISOU 449 N HIS A 129 3335 3628 2284 -520 -93 -822 N ATOM 450 CA HIS A 129 -4.963 -4.395 -0.713 1.00 24.99 C ANISOU 450 CA HIS A 129 3416 3712 2367 -522 -93 -824 C ATOM 451 C HIS A 129 -5.859 -3.143 -0.720 1.00 26.04 C ANISOU 451 C HIS A 129 3549 3845 2501 -520 -97 -829 C ATOM 452 O HIS A 129 -6.640 -2.948 0.204 1.00 27.13 O ANISOU 452 O HIS A 129 3685 3984 2639 -521 -98 -833 O ATOM 453 CB HIS A 129 -3.658 -4.054 0.025 1.00 17.97 C ANISOU 453 CB HIS A 129 2527 2822 1477 -524 -92 -818 C ATOM 454 CG HIS A 129 -2.666 -5.181 0.104 1.00 20.51 C ANISOU 454 CG HIS A 129 2850 3145 1799 -526 -88 -813 C ATOM 455 ND1 HIS A 129 -2.936 -6.378 0.735 1.00 24.44 N ANISOU 455 ND1 HIS A 129 3345 3644 2296 -528 -84 -814 N ATOM 456 CD2 HIS A 129 -1.373 -5.258 -0.300 1.00 21.41 C ANISOU 456 CD2 HIS A 129 2965 3258 1911 -526 -88 -806 C ATOM 457 CE1 HIS A 129 -1.869 -7.161 0.670 1.00 23.76 C ANISOU 457 CE1 HIS A 129 3260 3558 2209 -529 -81 -808 C ATOM 458 NE2 HIS A 129 -0.898 -6.500 0.056 1.00 22.38 N ANISOU 458 NE2 HIS A 129 3087 3381 2033 -528 -83 -803 N ATOM 459 H HIS A 129 -3.865 -4.750 -2.305 1.00 29.20 H ATOM 460 HA HIS A 129 -5.420 -5.086 -0.208 1.00 29.99 H ATOM 461 HB2 HIS A 129 -3.227 -3.316 -0.435 1.00 21.56 H ATOM 462 HB3 HIS A 129 -3.875 -3.790 0.932 1.00 21.56 H ATOM 463 HD1 HIS A 129 -3.690 -6.594 1.090 1.00 29.32 H ATOM 464 HD2 HIS A 129 -0.899 -4.597 -0.751 1.00 25.69 H ATOM 465 HE1 HIS A 129 -1.806 -8.023 1.014 1.00 28.51 H ATOM 466 N THR A 130 -5.739 -2.278 -1.727 1.00 19.27 N ANISOU 466 N THR A 130 2694 2986 1643 -518 -101 -829 N ATOM 467 CA THR A 130 -6.544 -1.062 -1.768 1.00 19.59 C ANISOU 467 CA THR A 130 2735 3026 1684 -516 -105 -833 C ATOM 468 C THR A 130 -7.894 -1.300 -2.428 1.00 24.34 C ANISOU 468 C THR A 130 3335 3627 2286 -514 -106 -840 C ATOM 469 O THR A 130 -8.825 -0.514 -2.258 1.00 26.55 O ANISOU 469 O THR A 130 3614 3907 2567 -513 -109 -845 O ATOM 470 CB THR A 130 -5.848 0.083 -2.517 1.00 22.31 C ANISOU 470 CB THR A 130 3081 3368 2027 -514 -109 -830 C ATOM 471 OG1 THR A 130 -5.725 -0.277 -3.900 1.00 21.24 O ANISOU 471 OG1 THR A 130 2947 3232 1892 -512 -110 -829 O ATOM 472 CG2 THR A 130 -4.468 0.378 -1.933 1.00 19.99 C ANISOU 472 CG2 THR A 130 2789 3075 1733 -516 -109 -824 C ATOM 473 H THR A 130 -5.202 -2.372 -2.392 1.00 23.12 H ATOM 474 HA THR A 130 -6.707 -0.766 -0.859 1.00 23.51 H ATOM 475 HB THR A 130 -6.386 0.886 -2.443 1.00 26.77 H ATOM 476 HG1 THR A 130 -5.346 0.340 -4.325 1.00 25.49 H ATOM 477 HG21 THR A 130 -4.050 1.103 -2.422 1.00 23.99 H ATOM 478 HG22 THR A 130 -4.551 0.633 -1.000 1.00 23.99 H ATOM 479 HG23 THR A 130 -3.907 -0.411 -1.995 1.00 23.99 H ATOM 480 N GLY A 131 -7.995 -2.378 -3.191 1.00 27.43 N ANISOU 480 N GLY A 131 3726 4019 2678 -513 -104 -839 N ATOM 481 CA GLY A 131 -9.195 -2.653 -3.952 1.00 23.06 C ANISOU 481 CA GLY A 131 3171 3465 2125 -511 -104 -845 C ATOM 482 C GLY A 131 -9.339 -1.775 -5.174 1.00 25.64 C ANISOU 482 C GLY A 131 3501 3791 2452 -508 -108 -846 C ATOM 483 O GLY A 131 -10.402 -1.762 -5.796 1.00 30.33 O ANISOU 483 O GLY A 131 4094 4384 3047 -506 -110 -851 O ATOM 484 H GLY A 131 -7.376 -2.968 -3.284 1.00 32.92 H ATOM 485 HA2 GLY A 131 -9.187 -3.578 -4.241 1.00 27.67 H ATOM 486 HA3 GLY A 131 -9.971 -2.517 -3.386 1.00 27.67 H ATOM 487 N GLN A 132 -8.281 -1.062 -5.542 1.00 22.67 N ANISOU 487 N GLN A 132 3127 3413 2075 -508 -110 -841 N ATOM 488 CA GLN A 132 -8.335 -0.164 -6.683 1.00 19.59 C ANISOU 488 CA GLN A 132 2738 3020 1684 -505 -114 -841 C ATOM 489 C GLN A 132 -8.462 -0.996 -7.967 1.00 22.71 C ANISOU 489 C GLN A 132 3134 3415 2079 -503 -113 -841 C ATOM 490 O GLN A 132 -7.654 -1.894 -8.236 1.00 21.64 O ANISOU 490 O GLN A 132 2999 3279 1943 -504 -110 -837 O ATOM 491 CB GLN A 132 -7.094 0.730 -6.770 1.00 22.16 C ANISOU 491 CB GLN A 132 3067 3345 2009 -505 -116 -835 C ATOM 492 CG GLN A 132 -7.282 1.957 -7.672 1.00 34.61 C ANISOU 492 CG GLN A 132 4645 4920 3584 -502 -121 -837 C ATOM 493 CD GLN A 132 -5.965 2.568 -8.172 1.00 41.67 C ANISOU 493 CD GLN A 132 5542 5813 4478 -502 -123 -830 C ATOM 494 OE1 GLN A 132 -4.864 2.074 -7.876 1.00 27.09 O ANISOU 494 OE1 GLN A 132 3696 3966 2631 -504 -120 -825 O ATOM 495 NE2 GLN A 132 -6.083 3.643 -8.957 1.00 43.95 N ANISOU 495 NE2 GLN A 132 5833 6100 4767 -499 -127 -831 N ATOM 496 H GLN A 132 -7.518 -1.082 -5.145 1.00 27.21 H ATOM 497 HA GLN A 132 -9.118 0.405 -6.608 1.00 23.50 H ATOM 498 HB2 GLN A 132 -6.872 1.046 -5.880 1.00 26.60 H ATOM 499 HB3 GLN A 132 -6.357 0.209 -7.127 1.00 26.60 H ATOM 500 HG2 GLN A 132 -7.802 1.698 -8.448 1.00 41.53 H ATOM 501 HG3 GLN A 132 -7.756 2.642 -7.173 1.00 41.53 H ATOM 502 HE21 GLN A 132 -6.862 3.950 -9.152 1.00 52.74 H ATOM 503 HE22 GLN A 132 -5.379 4.028 -9.267 1.00 52.74 H ATOM 504 N LYS A 133 -9.499 -0.699 -8.742 1.00 21.40 N ANISOU 504 N LYS A 133 2969 3249 1915 -501 -115 -846 N ATOM 505 CA LYS A 133 -9.797 -1.401 -9.995 1.00 18.23 C ANISOU 505 CA LYS A 133 2567 2847 1513 -499 -115 -847 C ATOM 506 C LYS A 133 -10.069 -0.310 -11.018 1.00 19.08 C ANISOU 506 C LYS A 133 2677 2953 1620 -496 -119 -849 C ATOM 507 O LYS A 133 -11.220 0.021 -11.295 1.00 25.95 O ANISOU 507 O LYS A 133 3546 3823 2491 -494 -121 -854 O ATOM 508 CB LYS A 133 -10.985 -2.354 -9.818 1.00 19.84 C ANISOU 508 CB LYS A 133 2769 3052 1718 -499 -112 -853 C ATOM 509 CG LYS A 133 -10.622 -3.663 -9.110 1.00 21.42 C ANISOU 509 CG LYS A 133 2967 3253 1917 -502 -107 -850 C ATOM 510 CD LYS A 133 -11.842 -4.542 -8.873 1.00 25.87 C ANISOU 510 CD LYS A 133 3529 3819 2483 -502 -105 -856 C ATOM 511 CE LYS A 133 -11.434 -5.914 -8.360 1.00 34.63 C ANISOU 511 CE LYS A 133 4637 4930 3592 -504 -100 -854 C ATOM 512 NZ LYS A 133 -12.603 -6.803 -8.063 1.00 47.67 N ANISOU 512 NZ LYS A 133 6286 6582 5245 -505 -98 -859 N ATOM 513 H LYS A 133 -10.063 -0.076 -8.560 1.00 25.69 H ATOM 514 HA LYS A 133 -9.023 -1.912 -10.279 1.00 21.88 H ATOM 515 HB2 LYS A 133 -11.667 -1.910 -9.290 1.00 23.81 H ATOM 516 HB3 LYS A 133 -11.340 -2.578 -10.692 1.00 23.81 H ATOM 517 HG2 LYS A 133 -9.994 -4.158 -9.659 1.00 25.70 H ATOM 518 HG3 LYS A 133 -10.224 -3.459 -8.249 1.00 25.70 H ATOM 519 HD2 LYS A 133 -12.415 -4.126 -8.211 1.00 31.05 H ATOM 520 HD3 LYS A 133 -12.321 -4.659 -9.709 1.00 31.05 H ATOM 521 HE2 LYS A 133 -10.888 -6.352 -9.031 1.00 41.56 H ATOM 522 HE3 LYS A 133 -10.926 -5.804 -7.540 1.00 41.56 H ATOM 523 HZ1 LYS A 133 -12.318 -7.592 -7.766 1.00 57.21 H ATOM 524 HZ2 LYS A 133 -13.119 -6.429 -7.441 1.00 57.21 H ATOM 525 HZ3 LYS A 133 -13.085 -6.928 -8.801 1.00 57.21 H ATOM 526 N PRO A 134 -8.994 0.275 -11.562 1.00 19.92 N ANISOU 526 N PRO A 134 2330 2842 2398 -416 -92 -711 N ATOM 527 CA PRO A 134 -9.067 1.529 -12.319 1.00 22.66 C ANISOU 527 CA PRO A 134 2677 3187 2746 -414 -98 -709 C ATOM 528 C PRO A 134 -9.623 1.412 -13.732 1.00 20.91 C ANISOU 528 C PRO A 134 2451 2970 2524 -413 -95 -709 C ATOM 529 O PRO A 134 -9.773 2.438 -14.388 1.00 22.33 O ANISOU 529 O PRO A 134 2630 3149 2704 -411 -99 -708 O ATOM 530 CB PRO A 134 -7.601 1.966 -12.420 1.00 23.79 C ANISOU 530 CB PRO A 134 2821 3326 2893 -418 -102 -700 C ATOM 531 CG PRO A 134 -6.830 1.114 -11.475 1.00 24.18 C ANISOU 531 CG PRO A 134 2871 3374 2942 -421 -100 -699 C ATOM 532 CD PRO A 134 -7.602 -0.145 -11.311 1.00 19.83 C ANISOU 532 CD PRO A 134 2318 2827 2389 -420 -92 -705 C ATOM 533 HA PRO A 134 -9.570 2.196 -11.826 1.00 27.19 H ATOM 534 HB2 PRO A 134 -7.287 1.833 -13.328 1.00 28.55 H ATOM 535 HB3 PRO A 134 -7.526 2.901 -12.171 1.00 28.55 H ATOM 536 HG2 PRO A 134 -5.954 0.928 -11.849 1.00 29.02 H ATOM 537 HG3 PRO A 134 -6.744 1.572 -10.624 1.00 29.02 H ATOM 538 HD2 PRO A 134 -7.322 -0.802 -11.968 1.00 23.79 H ATOM 539 HD3 PRO A 134 -7.509 -0.484 -10.406 1.00 23.79 H ATOM 540 N PHE A 135 -9.908 0.196 -14.199 1.00 17.33 N ANISOU 540 N PHE A 135 1993 2522 2069 -413 -87 -711 N ATOM 541 CA PHE A 135 -10.189 -0.026 -15.616 1.00 16.91 C ANISOU 541 CA PHE A 135 1934 2474 2016 -412 -84 -711 C ATOM 542 C PHE A 135 -11.578 -0.590 -15.748 1.00 20.45 C ANISOU 542 C PHE A 135 2382 2928 2462 -409 -79 -718 C ATOM 543 O PHE A 135 -11.820 -1.716 -15.341 1.00 21.24 O ANISOU 543 O PHE A 135 2480 3030 2560 -409 -73 -722 O ATOM 544 CB PHE A 135 -9.174 -0.981 -16.214 1.00 16.89 C ANISOU 544 CB PHE A 135 1928 2475 2016 -416 -80 -705 C ATOM 545 CG PHE A 135 -7.748 -0.543 -15.990 1.00 18.20 C ANISOU 545 CG PHE A 135 2096 2636 2184 -419 -86 -697 C ATOM 546 CD1 PHE A 135 -7.237 0.537 -16.688 1.00 20.14 C ANISOU 546 CD1 PHE A 135 2342 2879 2432 -420 -92 -692 C ATOM 547 CD2 PHE A 135 -6.951 -1.181 -15.061 1.00 17.03 C ANISOU 547 CD2 PHE A 135 1949 2485 2036 -422 -85 -695 C ATOM 548 CE1 PHE A 135 -5.935 0.951 -16.479 1.00 16.54 C ANISOU 548 CE1 PHE A 135 1887 2418 1978 -423 -96 -685 C ATOM 549 CE2 PHE A 135 -5.656 -0.771 -14.851 1.00 20.76 C ANISOU 549 CE2 PHE A 135 2423 2954 2512 -425 -89 -688 C ATOM 550 CZ PHE A 135 -5.154 0.298 -15.556 1.00 16.27 C ANISOU 550 CZ PHE A 135 1855 2383 1945 -426 -95 -683 C ATOM 551 H PHE A 135 -9.945 -0.515 -13.716 1.00 20.80 H ATOM 552 HA PHE A 135 -10.147 0.817 -16.095 1.00 20.29 H ATOM 553 HB2 PHE A 135 -9.285 -1.854 -15.807 1.00 20.27 H ATOM 554 HB3 PHE A 135 -9.322 -1.040 -17.171 1.00 20.27 H ATOM 555 HD1 PHE A 135 -7.768 0.977 -17.312 1.00 24.17 H ATOM 556 HD2 PHE A 135 -7.288 -1.904 -14.583 1.00 20.44 H ATOM 557 HE1 PHE A 135 -5.592 1.672 -16.955 1.00 19.85 H ATOM 558 HE2 PHE A 135 -5.123 -1.211 -14.229 1.00 24.91 H ATOM 559 HZ PHE A 135 -4.278 0.574 -15.415 1.00 19.53 H ATOM 560 N GLN A 136 -12.489 0.199 -16.301 1.00 16.07 N ANISOU 560 N GLN A 136 1826 2373 1906 -406 -81 -721 N ATOM 561 CA GLN A 136 -13.904 -0.181 -16.324 1.00 14.19 C ANISOU 561 CA GLN A 136 1588 2140 1665 -402 -76 -730 C ATOM 562 C GLN A 136 -14.327 -0.609 -17.725 1.00 14.17 C ANISOU 562 C GLN A 136 1580 2143 1662 -401 -72 -730 C ATOM 563 O GLN A 136 -14.012 0.047 -18.711 1.00 16.41 O ANISOU 563 O GLN A 136 1861 2426 1947 -401 -75 -725 O ATOM 564 CB GLN A 136 -14.795 0.962 -15.858 1.00 23.32 C ANISOU 564 CB GLN A 136 2748 3293 2821 -399 -81 -734 C ATOM 565 CG GLN A 136 -16.236 0.518 -15.615 1.00 24.39 C ANISOU 565 CG GLN A 136 2883 3432 2953 -395 -76 -743 C ATOM 566 CD GLN A 136 -17.138 1.657 -15.183 1.00 31.70 C ANISOU 566 CD GLN A 136 3813 4354 3877 -392 -81 -747 C ATOM 567 OE1 GLN A 136 -17.067 2.760 -15.725 1.00 36.11 O ANISOU 567 OE1 GLN A 136 4373 4911 4437 -391 -86 -744 O ATOM 568 NE2 GLN A 136 -17.979 1.399 -14.188 1.00 36.41 N ANISOU 568 NE2 GLN A 136 4412 4951 4472 -390 -79 -754 N ATOM 569 H GLN A 136 -12.320 0.958 -16.670 1.00 19.28 H ATOM 570 HA GLN A 136 -14.040 -0.932 -15.726 1.00 17.03 H ATOM 571 HB2 GLN A 136 -14.445 1.317 -15.025 1.00 27.99 H ATOM 572 HB3 GLN A 136 -14.804 1.654 -16.537 1.00 27.99 H ATOM 573 HG2 GLN A 136 -16.594 0.147 -16.436 1.00 29.27 H ATOM 574 HG3 GLN A 136 -16.245 -0.154 -14.915 1.00 29.27 H ATOM 575 HE21 GLN A 136 -17.991 0.619 -13.825 1.00 43.70 H ATOM 576 HE22 GLN A 136 -18.512 2.012 -13.906 1.00 43.70 H ATOM 577 N CYS A 137 -15.040 -1.725 -17.801 1.00 14.19 N ANISOU 577 N CYS A 137 1578 2150 1662 -400 -64 -735 N ATOM 578 CA CYS A 137 -15.651 -2.161 -19.047 1.00 14.94 C ANISOU 578 CA CYS A 137 1668 2251 1756 -399 -60 -736 C ATOM 579 C CYS A 137 -16.797 -1.238 -19.453 1.00 18.93 C ANISOU 579 C CYS A 137 2175 2757 2260 -395 -62 -741 C ATOM 580 O CYS A 137 -17.729 -0.996 -18.684 1.00 18.06 O ANISOU 580 O CYS A 137 2067 2645 2148 -392 -63 -747 O ATOM 581 CB CYS A 137 -16.170 -3.571 -18.915 1.00 12.55 C ANISOU 581 CB CYS A 137 1364 1954 1452 -399 -52 -741 C ATOM 582 SG CYS A 137 -16.977 -4.161 -20.431 1.00 14.69 S ANISOU 582 SG CYS A 137 1628 2232 1722 -397 -46 -743 S ATOM 583 H CYS A 137 -15.185 -2.253 -17.138 1.00 17.02 H ATOM 584 HA CYS A 137 -14.985 -2.146 -19.753 1.00 17.92 H ATOM 585 HB2 CYS A 137 -15.428 -4.165 -18.719 1.00 15.06 H ATOM 586 HB3 CYS A 137 -16.821 -3.603 -18.196 1.00 15.06 H ATOM 587 N ARG A 138 -16.719 -0.715 -20.665 1.00 19.11 N ANISOU 587 N ARG A 138 2195 2781 2284 -394 -64 -737 N ATOM 588 CA ARG A 138 -17.696 0.239 -21.154 1.00 23.62 C ANISOU 588 CA ARG A 138 2767 3353 2854 -391 -67 -740 C ATOM 589 C ARG A 138 -19.037 -0.419 -21.417 1.00 20.82 C ANISOU 589 C ARG A 138 2409 3003 2496 -388 -61 -748 C ATOM 590 O ARG A 138 -20.066 0.254 -21.470 1.00 22.07 O ANISOU 590 O ARG A 138 2570 3162 2654 -384 -62 -753 O ATOM 591 CB ARG A 138 -17.180 0.838 -22.445 1.00 25.04 C ANISOU 591 CB ARG A 138 2945 3534 3037 -391 -70 -735 C ATOM 592 CG ARG A 138 -15.802 1.422 -22.287 1.00 25.16 C ANISOU 592 CG ARG A 138 2961 3543 3054 -395 -76 -727 C ATOM 593 CD ARG A 138 -15.255 1.760 -23.637 1.00 24.15 C ANISOU 593 CD ARG A 138 2830 3417 2928 -395 -77 -721 C ATOM 594 NE ARG A 138 -16.247 2.554 -24.351 1.00 18.47 N ANISOU 594 NE ARG A 138 2110 2700 2208 -392 -79 -724 N ATOM 595 CZ ARG A 138 -16.282 3.869 -24.351 1.00 20.91 C ANISOU 595 CZ ARG A 138 2422 3005 2518 -391 -86 -723 C ATOM 596 NH1 ARG A 138 -17.217 4.465 -25.047 1.00 20.79 N ANISOU 596 NH1 ARG A 138 2406 2991 2501 -387 -87 -726 N ATOM 597 NH2 ARG A 138 -15.369 4.581 -23.686 1.00 28.78 N ANISOU 597 NH2 ARG A 138 3423 3995 3516 -392 -92 -718 N ATOM 598 H ARG A 138 -16.099 -0.900 -21.231 1.00 22.93 H ATOM 599 HA ARG A 138 -17.818 0.950 -20.505 1.00 28.34 H ATOM 600 HB2 ARG A 138 -17.138 0.145 -23.123 1.00 30.05 H ATOM 601 HB3 ARG A 138 -17.778 1.547 -22.729 1.00 30.05 H ATOM 602 HG2 ARG A 138 -15.849 2.234 -21.758 1.00 30.19 H ATOM 603 HG3 ARG A 138 -15.217 0.772 -21.868 1.00 30.19 H ATOM 604 HD2 ARG A 138 -14.444 2.284 -23.543 1.00 28.98 H ATOM 605 HD3 ARG A 138 -15.085 0.947 -24.137 1.00 28.98 H ATOM 606 HE ARG A 138 -16.848 2.135 -24.802 1.00 22.17 H ATOM 607 HH11 ARG A 138 -17.799 3.998 -25.474 1.00 24.94 H ATOM 608 HH12 ARG A 138 -17.260 5.324 -25.062 1.00 24.94 H ATOM 609 HH21 ARG A 138 -14.754 4.181 -23.238 1.00 34.53 H ATOM 610 HH22 ARG A 138 -15.402 5.441 -23.698 1.00 34.53 H ATOM 611 N ILE A 139 -19.022 -1.735 -21.597 1.00 19.23 N ANISOU 611 N ILE A 139 2205 2807 2295 -389 -54 -749 N ATOM 612 CA ILE A 139 -20.221 -2.474 -21.978 1.00 16.60 C ANISOU 612 CA ILE A 139 1869 2480 1959 -386 -47 -756 C ATOM 613 C ILE A 139 -21.035 -2.885 -20.756 1.00 15.78 C ANISOU 613 C ILE A 139 1768 2375 1853 -385 -45 -763 C ATOM 614 O ILE A 139 -22.236 -2.623 -20.712 1.00 26.18 O ANISOU 614 O ILE A 139 3086 3694 3168 -381 -44 -769 O ATOM 615 CB ILE A 139 -19.851 -3.680 -22.869 1.00 17.67 C ANISOU 615 CB ILE A 139 1999 2620 2095 -388 -41 -753 C ATOM 616 CG1 ILE A 139 -19.258 -3.145 -24.187 1.00 18.04 C ANISOU 616 CG1 ILE A 139 2043 2668 2144 -389 -44 -747 C ATOM 617 CG2 ILE A 139 -21.083 -4.557 -23.181 1.00 17.73 C ANISOU 617 CG2 ILE A 139 2003 2633 2099 -386 -34 -761 C ATOM 618 CD1 ILE A 139 -18.431 -4.128 -24.981 1.00 27.81 C ANISOU 618 CD1 ILE A 139 3276 3910 3383 -392 -39 -742 C ATOM 619 H ILE A 139 -18.323 -2.228 -21.503 1.00 23.08 H ATOM 620 HA ILE A 139 -20.781 -1.887 -22.510 1.00 19.92 H ATOM 621 HB ILE A 139 -19.183 -4.218 -22.416 1.00 21.20 H ATOM 622 HG12 ILE A 139 -19.989 -2.855 -24.755 1.00 21.65 H ATOM 623 HG13 ILE A 139 -18.689 -2.388 -23.981 1.00 21.65 H ATOM 624 HG21 ILE A 139 -20.807 -5.300 -23.740 1.00 21.27 H ATOM 625 HG22 ILE A 139 -21.452 -4.889 -22.348 1.00 21.27 H ATOM 626 HG23 ILE A 139 -21.743 -4.020 -23.645 1.00 21.27 H ATOM 627 HD11 ILE A 139 -18.109 -3.692 -25.785 1.00 33.38 H ATOM 628 HD12 ILE A 139 -17.681 -4.420 -24.439 1.00 33.38 H ATOM 629 HD13 ILE A 139 -18.985 -4.889 -25.216 1.00 33.38 H ATOM 630 N CYS A 140 -20.397 -3.500 -19.756 1.00 17.08 N ANISOU 630 N CYS A 140 1934 2537 2018 -387 -44 -762 N ATOM 631 CA CYS A 140 -21.142 -3.992 -18.590 1.00 19.31 C ANISOU 631 CA CYS A 140 2220 2820 2299 -386 -41 -769 C ATOM 632 C CYS A 140 -20.818 -3.266 -17.287 1.00 20.19 C ANISOU 632 C CYS A 140 2337 2925 2410 -386 -46 -769 C ATOM 633 O CYS A 140 -21.413 -3.593 -16.258 1.00 22.45 O ANISOU 633 O CYS A 140 2625 3210 2695 -385 -44 -774 O ATOM 634 CB CYS A 140 -20.913 -5.493 -18.385 1.00 15.90 C ANISOU 634 CB CYS A 140 1785 2392 1866 -388 -33 -770 C ATOM 635 SG CYS A 140 -19.245 -5.874 -17.755 1.00 17.36 S ANISOU 635 SG CYS A 140 1971 2573 2053 -393 -35 -762 S ATOM 636 H CYS A 140 -19.550 -3.644 -19.727 1.00 20.50 H ATOM 637 HA CYS A 140 -22.088 -3.865 -18.761 1.00 23.18 H ATOM 638 HB2 CYS A 140 -21.560 -5.826 -17.743 1.00 19.08 H ATOM 639 HB3 CYS A 140 -21.024 -5.948 -19.235 1.00 19.08 H ATOM 640 N MET A 141 -19.869 -2.324 -17.326 1.00 14.24 N ANISOU 640 N MET A 141 1586 2167 1660 -388 -53 -762 N ATOM 641 CA MET A 141 -19.515 -1.463 -16.196 1.00 21.90 C ANISOU 641 CA MET A 141 2561 3130 2630 -388 -59 -762 C ATOM 642 C MET A 141 -18.690 -2.166 -15.106 1.00 17.18 C ANISOU 642 C MET A 141 1965 2530 2032 -391 -58 -760 C ATOM 643 O MET A 141 -18.337 -1.543 -14.095 1.00 21.12 O ANISOU 643 O MET A 141 2468 3023 2532 -392 -63 -759 O ATOM 644 CB MET A 141 -20.760 -0.784 -15.596 1.00 26.30 C ANISOU 644 CB MET A 141 3121 3686 3185 -384 -61 -769 C ATOM 645 CG MET A 141 -21.285 0.391 -16.419 1.00 44.51 C ANISOU 645 CG MET A 141 5428 5992 5491 -382 -66 -769 C ATOM 646 SD MET A 141 -21.863 -0.060 -18.071 1.00 63.95 S ANISOU 646 SD MET A 141 7884 8461 7953 -380 -61 -769 S ATOM 647 CE MET A 141 -23.597 -0.434 -17.780 1.00 57.63 C ANISOU 647 CE MET A 141 7084 7665 7150 -376 -56 -780 C ATOM 648 H MET A 141 -19.399 -2.162 -18.027 1.00 17.09 H ATOM 649 HA MET A 141 -18.964 -0.747 -16.549 1.00 26.28 H ATOM 650 HB2 MET A 141 -21.472 -1.440 -15.530 1.00 31.56 H ATOM 651 HB3 MET A 141 -20.539 -0.451 -14.712 1.00 31.56 H ATOM 652 HG2 MET A 141 -22.030 0.795 -15.946 1.00 53.41 H ATOM 653 HG3 MET A 141 -20.572 1.041 -16.523 1.00 53.41 H ATOM 654 HE1 MET A 141 -24.009 -0.693 -18.619 1.00 69.16 H ATOM 655 HE2 MET A 141 -23.660 -1.162 -17.142 1.00 69.16 H ATOM 656 HE3 MET A 141 -24.035 0.356 -17.426 1.00 69.16 H ATOM 657 N ARG A 142 -18.346 -3.433 -15.314 1.00 18.23 N ANISOU 657 N ARG A 142 2094 2666 2165 -393 -52 -759 N ATOM 658 CA ARG A 142 -17.479 -4.132 -14.373 1.00 17.83 C ANISOU 658 CA ARG A 142 2045 2613 2115 -397 -50 -757 C ATOM 659 C ARG A 142 -16.082 -3.496 -14.327 1.00 18.09 C ANISOU 659 C ARG A 142 2079 2642 2151 -400 -56 -749 C ATOM 660 O ARG A 142 -15.557 -3.070 -15.350 1.00 17.35 O ANISOU 660 O ARG A 142 1984 2549 2060 -401 -59 -744 O ATOM 661 CB ARG A 142 -17.355 -5.601 -14.744 1.00 17.73 C ANISOU 661 CB ARG A 142 2028 2606 2102 -398 -42 -757 C ATOM 662 CG ARG A 142 -16.581 -6.421 -13.746 1.00 18.18 C ANISOU 662 CG ARG A 142 2086 2662 2160 -401 -40 -756 C ATOM 663 CD ARG A 142 -16.690 -7.930 -14.033 1.00 17.34 C ANISOU 663 CD ARG A 142 1975 2561 2052 -403 -32 -758 C ATOM 664 NE ARG A 142 -15.907 -8.707 -13.062 1.00 22.60 N ANISOU 664 NE ARG A 142 2642 3225 2718 -406 -30 -756 N ATOM 665 CZ ARG A 142 -16.025 -10.021 -12.845 1.00 20.60 C ANISOU 665 CZ ARG A 142 2387 2976 2464 -407 -23 -759 C ATOM 666 NH1 ARG A 142 -16.897 -10.746 -13.528 1.00 21.42 N ANISOU 666 NH1 ARG A 142 2487 3086 2567 -405 -17 -763 N ATOM 667 NH2 ARG A 142 -15.262 -10.604 -11.922 1.00 23.72 N ANISOU 667 NH2 ARG A 142 2783 3368 2860 -409 -22 -757 N ATOM 668 H ARG A 142 -18.599 -3.907 -15.986 1.00 21.87 H ATOM 669 HA ARG A 142 -17.865 -4.077 -13.485 1.00 21.39 H ATOM 670 HB2 ARG A 142 -18.244 -5.982 -14.814 1.00 21.27 H ATOM 671 HB3 ARG A 142 -16.901 -5.670 -15.599 1.00 21.27 H ATOM 672 HG2 ARG A 142 -15.644 -6.172 -13.787 1.00 21.82 H ATOM 673 HG3 ARG A 142 -16.932 -6.256 -12.857 1.00 21.82 H ATOM 674 HD2 ARG A 142 -17.619 -8.203 -13.966 1.00 20.81 H ATOM 675 HD3 ARG A 142 -16.347 -8.114 -14.921 1.00 20.81 H ATOM 676 HE ARG A 142 -15.324 -8.281 -12.594 1.00 27.12 H ATOM 677 HH11 ARG A 142 -17.396 -10.373 -14.122 1.00 25.71 H ATOM 678 HH12 ARG A 142 -16.964 -11.591 -13.380 1.00 25.71 H ATOM 679 HH21 ARG A 142 -14.693 -10.137 -11.477 1.00 28.46 H ATOM 680 HH22 ARG A 142 -15.329 -11.450 -11.780 1.00 28.46 H ATOM 681 N ASN A 143 -15.494 -3.440 -13.132 1.00 17.98 N ANISOU 681 N ASN A 143 2070 2624 2138 -401 -59 -748 N ATOM 682 CA ASN A 143 -14.166 -2.847 -12.952 1.00 14.89 C ANISOU 682 CA ASN A 143 1680 2227 1750 -405 -65 -740 C ATOM 683 C ASN A 143 -13.095 -3.907 -12.781 1.00 15.93 C ANISOU 683 C ASN A 143 1810 2360 1882 -408 -61 -736 C ATOM 684 O ASN A 143 -13.365 -4.982 -12.230 1.00 17.35 O ANISOU 684 O ASN A 143 1990 2542 2061 -409 -55 -740 O ATOM 685 CB ASN A 143 -14.184 -1.910 -11.747 1.00 19.76 C ANISOU 685 CB ASN A 143 2304 2839 2367 -404 -71 -742 C ATOM 686 CG ASN A 143 -15.260 -0.845 -11.851 1.00 21.76 C ANISOU 686 CG ASN A 143 2559 3091 2619 -400 -74 -746 C ATOM 687 OD1 ASN A 143 -15.178 0.072 -12.671 1.00 24.56 O ANISOU 687 OD1 ASN A 143 2913 3445 2975 -399 -78 -743 O ATOM 688 ND2 ASN A 143 -16.259 -0.936 -10.980 1.00 28.87 N ANISOU 688 ND2 ASN A 143 3462 3991 3517 -397 -73 -753 N ATOM 689 H ASN A 143 -15.843 -3.739 -12.406 1.00 21.58 H ATOM 690 HA ASN A 143 -13.946 -2.322 -13.738 1.00 17.87 H ATOM 691 HB2 ASN A 143 -14.353 -2.430 -10.945 1.00 23.72 H ATOM 692 HB3 ASN A 143 -13.325 -1.465 -11.680 1.00 23.72 H ATOM 693 HD21 ASN A 143 -16.896 -0.358 -10.994 1.00 34.64 H ATOM 694 HD22 ASN A 143 -16.269 -1.573 -10.402 1.00 34.64 H ATOM 695 N PHE A 144 -11.890 -3.596 -13.268 1.00 15.76 N ANISOU 695 N PHE A 144 1957 2127 1905 -494 -41 -190 N ATOM 696 CA PHE A 144 -10.772 -4.525 -13.272 1.00 13.68 C ANISOU 696 CA PHE A 144 1678 1888 1630 -492 -35 -167 C ATOM 697 C PHE A 144 -9.511 -3.856 -12.751 1.00 10.43 C ANISOU 697 C PHE A 144 1257 1492 1213 -516 -38 -152 C ATOM 698 O PHE A 144 -9.286 -2.662 -12.962 1.00 16.48 O ANISOU 698 O PHE A 144 2030 2249 1985 -529 -44 -151 O ATOM 699 CB PHE A 144 -10.516 -5.064 -14.689 1.00 14.06 C ANISOU 699 CB PHE A 144 1726 1938 1677 -470 -30 -150 C ATOM 700 CG PHE A 144 -11.695 -5.814 -15.267 1.00 13.46 C ANISOU 700 CG PHE A 144 1659 1849 1606 -445 -26 -164 C ATOM 701 CD1 PHE A 144 -12.746 -5.128 -15.865 1.00 17.67 C ANISOU 701 CD1 PHE A 144 2207 2356 2149 -438 -30 -180 C ATOM 702 CD2 PHE A 144 -11.758 -7.191 -15.190 1.00 12.78 C ANISOU 702 CD2 PHE A 144 1566 1777 1514 -429 -20 -160 C ATOM 703 CE1 PHE A 144 -13.853 -5.814 -16.367 1.00 14.21 C ANISOU 703 CE1 PHE A 144 1778 1907 1716 -415 -27 -193 C ATOM 704 CE2 PHE A 144 -12.866 -7.880 -15.691 1.00 13.22 C ANISOU 704 CE2 PHE A 144 1629 1820 1574 -406 -16 -173 C ATOM 705 CZ PHE A 144 -13.908 -7.180 -16.284 1.00 16.31 C ANISOU 705 CZ PHE A 144 2036 2185 1976 -399 -20 -190 C ATOM 706 H PHE A 144 -11.698 -2.831 -13.609 1.00 18.92 H ATOM 707 HA PHE A 144 -10.979 -5.276 -12.694 1.00 16.41 H ATOM 708 HB2 PHE A 144 -10.320 -4.318 -15.278 1.00 16.87 H ATOM 709 HB3 PHE A 144 -9.760 -5.671 -14.663 1.00 16.87 H ATOM 710 HD1 PHE A 144 -12.719 -4.200 -15.915 1.00 21.20 H ATOM 711 HD2 PHE A 144 -11.066 -7.663 -14.784 1.00 15.34 H ATOM 712 HE1 PHE A 144 -14.548 -5.344 -16.768 1.00 17.06 H ATOM 713 HE2 PHE A 144 -12.899 -8.808 -15.639 1.00 15.86 H ATOM 714 HZ PHE A 144 -14.639 -7.639 -16.631 1.00 19.57 H ATOM 715 N SER A 145 -8.709 -4.679 -12.090 1.00 13.68 N ANISOU 715 N SER A 145 1655 1928 1616 -520 -34 -140 N ATOM 716 CA SER A 145 -7.413 -4.289 -11.571 1.00 13.21 C ANISOU 716 CA SER A 145 1584 1886 1549 -541 -36 -122 C ATOM 717 C SER A 145 -6.370 -4.005 -12.663 1.00 15.14 C ANISOU 717 C SER A 145 1824 2137 1791 -540 -35 -97 C ATOM 718 O SER A 145 -5.394 -3.284 -12.436 1.00 14.86 O ANISOU 718 O SER A 145 1783 2110 1753 -559 -38 -85 O ATOM 719 CB SER A 145 -6.881 -5.389 -10.668 1.00 16.95 C ANISOU 719 CB SER A 145 2044 2384 2013 -543 -32 -116 C ATOM 720 OG SER A 145 -6.646 -6.593 -11.399 1.00 21.75 O ANISOU 720 OG SER A 145 2645 3003 2615 -522 -24 -102 O ATOM 721 H SER A 145 -8.906 -5.500 -11.924 1.00 16.42 H ATOM 722 HA SER A 145 -7.515 -3.485 -11.038 1.00 15.86 H ATOM 723 HB2 SER A 145 -6.046 -5.094 -10.272 1.00 20.34 H ATOM 724 HB3 SER A 145 -7.532 -5.566 -9.971 1.00 20.34 H ATOM 725 HG SER A 145 -6.353 -7.189 -10.885 1.00 26.10 H ATOM 726 N ARG A 146 -6.553 -4.602 -13.834 1.00 13.89 N ANISOU 726 N ARG A 146 1669 1976 1633 -517 -30 -90 N ATOM 727 CA ARG A 146 -5.522 -4.553 -14.864 1.00 15.45 C ANISOU 727 CA ARG A 146 1861 2182 1826 -513 -28 -65 C ATOM 728 C ARG A 146 -6.069 -4.252 -16.248 1.00 13.50 C ANISOU 728 C ARG A 146 1626 1917 1587 -495 -28 -65 C ATOM 729 O ARG A 146 -7.079 -4.827 -16.684 1.00 13.91 O ANISOU 729 O ARG A 146 1685 1957 1643 -475 -25 -77 O ATOM 730 CB ARG A 146 -4.743 -5.857 -14.903 1.00 14.25 C ANISOU 730 CB ARG A 146 1694 2054 1664 -503 -20 -46 C ATOM 731 CG ARG A 146 -3.743 -5.965 -13.766 1.00 16.73 C ANISOU 731 CG ARG A 146 1995 2391 1970 -523 -21 -37 C ATOM 732 CD ARG A 146 -3.171 -7.337 -13.592 1.00 13.13 C ANISOU 732 CD ARG A 146 1526 1958 1505 -513 -14 -23 C ATOM 733 NE ARG A 146 -2.502 -7.839 -14.782 1.00 12.76 N ANISOU 733 NE ARG A 146 1474 1920 1454 -498 -8 -1 N ATOM 734 CZ ARG A 146 -1.583 -8.796 -14.784 1.00 13.32 C ANISOU 734 CZ ARG A 146 1532 2014 1516 -494 -3 18 C ATOM 735 NH1 ARG A 146 -1.109 -9.313 -13.646 1.00 12.65 N ANISOU 735 NH1 ARG A 146 1435 1948 1423 -505 -1 20 N ATOM 736 NH2 ARG A 146 -1.100 -9.201 -15.933 1.00 13.59 N ANISOU 736 NH2 ARG A 146 1563 2053 1546 -478 2 37 N ATOM 737 H ARG A 146 -7.259 -5.039 -14.057 1.00 16.67 H ATOM 738 HA ARG A 146 -4.897 -3.846 -14.639 1.00 18.54 H ATOM 739 HB2 ARG A 146 -5.363 -6.600 -14.830 1.00 17.09 H ATOM 740 HB3 ARG A 146 -4.255 -5.911 -15.739 1.00 17.09 H ATOM 741 HG2 ARG A 146 -3.008 -5.356 -13.938 1.00 20.07 H ATOM 742 HG3 ARG A 146 -4.185 -5.720 -12.937 1.00 20.07 H ATOM 743 HD2 ARG A 146 -2.522 -7.317 -12.871 1.00 15.76 H ATOM 744 HD3 ARG A 146 -3.889 -7.951 -13.373 1.00 15.76 H ATOM 745 HE ARG A 146 -2.717 -7.490 -15.538 1.00 15.31 H ATOM 746 HH11 ARG A 146 -1.432 -9.059 -12.891 1.00 15.18 H ATOM 747 HH12 ARG A 146 -0.501 -9.921 -13.671 1.00 15.18 H ATOM 748 HH21 ARG A 146 -1.387 -8.854 -16.666 1.00 16.30 H ATOM 749 HH22 ARG A 146 -0.477 -9.794 -15.953 1.00 16.30 H ATOM 750 N SER A 147 -5.383 -3.367 -16.964 1.00 12.05 N ANISOU 750 N SER A 147 1443 1730 1404 -502 -30 -51 N ATOM 751 CA SER A 147 -5.834 -2.973 -18.284 1.00 12.63 C ANISOU 751 CA SER A 147 1528 1786 1485 -488 -31 -51 C ATOM 752 C SER A 147 -5.807 -4.136 -19.274 1.00 13.24 C ANISOU 752 C SER A 147 1602 1870 1558 -462 -23 -39 C ATOM 753 O SER A 147 -6.686 -4.219 -20.134 1.00 12.13 O ANISOU 753 O SER A 147 1472 1712 1423 -444 -22 -48 O ATOM 754 CB SER A 147 -4.976 -1.824 -18.838 1.00 14.25 C ANISOU 754 CB SER A 147 1733 1989 1691 -501 -35 -36 C ATOM 755 OG SER A 147 -3.651 -2.236 -19.028 1.00 11.92 O ANISOU 755 OG SER A 147 1425 1717 1387 -504 -31 -11 O ATOM 756 H SER A 147 -4.658 -2.984 -16.705 1.00 14.46 H ATOM 757 HA SER A 147 -6.749 -2.657 -18.221 1.00 15.16 H ATOM 758 HB2 SER A 147 -5.342 -1.538 -19.689 1.00 17.09 H ATOM 759 HB3 SER A 147 -4.990 -1.087 -18.207 1.00 17.09 H ATOM 760 HG SER A 147 -3.624 -2.875 -19.573 1.00 14.30 H ATOM 761 N ASP A 148 -4.834 -5.033 -19.146 1.00 11.54 N ANISOU 761 N ASP A 148 1373 1679 1333 -460 -18 -20 N ATOM 762 CA ASP A 148 -4.731 -6.161 -20.075 1.00 8.35 C ANISOU 762 CA ASP A 148 965 1282 925 -436 -10 -7 C ATOM 763 C ASP A 148 -5.878 -7.141 -19.846 1.00 9.28 C ANISOU 763 C ASP A 148 1087 1394 1044 -418 -7 -25 C ATOM 764 O ASP A 148 -6.395 -7.731 -20.791 1.00 11.52 O ANISOU 764 O ASP A 148 1376 1671 1330 -396 -3 -25 O ATOM 765 CB ASP A 148 -3.358 -6.886 -20.040 1.00 10.08 C ANISOU 765 CB ASP A 148 1167 1529 1133 -439 -5 19 C ATOM 766 CG ASP A 148 -2.920 -7.345 -18.659 1.00 11.35 C ANISOU 766 CG ASP A 148 1316 1708 1286 -453 -5 18 C ATOM 767 OD1 ASP A 148 -3.189 -6.676 -17.646 1.00 13.05 O ANISOU 767 OD1 ASP A 148 1535 1919 1505 -472 -10 4 O ATOM 768 OD2 ASP A 148 -2.239 -8.387 -18.580 1.00 12.41 O ANISOU 768 OD2 ASP A 148 1438 1864 1412 -447 1 33 O ATOM 769 H ASP A 148 -4.226 -5.014 -18.539 1.00 13.85 H ATOM 770 HA ASP A 148 -4.837 -5.812 -20.973 1.00 10.02 H ATOM 771 HB2 ASP A 148 -3.407 -7.671 -20.608 1.00 12.09 H ATOM 772 HB3 ASP A 148 -2.679 -6.281 -20.377 1.00 12.09 H ATOM 773 N HIS A 149 -6.288 -7.317 -18.593 1.00 8.37 N ANISOU 773 N HIS A 149 970 1281 928 -428 -8 -41 N ATOM 774 CA HIS A 149 -7.398 -8.213 -18.283 1.00 8.72 C ANISOU 774 CA HIS A 149 1018 1320 974 -413 -5 -59 C ATOM 775 C HIS A 149 -8.737 -7.592 -18.698 1.00 8.88 C ANISOU 775 C HIS A 149 1056 1313 1007 -405 -9 -81 C ATOM 776 O HIS A 149 -9.706 -8.329 -19.034 1.00 10.48 O ANISOU 776 O HIS A 149 1265 1507 1213 -385 -6 -93 O ATOM 777 CB HIS A 149 -7.358 -8.551 -16.803 1.00 10.14 C ANISOU 777 CB HIS A 149 1191 1513 1151 -427 -6 -68 C ATOM 778 CG HIS A 149 -6.202 -9.415 -16.417 1.00 9.74 C ANISOU 778 CG HIS A 149 1123 1490 1088 -431 -1 -48 C ATOM 779 ND1 HIS A 149 -5.500 -10.178 -17.325 1.00 10.46 N ANISOU 779 ND1 HIS A 149 1207 1594 1174 -416 5 -26 N ATOM 780 CD2 HIS A 149 -5.650 -9.666 -15.205 1.00 9.51 C ANISOU 780 CD2 HIS A 149 1083 1477 1053 -447 -1 -46 C ATOM 781 CE1 HIS A 149 -4.531 -10.829 -16.691 1.00 9.18 C ANISOU 781 CE1 HIS A 149 1031 1457 1003 -423 8 -11 C ATOM 782 NE2 HIS A 149 -4.624 -10.555 -15.396 1.00 8.72 N ANISOU 782 NE2 HIS A 149 970 1401 943 -442 5 -23 N ATOM 783 H HIS A 149 -5.942 -6.931 -17.906 1.00 10.04 H ATOM 784 HA HIS A 149 -7.285 -9.038 -18.781 1.00 10.46 H ATOM 785 HB2 HIS A 149 -7.296 -7.727 -16.296 1.00 12.17 H ATOM 786 HB3 HIS A 149 -8.173 -9.023 -16.568 1.00 12.17 H ATOM 787 HD2 HIS A 149 -5.919 -9.303 -14.393 1.00 11.41 H ATOM 788 HE1 HIS A 149 -3.922 -11.413 -17.081 1.00 11.02 H ATOM 789 HE2 HIS A 149 -4.107 -10.861 -14.781 1.00 10.47 H ATOM 790 N LEU A 150 -8.818 -6.255 -18.683 1.00 10.43 N ANISOU 790 N LEU A 150 1259 1493 1209 -420 -16 -88 N ATOM 791 CA LEU A 150 -9.989 -5.590 -19.248 1.00 11.55 C ANISOU 791 CA LEU A 150 1418 1608 1362 -412 -20 -106 C ATOM 792 C LEU A 150 -10.113 -5.955 -20.726 1.00 9.87 C ANISOU 792 C LEU A 150 1210 1390 1151 -389 -16 -96 C ATOM 793 O LEU A 150 -11.185 -6.370 -21.199 1.00 10.64 O ANISOU 793 O LEU A 150 1316 1472 1253 -370 -14 -110 O ATOM 794 CB LEU A 150 -9.949 -4.072 -19.052 1.00 14.09 C ANISOU 794 CB LEU A 150 1747 1917 1691 -433 -28 -113 C ATOM 795 CG LEU A 150 -11.014 -3.323 -19.847 1.00 13.54 C ANISOU 795 CG LEU A 150 1694 1820 1632 -424 -32 -128 C ATOM 796 CD1 LEU A 150 -12.423 -3.815 -19.456 1.00 14.81 C ANISOU 796 CD1 LEU A 150 1863 1966 1798 -412 -31 -153 C ATOM 797 CD2 LEU A 150 -10.845 -1.831 -19.633 1.00 15.95 C ANISOU 797 CD2 LEU A 150 2004 2113 1942 -446 -39 -132 C ATOM 798 H LEU A 150 -8.222 -5.726 -18.360 1.00 12.51 H ATOM 799 HA LEU A 150 -10.781 -5.923 -18.796 1.00 13.86 H ATOM 800 HB2 LEU A 150 -10.086 -3.874 -18.112 1.00 16.91 H ATOM 801 HB3 LEU A 150 -9.081 -3.743 -19.335 1.00 16.91 H ATOM 802 HG LEU A 150 -10.887 -3.505 -20.792 1.00 16.25 H ATOM 803 HD11 LEU A 150 -13.083 -3.326 -19.973 1.00 17.77 H ATOM 804 HD12 LEU A 150 -12.490 -4.764 -19.646 1.00 17.77 H ATOM 805 HD13 LEU A 150 -12.561 -3.656 -18.509 1.00 17.77 H ATOM 806 HD21 LEU A 150 -11.524 -1.360 -20.140 1.00 19.14 H ATOM 807 HD22 LEU A 150 -10.943 -1.635 -18.688 1.00 19.14 H ATOM 808 HD23 LEU A 150 -9.962 -1.567 -19.936 1.00 19.14 H ATOM 809 N THR A 151 -9.020 -5.844 -21.466 1.00 8.84 N ANISOU 809 N THR A 151 1073 1270 1016 -390 -14 -73 N ATOM 810 CA THR A 151 -9.068 -6.107 -22.895 1.00 8.86 C ANISOU 810 CA THR A 151 1081 1267 1020 -369 -11 -62 C ATOM 811 C THR A 151 -9.575 -7.516 -23.209 1.00 10.11 C ANISOU 811 C THR A 151 1236 1429 1175 -344 -4 -63 C ATOM 812 O THR A 151 -10.423 -7.698 -24.082 1.00 10.30 O ANISOU 812 O THR A 151 1271 1439 1205 -325 -2 -71 O ATOM 813 CB THR A 151 -7.680 -5.955 -23.485 1.00 12.55 C ANISOU 813 CB THR A 151 1538 1750 1481 -374 -9 -34 C ATOM 814 OG1 THR A 151 -7.275 -4.588 -23.328 1.00 13.05 O ANISOU 814 OG1 THR A 151 1604 1806 1547 -396 -16 -33 O ATOM 815 CG2 THR A 151 -7.655 -6.356 -24.977 1.00 12.67 C ANISOU 815 CG2 THR A 151 1557 1761 1496 -352 -4 -22 C ATOM 816 H THR A 151 -8.244 -5.621 -21.169 1.00 10.61 H ATOM 817 HA THR A 151 -9.657 -5.466 -23.322 1.00 10.64 H ATOM 818 HB THR A 151 -7.063 -6.529 -23.005 1.00 15.06 H ATOM 819 HG1 THR A 151 -6.506 -4.478 -23.648 1.00 15.66 H ATOM 820 HG21 THR A 151 -6.759 -6.251 -25.334 1.00 15.21 H ATOM 821 HG22 THR A 151 -7.927 -7.282 -25.076 1.00 15.21 H ATOM 822 HG23 THR A 151 -8.263 -5.794 -25.482 1.00 15.21 H ATOM 823 N THR A 152 -9.057 -8.532 -22.533 1.00 9.15 N ANISOU 823 N THR A 152 1102 1330 1045 -345 1 -56 N ATOM 824 CA THR A 152 -9.552 -9.893 -22.799 1.00 9.82 C ANISOU 824 CA THR A 152 1185 1420 1127 -321 8 -57 C ATOM 825 C THR A 152 -10.999 -10.080 -22.332 1.00 11.49 C ANISOU 825 C THR A 152 1407 1615 1346 -314 7 -85 C ATOM 826 O THR A 152 -11.797 -10.771 -22.992 1.00 10.61 O ANISOU 826 O THR A 152 1301 1494 1237 -291 10 -92 O ATOM 827 CB THR A 152 -8.608 -10.984 -22.240 1.00 11.43 C ANISOU 827 CB THR A 152 1372 1651 1319 -322 14 -41 C ATOM 828 OG1 THR A 152 -8.445 -10.836 -20.828 1.00 12.35 O ANISOU 828 OG1 THR A 152 1482 1776 1433 -343 11 -49 O ATOM 829 CG2 THR A 152 -7.229 -10.894 -22.930 1.00 15.96 C ANISOU 829 CG2 THR A 152 1936 2240 1886 -326 16 -13 C ATOM 830 H THR A 152 -8.441 -8.474 -21.935 1.00 10.98 H ATOM 831 HA THR A 152 -9.560 -10.011 -23.762 1.00 11.79 H ATOM 832 HB THR A 152 -8.984 -11.858 -22.428 1.00 13.72 H ATOM 833 HG1 THR A 152 -9.189 -10.904 -20.445 1.00 14.82 H ATOM 834 HG21 THR A 152 -6.638 -11.578 -22.579 1.00 19.15 H ATOM 835 HG22 THR A 152 -7.328 -11.022 -23.886 1.00 19.15 H ATOM 836 HG23 THR A 152 -6.834 -10.023 -22.768 1.00 19.15 H ATOM 837 N HIS A 153 -11.362 -9.436 -21.220 1.00 11.14 N ANISOU 837 N HIS A 153 1365 1564 1304 -332 1 -102 N ATOM 838 CA HIS A 153 -12.759 -9.474 -20.770 1.00 8.83 C ANISOU 838 CA HIS A 153 1082 1253 1018 -326 -1 -129 C ATOM 839 C HIS A 153 -13.718 -8.947 -21.849 1.00 9.21 C ANISOU 839 C HIS A 153 1146 1276 1077 -312 -3 -140 C ATOM 840 O HIS A 153 -14.797 -9.521 -22.090 1.00 11.26 O ANISOU 840 O HIS A 153 1413 1524 1341 -294 -1 -154 O ATOM 841 CB HIS A 153 -12.934 -8.685 -19.474 1.00 8.21 C ANISOU 841 CB HIS A 153 1005 1171 943 -350 -7 -144 C ATOM 842 CG HIS A 153 -14.354 -8.325 -19.211 1.00 9.41 C ANISOU 842 CG HIS A 153 1171 1301 1105 -347 -11 -172 C ATOM 843 ND1 HIS A 153 -15.249 -9.229 -18.686 1.00 10.41 N ANISOU 843 ND1 HIS A 153 1298 1426 1232 -335 -8 -188 N ATOM 844 CD2 HIS A 153 -15.058 -7.197 -19.474 1.00 13.35 C ANISOU 844 CD2 HIS A 153 1683 1776 1614 -351 -17 -186 C ATOM 845 CE1 HIS A 153 -16.442 -8.651 -18.607 1.00 9.92 C ANISOU 845 CE1 HIS A 153 1249 1340 1179 -334 -12 -211 C ATOM 846 NE2 HIS A 153 -16.353 -7.427 -19.086 1.00 12.82 N ANISOU 846 NE2 HIS A 153 1624 1694 1552 -343 -17 -210 N ATOM 847 H HIS A 153 -10.834 -8.980 -20.718 1.00 13.37 H ATOM 848 HA HIS A 153 -13.000 -10.396 -20.587 1.00 10.59 H ATOM 849 HB2 HIS A 153 -12.617 -9.221 -18.731 1.00 9.85 H ATOM 850 HB3 HIS A 153 -12.422 -7.863 -19.532 1.00 9.85 H ATOM 851 HD1 HIS A 153 -15.064 -10.031 -18.439 1.00 12.50 H ATOM 852 HD2 HIS A 153 -14.724 -6.412 -19.845 1.00 16.02 H ATOM 853 HE1 HIS A 153 -17.214 -9.047 -18.272 1.00 11.90 H ATOM 854 N ILE A 154 -13.355 -7.838 -22.487 1.00 8.76 N ANISOU 854 N ILE A 154 1095 1211 1024 -320 -7 -133 N ATOM 855 CA ILE A 154 -14.224 -7.223 -23.492 1.00 10.21 C ANISOU 855 CA ILE A 154 1293 1368 1217 -309 -10 -143 C ATOM 856 C ILE A 154 -14.579 -8.224 -24.594 1.00 10.02 C ANISOU 856 C ILE A 154 1271 1344 1192 -281 -4 -137 C ATOM 857 O ILE A 154 -15.674 -8.181 -25.161 1.00 11.54 O ANISOU 857 O ILE A 154 1476 1516 1392 -266 -5 -152 O ATOM 858 CB ILE A 154 -13.578 -5.963 -24.080 1.00 10.24 C ANISOU 858 CB ILE A 154 1300 1366 1223 -321 -15 -132 C ATOM 859 CG1 ILE A 154 -13.597 -4.870 -23.015 1.00 15.00 C ANISOU 859 CG1 ILE A 154 1906 1965 1830 -347 -22 -144 C ATOM 860 CG2 ILE A 154 -14.316 -5.499 -25.305 1.00 13.13 C ANISOU 860 CG2 ILE A 154 1681 1711 1599 -306 -16 -137 C ATOM 861 CD1 ILE A 154 -12.694 -3.697 -23.312 1.00 19.39 C ANISOU 861 CD1 ILE A 154 2461 2520 2386 -364 -26 -130 C ATOM 862 H ILE A 154 -12.614 -7.421 -22.358 1.00 10.52 H ATOM 863 HA ILE A 154 -15.052 -6.955 -23.062 1.00 12.25 H ATOM 864 HB ILE A 154 -12.658 -6.160 -24.318 1.00 12.29 H ATOM 865 HG12 ILE A 154 -14.502 -4.531 -22.933 1.00 18.01 H ATOM 866 HG13 ILE A 154 -13.313 -5.253 -22.171 1.00 18.01 H ATOM 867 HG21 ILE A 154 -13.883 -4.703 -25.652 1.00 15.76 H ATOM 868 HG22 ILE A 154 -14.295 -6.204 -25.972 1.00 15.76 H ATOM 869 HG23 ILE A 154 -15.234 -5.299 -25.064 1.00 15.76 H ATOM 870 HD11 ILE A 154 -12.766 -3.053 -22.590 1.00 23.27 H ATOM 871 HD12 ILE A 154 -11.780 -4.013 -23.384 1.00 23.27 H ATOM 872 HD13 ILE A 154 -12.971 -3.289 -24.148 1.00 23.27 H ATOM 873 N ARG A 155 -13.658 -9.134 -24.893 1.00 10.14 N ANISOU 873 N ARG A 155 1275 1380 1199 -273 2 -116 N ATOM 874 CA ARG A 155 -13.896 -10.140 -25.929 1.00 10.06 C ANISOU 874 CA ARG A 155 1265 1371 1187 -247 9 -109 C ATOM 875 C ARG A 155 -15.055 -11.069 -25.566 1.00 10.31 C ANISOU 875 C ARG A 155 1301 1396 1221 -232 11 -128 C ATOM 876 O ARG A 155 -15.638 -11.711 -26.439 1.00 10.28 O ANISOU 876 O ARG A 155 1302 1386 1219 -209 15 -130 O ATOM 877 CB ARG A 155 -12.634 -10.952 -26.181 1.00 10.19 C ANISOU 877 CB ARG A 155 1267 1412 1192 -244 15 -82 C ATOM 878 CG ARG A 155 -11.497 -10.099 -26.696 1.00 14.42 C ANISOU 878 CG ARG A 155 1800 1954 1726 -257 13 -62 C ATOM 879 CD ARG A 155 -10.345 -10.896 -27.315 1.00 11.90 C ANISOU 879 CD ARG A 155 1469 1656 1398 -249 19 -35 C ATOM 880 NE ARG A 155 -9.350 -9.923 -27.739 1.00 12.25 N ANISOU 880 NE ARG A 155 1510 1702 1440 -263 16 -18 N ATOM 881 CZ ARG A 155 -8.073 -9.938 -27.395 1.00 12.27 C ANISOU 881 CZ ARG A 155 1501 1727 1436 -276 17 2 C ATOM 882 NH1 ARG A 155 -7.548 -10.934 -26.687 1.00 11.36 N ANISOU 882 NH1 ARG A 155 1372 1632 1311 -277 22 9 N ATOM 883 NH2 ARG A 155 -7.295 -8.933 -27.788 1.00 15.88 N ANISOU 883 NH2 ARG A 155 1958 2183 1894 -290 14 14 N ATOM 884 H ARG A 155 -12.888 -9.192 -24.513 1.00 12.17 H ATOM 885 HA ARG A 155 -14.127 -9.688 -26.755 1.00 12.07 H ATOM 886 HB2 ARG A 155 -12.350 -11.364 -25.350 1.00 12.22 H ATOM 887 HB3 ARG A 155 -12.823 -11.635 -26.844 1.00 12.22 H ATOM 888 HG2 ARG A 155 -11.841 -9.500 -27.377 1.00 17.31 H ATOM 889 HG3 ARG A 155 -11.136 -9.583 -25.958 1.00 17.31 H ATOM 890 HD2 ARG A 155 -9.953 -11.487 -26.654 1.00 14.28 H ATOM 891 HD3 ARG A 155 -10.658 -11.391 -28.089 1.00 14.28 H ATOM 892 HE ARG A 155 -9.613 -9.287 -28.255 1.00 14.70 H ATOM 893 HH11 ARG A 155 -8.049 -11.576 -26.412 1.00 13.63 H ATOM 894 HH12 ARG A 155 -6.711 -10.926 -26.489 1.00 13.63 H ATOM 895 HH21 ARG A 155 -7.623 -8.298 -28.265 1.00 19.06 H ATOM 896 HH22 ARG A 155 -6.454 -8.946 -27.608 1.00 19.06 H ATOM 897 N THR A 156 -15.414 -11.155 -24.293 1.00 10.13 N ANISOU 897 N THR A 156 1276 1376 1198 -243 10 -143 N ATOM 898 CA THR A 156 -16.573 -11.943 -23.920 1.00 10.65 C ANISOU 898 CA THR A 156 1346 1435 1266 -230 12 -163 C ATOM 899 C THR A 156 -17.845 -11.315 -24.453 1.00 14.98 C ANISOU 899 C THR A 156 1911 1955 1826 -221 8 -183 C ATOM 900 O THR A 156 -18.810 -12.029 -24.730 1.00 17.11 O ANISOU 900 O THR A 156 2186 2216 2099 -202 11 -195 O ATOM 901 CB THR A 156 -16.680 -12.144 -22.402 1.00 12.59 C ANISOU 901 CB THR A 156 1586 1689 1510 -245 11 -175 C ATOM 902 OG1 THR A 156 -17.075 -10.936 -21.755 1.00 15.76 O ANISOU 902 OG1 THR A 156 1994 2076 1918 -264 3 -191 O ATOM 903 CG2 THR A 156 -15.373 -12.659 -21.824 1.00 15.26 C ANISOU 903 CG2 THR A 156 1907 2055 1836 -256 14 -155 C ATOM 904 H THR A 156 -15.010 -10.772 -23.637 1.00 12.16 H ATOM 905 HA THR A 156 -16.490 -12.820 -24.325 1.00 12.78 H ATOM 906 HB THR A 156 -17.357 -12.817 -22.230 1.00 15.11 H ATOM 907 HG1 THR A 156 -16.510 -10.332 -21.904 1.00 18.91 H ATOM 908 HG21 THR A 156 -15.460 -12.779 -20.866 1.00 18.31 H ATOM 909 HG22 THR A 156 -15.144 -13.509 -22.230 1.00 18.31 H ATOM 910 HG23 THR A 156 -14.661 -12.024 -21.999 1.00 18.31 H ATOM 911 N HIS A 157 -17.853 -9.997 -24.634 1.00 10.34 N ANISOU 911 N HIS A 157 1330 1352 1244 -234 1 -187 N ATOM 912 CA HIS A 157 -19.021 -9.304 -25.165 1.00 11.58 C ANISOU 912 CA HIS A 157 1505 1483 1414 -227 -3 -205 C ATOM 913 C HIS A 157 -19.014 -9.270 -26.697 1.00 13.42 C ANISOU 913 C HIS A 157 1743 1707 1648 -209 -1 -194 C ATOM 914 O HIS A 157 -20.074 -9.380 -27.338 1.00 14.65 O ANISOU 914 O HIS A 157 1910 1844 1811 -192 -1 -207 O ATOM 915 CB HIS A 157 -19.044 -7.857 -24.665 1.00 10.05 C ANISOU 915 CB HIS A 157 1316 1277 1225 -250 -11 -215 C ATOM 916 CG HIS A 157 -19.095 -7.721 -23.171 1.00 12.31 C ANISOU 916 CG HIS A 157 1598 1569 1510 -269 -14 -227 C ATOM 917 ND1 HIS A 157 -20.085 -8.295 -22.411 1.00 13.79 N ANISOU 917 ND1 HIS A 157 1788 1752 1700 -264 -13 -247 N ATOM 918 CD2 HIS A 157 -18.313 -7.025 -22.307 1.00 14.85 C ANISOU 918 CD2 HIS A 157 1913 1900 1828 -294 -17 -222 C ATOM 919 CE1 HIS A 157 -19.905 -7.983 -21.139 1.00 17.15 C ANISOU 919 CE1 HIS A 157 2209 2184 2123 -284 -16 -254 C ATOM 920 NE2 HIS A 157 -18.840 -7.204 -21.047 1.00 11.81 N ANISOU 920 NE2 HIS A 157 1527 1516 1443 -303 -19 -240 N ATOM 921 H HIS A 157 -17.190 -9.479 -24.455 1.00 12.40 H ATOM 922 HA HIS A 157 -19.830 -9.749 -24.868 1.00 13.90 H ATOM 923 HB2 HIS A 157 -18.242 -7.409 -24.975 1.00 12.06 H ATOM 924 HB3 HIS A 157 -19.827 -7.415 -25.028 1.00 12.06 H ATOM 925 HD1 HIS A 157 -20.721 -8.788 -22.715 1.00 16.55 H ATOM 926 HD2 HIS A 157 -17.563 -6.520 -22.525 1.00 17.81 H ATOM 927 HE1 HIS A 157 -20.438 -8.261 -20.430 1.00 20.58 H ATOM 928 N THR A 158 -17.842 -9.066 -27.302 1.00 9.74 N ANISOU 928 N THR A 158 1270 1252 1176 -213 0 -170 N ATOM 929 CA THR A 158 -17.768 -8.819 -28.737 1.00 11.94 C ANISOU 929 CA THR A 158 1556 1523 1459 -199 1 -160 C ATOM 930 C THR A 158 -17.653 -10.107 -29.540 1.00 15.58 C ANISOU 930 C THR A 158 2012 1993 1914 -175 9 -147 C ATOM 931 O THR A 158 -17.980 -10.114 -30.720 1.00 16.10 O ANISOU 931 O THR A 158 2085 2048 1983 -158 10 -144 O ATOM 932 CB THR A 158 -16.558 -7.961 -29.079 1.00 13.56 C ANISOU 932 CB THR A 158 1756 1735 1661 -214 -1 -139 C ATOM 933 OG1 THR A 158 -15.383 -8.679 -28.731 1.00 12.14 O ANISOU 933 OG1 THR A 158 1560 1581 1470 -219 3 -119 O ATOM 934 CG2 THR A 158 -16.595 -6.649 -28.323 1.00 18.35 C ANISOU 934 CG2 THR A 158 2367 2332 2272 -239 -9 -150 C ATOM 935 H THR A 158 -17.080 -9.067 -26.904 1.00 11.68 H ATOM 936 HA THR A 158 -18.567 -8.350 -29.024 1.00 14.33 H ATOM 937 HB THR A 158 -16.552 -7.770 -30.030 1.00 16.27 H ATOM 938 HG1 THR A 158 -14.702 -8.222 -28.912 1.00 14.56 H ATOM 939 HG21 THR A 158 -15.819 -6.113 -28.551 1.00 22.01 H ATOM 940 HG22 THR A 158 -17.397 -6.156 -28.555 1.00 22.01 H ATOM 941 HG23 THR A 158 -16.593 -6.817 -27.368 1.00 22.01 H ATOM 942 N GLY A 159 -17.182 -11.198 -28.930 1.00 10.42 N ANISOU 942 N GLY A 159 1347 1361 1252 -173 14 -140 N ATOM 943 CA GLY A 159 -16.962 -12.421 -29.664 1.00 10.32 C ANISOU 943 CA GLY A 159 1328 1360 1233 -152 22 -126 C ATOM 944 C GLY A 159 -15.662 -12.440 -30.436 1.00 11.44 C ANISOU 944 C GLY A 159 1462 1517 1369 -152 24 -98 C ATOM 945 O GLY A 159 -15.409 -13.368 -31.201 1.00 12.22 O ANISOU 945 O GLY A 159 1557 1625 1463 -134 31 -85 O ATOM 946 H GLY A 159 -16.986 -11.245 -28.094 1.00 12.51 H ATOM 947 HA2 GLY A 159 -16.958 -13.168 -29.046 1.00 12.38 H ATOM 948 HA3 GLY A 159 -17.690 -12.551 -30.293 1.00 12.38 H ATOM 949 N GLU A 160 -14.796 -11.448 -30.234 1.00 9.66 N ANISOU 949 N GLU A 160 1232 1295 1141 -173 20 -88 N ATOM 950 CA GLU A 160 -13.529 -11.389 -30.955 1.00 8.93 C ANISOU 950 CA GLU A 160 1132 1217 1043 -174 23 -62 C ATOM 951 C GLU A 160 -12.651 -12.569 -30.526 1.00 13.04 C ANISOU 951 C GLU A 160 1637 1765 1552 -172 29 -45 C ATOM 952 O GLU A 160 -12.491 -12.807 -29.339 1.00 13.04 O ANISOU 952 O GLU A 160 1629 1776 1548 -185 29 -50 O ATOM 953 CB GLU A 160 -12.793 -10.067 -30.674 1.00 11.56 C ANISOU 953 CB GLU A 160 1465 1550 1378 -199 17 -56 C ATOM 954 CG GLU A 160 -11.499 -9.905 -31.445 1.00 14.92 C ANISOU 954 CG GLU A 160 1884 1989 1798 -201 19 -28 C ATOM 955 CD GLU A 160 -10.664 -8.715 -31.019 1.00 21.73 C ANISOU 955 CD GLU A 160 2742 2853 2659 -227 13 -21 C ATOM 956 OE1 GLU A 160 -10.844 -8.211 -29.894 1.00 20.49 O ANISOU 956 OE1 GLU A 160 2585 2695 2504 -245 9 -34 O ATOM 957 OE2 GLU A 160 -9.783 -8.296 -31.822 1.00 25.10 O ANISOU 957 OE2 GLU A 160 3167 3284 3084 -229 13 -2 O ATOM 958 H GLU A 160 -14.919 -10.798 -29.684 1.00 11.59 H ATOM 959 HA GLU A 160 -13.694 -11.456 -31.908 1.00 10.71 H ATOM 960 HB2 GLU A 160 -13.375 -9.330 -30.915 1.00 13.87 H ATOM 961 HB3 GLU A 160 -12.581 -10.023 -29.729 1.00 13.87 H ATOM 962 HG2 GLU A 160 -10.961 -10.703 -31.321 1.00 17.91 H ATOM 963 HG3 GLU A 160 -11.710 -9.796 -32.386 1.00 17.91 H ATOM 964 N LYS A 161 -12.044 -13.258 -31.488 1.00 10.04 N ANISOU 964 N LYS A 161 1253 1395 1167 -157 35 -26 N ATOM 965 CA LYS A 161 -11.222 -14.425 -31.191 1.00 12.55 C ANISOU 965 CA LYS A 161 1556 1738 1475 -153 42 -9 C ATOM 966 C LYS A 161 -9.970 -14.377 -32.066 1.00 11.06 C ANISOU 966 C LYS A 161 1360 1563 1280 -153 45 18 C ATOM 967 O LYS A 161 -9.937 -14.996 -33.140 1.00 12.37 O ANISOU 967 O LYS A 161 1527 1730 1445 -132 50 29 O ATOM 968 CB LYS A 161 -12.036 -15.711 -31.427 1.00 10.91 C ANISOU 968 CB LYS A 161 1350 1530 1266 -129 48 -17 C ATOM 969 CG LYS A 161 -13.197 -15.904 -30.471 1.00 8.51 C ANISOU 969 CG LYS A 161 1050 1216 967 -129 46 -43 C ATOM 970 CD LYS A 161 -13.930 -17.222 -30.709 1.00 13.10 C ANISOU 970 CD LYS A 161 1632 1798 1547 -105 52 -50 C ATOM 971 CE LYS A 161 -15.057 -17.398 -29.712 1.00 19.48 C ANISOU 971 CE LYS A 161 2446 2598 2360 -107 50 -76 C ATOM 972 NZ LYS A 161 -15.773 -18.686 -29.886 1.00 27.28 N ANISOU 972 NZ LYS A 161 3434 3586 3346 -84 56 -82 N ATOM 973 H LYS A 161 -12.094 -13.069 -32.326 1.00 12.05 H ATOM 974 HA LYS A 161 -10.949 -14.401 -30.261 1.00 15.06 H ATOM 975 HB2 LYS A 161 -12.396 -15.689 -32.327 1.00 13.09 H ATOM 976 HB3 LYS A 161 -11.444 -16.474 -31.330 1.00 13.09 H ATOM 977 HG2 LYS A 161 -12.862 -15.906 -29.561 1.00 10.21 H ATOM 978 HG3 LYS A 161 -13.831 -15.180 -30.591 1.00 10.21 H ATOM 979 HD2 LYS A 161 -14.308 -17.224 -31.602 1.00 15.72 H ATOM 980 HD3 LYS A 161 -13.309 -17.960 -30.603 1.00 15.72 H ATOM 981 HE2 LYS A 161 -14.692 -17.376 -28.813 1.00 23.38 H ATOM 982 HE3 LYS A 161 -15.698 -16.680 -29.828 1.00 23.38 H ATOM 983 HZ1 LYS A 161 -16.426 -18.755 -29.285 1.00 32.74 H ATOM 984 HZ2 LYS A 161 -16.125 -18.731 -30.702 1.00 32.74 H ATOM 985 HZ3 LYS A 161 -15.207 -19.365 -29.778 1.00 32.74 H ATOM 986 N PRO A 162 -8.943 -13.628 -31.627 1.00 9.89 N ANISOU 986 N PRO A 162 1205 1425 1128 -175 42 30 N ATOM 987 CA PRO A 162 -7.784 -13.367 -32.499 1.00 12.64 C ANISOU 987 CA PRO A 162 1548 1783 1473 -176 43 56 C ATOM 988 C PRO A 162 -6.843 -14.546 -32.713 1.00 15.90 C ANISOU 988 C PRO A 162 1946 2219 1874 -166 51 78 C ATOM 989 O PRO A 162 -6.019 -14.492 -33.622 1.00 17.41 O ANISOU 989 O PRO A 162 2134 2417 2062 -162 54 98 O ATOM 990 CB PRO A 162 -7.021 -12.266 -31.770 1.00 13.59 C ANISOU 990 CB PRO A 162 1664 1908 1593 -204 38 60 C ATOM 991 CG PRO A 162 -7.978 -11.703 -30.785 1.00 14.20 C ANISOU 991 CG PRO A 162 1749 1971 1677 -215 32 34 C ATOM 992 CD PRO A 162 -8.916 -12.805 -30.410 1.00 12.19 C ANISOU 992 CD PRO A 162 1495 1715 1422 -199 36 19 C ATOM 993 HA PRO A 162 -8.081 -13.034 -33.360 1.00 15.17 H ATOM 994 HB2 PRO A 162 -6.251 -12.647 -31.320 1.00 16.31 H ATOM 995 HB3 PRO A 162 -6.745 -11.587 -32.405 1.00 16.31 H ATOM 996 HG2 PRO A 162 -7.491 -11.394 -30.005 1.00 17.04 H ATOM 997 HG3 PRO A 162 -8.464 -10.969 -31.193 1.00 17.04 H ATOM 998 HD2 PRO A 162 -8.564 -13.313 -29.663 1.00 14.63 H ATOM 999 HD3 PRO A 162 -9.799 -12.450 -30.219 1.00 14.63 H ATOM 1000 N PHE A 163 -6.924 -15.582 -31.890 1.00 11.96 N ANISOU 1000 N PHE A 163 1439 1735 1370 -163 55 74 N ATOM 1001 CA PHE A 163 -5.894 -16.616 -31.874 1.00 10.61 C ANISOU 1001 CA PHE A 163 1253 1589 1188 -159 62 95 C ATOM 1002 C PHE A 163 -6.363 -17.958 -32.445 1.00 10.01 C ANISOU 1002 C PHE A 163 1177 1516 1110 -133 69 96 C ATOM 1003 O PHE A 163 -7.156 -18.697 -31.812 1.00 12.77 O ANISOU 1003 O PHE A 163 1528 1865 1460 -126 71 81 O ATOM 1004 CB PHE A 163 -5.416 -16.792 -30.443 1.00 10.05 C ANISOU 1004 CB PHE A 163 1171 1535 1112 -178 61 94 C ATOM 1005 CG PHE A 163 -4.920 -15.518 -29.821 1.00 8.52 C ANISOU 1005 CG PHE A 163 977 1340 920 -205 54 94 C ATOM 1006 CD1 PHE A 163 -3.650 -15.070 -30.099 1.00 13.35 C ANISOU 1006 CD1 PHE A 163 1580 1964 1527 -216 54 116 C ATOM 1007 CD2 PHE A 163 -5.727 -14.759 -28.988 1.00 10.16 C ANISOU 1007 CD2 PHE A 163 1192 1532 1134 -218 48 71 C ATOM 1008 CE1 PHE A 163 -3.192 -13.875 -29.555 1.00 14.30 C ANISOU 1008 CE1 PHE A 163 1702 2083 1650 -241 48 116 C ATOM 1009 CE2 PHE A 163 -5.288 -13.576 -28.442 1.00 12.29 C ANISOU 1009 CE2 PHE A 163 1463 1800 1407 -242 41 70 C ATOM 1010 CZ PHE A 163 -4.006 -13.143 -28.703 1.00 13.20 C ANISOU 1010 CZ PHE A 163 1570 1929 1517 -253 41 93 C ATOM 1011 H PHE A 163 -7.564 -15.712 -31.330 1.00 14.35 H ATOM 1012 HA PHE A 163 -5.140 -16.315 -32.405 1.00 12.73 H ATOM 1013 HB2 PHE A 163 -6.152 -17.120 -29.903 1.00 12.06 H ATOM 1014 HB3 PHE A 163 -4.688 -17.433 -30.431 1.00 12.06 H ATOM 1015 HD1 PHE A 163 -3.098 -15.563 -30.663 1.00 16.02 H ATOM 1016 HD2 PHE A 163 -6.589 -15.052 -28.801 1.00 12.19 H ATOM 1017 HE1 PHE A 163 -2.328 -13.583 -29.736 1.00 17.16 H ATOM 1018 HE2 PHE A 163 -5.841 -13.089 -27.875 1.00 14.75 H ATOM 1019 HZ PHE A 163 -3.701 -12.344 -28.338 1.00 15.84 H ATOM 1020 N ALA A 164 -5.860 -18.315 -33.606 1.00 10.93 N ANISOU 1020 N ALA A 164 1292 1637 1223 -118 74 115 N ATOM 1021 CA ALA A 164 -6.297 -19.543 -34.297 1.00 8.88 C ANISOU 1021 CA ALA A 164 1033 1379 961 -92 80 116 C ATOM 1022 C ALA A 164 -5.314 -20.705 -34.082 1.00 9.75 C ANISOU 1022 C ALA A 164 1128 1517 1061 -88 88 136 C ATOM 1023 O ALA A 164 -4.090 -20.543 -34.131 1.00 12.41 O ANISOU 1023 O ALA A 164 1454 1869 1391 -99 89 157 O ATOM 1024 CB ALA A 164 -6.487 -19.269 -35.767 1.00 14.09 C ANISOU 1024 CB ALA A 164 1702 2024 1625 -76 81 123 C ATOM 1025 H ALA A 164 -5.258 -17.871 -34.030 1.00 13.11 H ATOM 1026 HA ALA A 164 -7.156 -19.813 -33.935 1.00 10.65 H ATOM 1027 HB1 ALA A 164 -6.775 -20.086 -36.205 1.00 16.90 H ATOM 1028 HB2 ALA A 164 -7.162 -18.580 -35.875 1.00 16.90 H ATOM 1029 HB3 ALA A 164 -5.645 -18.970 -36.143 1.00 16.90 H ATOM 1030 N CYS A 165 -5.871 -21.893 -33.849 1.00 8.28 N ANISOU 1030 N CYS A 165 939 1334 871 -73 93 129 N ATOM 1031 CA CYS A 165 -5.075 -23.122 -33.747 1.00 9.02 C ANISOU 1031 CA CYS A 165 1019 1453 955 -65 100 146 C ATOM 1032 C CYS A 165 -4.362 -23.436 -35.071 1.00 9.75 C ANISOU 1032 C CYS A 165 1109 1551 1044 -51 105 169 C ATOM 1033 O CYS A 165 -4.965 -23.446 -36.143 1.00 10.83 O ANISOU 1033 O CYS A 165 1256 1673 1186 -33 106 167 O ATOM 1034 CB CYS A 165 -5.962 -24.312 -33.383 1.00 10.06 C ANISOU 1034 CB CYS A 165 1151 1586 1087 -49 104 132 C ATOM 1035 SG CYS A 165 -5.036 -25.831 -33.306 1.00 8.69 S ANISOU 1035 SG CYS A 165 961 1441 900 -39 114 153 S ATOM 1036 H CYS A 165 -6.715 -22.018 -33.745 1.00 9.93 H ATOM 1037 HA CYS A 165 -4.404 -23.016 -33.054 1.00 10.82 H ATOM 1038 HB2 CYS A 165 -6.362 -24.157 -32.513 1.00 12.08 H ATOM 1039 HB3 CYS A 165 -6.653 -24.412 -34.056 1.00 12.08 H ATOM 1040 N ASP A 166 -3.056 -23.669 -35.005 1.00 10.27 N ANISOU 1040 N ASP A 166 1162 1640 1102 -59 108 192 N ATOM 1041 CA ASP A 166 -2.303 -23.987 -36.211 1.00 10.27 C ANISOU 1041 CA ASP A 166 1159 1647 1098 -46 113 215 C ATOM 1042 C ASP A 166 -2.743 -25.274 -36.885 1.00 11.45 C ANISOU 1042 C ASP A 166 1308 1798 1244 -19 121 217 C ATOM 1043 O ASP A 166 -2.690 -25.384 -38.115 1.00 15.45 O ANISOU 1043 O ASP A 166 1819 2299 1751 -3 123 227 O ATOM 1044 CB ASP A 166 -0.809 -24.126 -35.888 1.00 10.11 C ANISOU 1044 CB ASP A 166 1122 1651 1068 -59 116 239 C ATOM 1045 CG ASP A 166 -0.123 -22.795 -35.688 1.00 13.25 C ANISOU 1045 CG ASP A 166 1520 2047 1467 -83 110 245 C ATOM 1046 OD1 ASP A 166 -0.599 -21.767 -36.212 1.00 13.75 O ANISOU 1046 OD1 ASP A 166 1595 2090 1539 -85 104 237 O ATOM 1047 OD2 ASP A 166 0.944 -22.756 -35.028 1.00 16.08 O ANISOU 1047 OD2 ASP A 166 1866 2425 1819 -99 110 259 O ATOM 1048 H ASP A 166 -2.588 -23.650 -34.284 1.00 12.33 H ATOM 1049 HA ASP A 166 -2.407 -23.263 -36.848 1.00 12.33 H ATOM 1050 HB2 ASP A 166 -0.709 -24.640 -35.072 1.00 12.13 H ATOM 1051 HB3 ASP A 166 -0.369 -24.582 -36.623 1.00 12.13 H ATOM 1052 N ILE A 167 -3.184 -26.249 -36.115 1.00 8.20 N ANISOU 1052 N ILE A 167 769 1402 945 -103 40 12 N ATOM 1053 CA ILE A 167 -3.571 -27.554 -36.651 1.00 7.39 C ANISOU 1053 CA ILE A 167 659 1302 845 -99 50 5 C ATOM 1054 C ILE A 167 -4.975 -27.563 -37.262 1.00 11.10 C ANISOU 1054 C ILE A 167 1130 1774 1313 -94 54 -7 C ATOM 1055 O ILE A 167 -5.200 -28.121 -38.335 1.00 12.95 O ANISOU 1055 O ILE A 167 1358 2013 1549 -91 60 -11 O ATOM 1056 CB ILE A 167 -3.551 -28.629 -35.538 1.00 9.87 C ANISOU 1056 CB ILE A 167 974 1614 1163 -99 55 4 C ATOM 1057 CG1 ILE A 167 -2.178 -28.690 -34.879 1.00 14.58 C ANISOU 1057 CG1 ILE A 167 1569 2209 1761 -104 52 16 C ATOM 1058 CG2 ILE A 167 -4.003 -29.962 -36.062 1.00 10.95 C ANISOU 1058 CG2 ILE A 167 1104 1754 1303 -95 66 -3 C ATOM 1059 CD1 ILE A 167 -1.120 -29.087 -35.790 1.00 15.88 C ANISOU 1059 CD1 ILE A 167 1726 2379 1929 -104 54 23 C ATOM 1060 H ILE A 167 -3.273 -26.186 -35.261 1.00 9.84 H ATOM 1061 HA ILE A 167 -2.939 -27.816 -37.339 1.00 8.86 H ATOM 1062 HB ILE A 167 -4.186 -28.354 -34.858 1.00 11.84 H ATOM 1063 HG12 ILE A 167 -1.957 -27.812 -34.530 1.00 17.49 H ATOM 1064 HG13 ILE A 167 -2.205 -29.335 -34.155 1.00 17.49 H ATOM 1065 HG21 ILE A 167 -3.978 -30.609 -35.340 1.00 13.14 H ATOM 1066 HG22 ILE A 167 -4.909 -29.877 -36.400 1.00 13.14 H ATOM 1067 HG23 ILE A 167 -3.408 -30.239 -36.776 1.00 13.14 H ATOM 1068 HD11 ILE A 167 -0.278 -29.106 -35.308 1.00 19.06 H ATOM 1069 HD12 ILE A 167 -1.320 -29.969 -36.141 1.00 19.06 H ATOM 1070 HD13 ILE A 167 -1.071 -28.445 -36.516 1.00 19.06 H ATOM 1071 N CYS A 168 -5.950 -26.979 -36.578 1.00 8.66 N ANISOU 1071 N CYS A 168 829 1461 1002 -94 51 -13 N ATOM 1072 CA CYS A 168 -7.357 -27.087 -36.997 1.00 9.72 C ANISOU 1072 CA CYS A 168 964 1595 1133 -89 55 -25 C ATOM 1073 C CYS A 168 -8.049 -25.769 -37.319 1.00 10.15 C ANISOU 1073 C CYS A 168 1024 1649 1184 -89 49 -28 C ATOM 1074 O CYS A 168 -9.180 -25.800 -37.844 1.00 13.81 O ANISOU 1074 O CYS A 168 1488 2113 1645 -85 52 -38 O ATOM 1075 CB CYS A 168 -8.185 -27.833 -35.943 1.00 8.95 C ANISOU 1075 CB CYS A 168 869 1493 1037 -87 60 -32 C ATOM 1076 SG CYS A 168 -8.594 -26.873 -34.466 1.00 10.29 S ANISOU 1076 SG CYS A 168 1050 1655 1203 -91 52 -33 S ATOM 1077 H CYS A 168 -5.831 -26.512 -35.865 1.00 10.40 H ATOM 1078 HA CYS A 168 -7.383 -27.622 -37.806 1.00 11.66 H ATOM 1079 HB2 CYS A 168 -9.020 -28.113 -36.350 1.00 10.74 H ATOM 1080 HB3 CYS A 168 -7.686 -28.613 -35.655 1.00 10.74 H ATOM 1081 N GLY A 169 -7.437 -24.641 -36.973 1.00 8.89 N ANISOU 1081 N GLY A 169 869 1487 1022 -93 40 -21 N ATOM 1082 CA GLY A 169 -8.002 -23.350 -37.293 1.00 9.70 C ANISOU 1082 CA GLY A 169 977 1588 1119 -93 33 -23 C ATOM 1083 C GLY A 169 -9.038 -22.840 -36.289 1.00 9.80 C ANISOU 1083 C GLY A 169 998 1595 1129 -93 30 -29 C ATOM 1084 O GLY A 169 -9.487 -21.718 -36.440 1.00 13.48 O ANISOU 1084 O GLY A 169 1470 2061 1592 -94 24 -31 O ATOM 1085 H GLY A 169 -6.689 -24.603 -36.551 1.00 10.67 H ATOM 1086 HA2 GLY A 169 -7.287 -22.696 -37.344 1.00 11.64 H ATOM 1087 HA3 GLY A 169 -8.428 -23.399 -38.164 1.00 11.64 H ATOM 1088 N ARG A 170 -9.396 -23.608 -35.265 1.00 9.92 N ANISOU 1088 N ARG A 170 1015 1607 1146 -93 34 -33 N ATOM 1089 CA ARG A 170 -10.338 -23.125 -34.249 1.00 8.63 C ANISOU 1089 CA ARG A 170 860 1438 980 -93 31 -39 C ATOM 1090 C ARG A 170 -9.788 -21.862 -33.577 1.00 9.29 C ANISOU 1090 C ARG A 170 951 1519 1062 -97 20 -31 C ATOM 1091 O ARG A 170 -8.598 -21.785 -33.266 1.00 10.39 O ANISOU 1091 O ARG A 170 1088 1657 1201 -101 17 -21 O ATOM 1092 CB ARG A 170 -10.622 -24.229 -33.213 1.00 10.47 C ANISOU 1092 CB ARG A 170 1094 1668 1216 -92 36 -43 C ATOM 1093 CG ARG A 170 -11.616 -23.858 -32.112 1.00 12.51 C ANISOU 1093 CG ARG A 170 1360 1921 1472 -92 34 -49 C ATOM 1094 CD ARG A 170 -12.102 -25.092 -31.353 1.00 17.40 C ANISOU 1094 CD ARG A 170 1979 2538 2094 -90 41 -55 C ATOM 1095 NE ARG A 170 -12.991 -24.721 -30.256 1.00 23.27 N ANISOU 1095 NE ARG A 170 2730 3276 2836 -90 38 -60 N ATOM 1096 CZ ARG A 170 -13.556 -25.594 -29.424 1.00 29.30 C ANISOU 1096 CZ ARG A 170 3495 4036 3601 -88 44 -66 C ATOM 1097 NH1 ARG A 170 -13.312 -26.891 -29.558 1.00 30.48 N ANISOU 1097 NH1 ARG A 170 3638 4188 3755 -87 52 -67 N ATOM 1098 NH2 ARG A 170 -14.356 -25.161 -28.454 1.00 37.53 N ANISOU 1098 NH2 ARG A 170 4545 5074 4641 -89 41 -71 N ATOM 1099 H ARG A 170 -9.113 -24.409 -35.132 1.00 11.90 H ATOM 1100 HA ARG A 170 -11.177 -22.895 -34.679 1.00 10.36 H ATOM 1101 HB2 ARG A 170 -10.979 -25.002 -33.679 1.00 12.57 H ATOM 1102 HB3 ARG A 170 -9.786 -24.468 -32.783 1.00 12.57 H ATOM 1103 HG2 ARG A 170 -11.184 -23.263 -31.479 1.00 15.01 H ATOM 1104 HG3 ARG A 170 -12.386 -23.423 -32.510 1.00 15.01 H ATOM 1105 HD2 ARG A 170 -12.591 -25.670 -31.960 1.00 20.88 H ATOM 1106 HD3 ARG A 170 -11.339 -25.562 -30.982 1.00 20.88 H ATOM 1107 HE ARG A 170 -13.146 -23.885 -30.128 1.00 27.92 H ATOM 1108 HH11 ARG A 170 -12.795 -27.169 -30.186 1.00 36.58 H ATOM 1109 HH12 ARG A 170 -13.676 -27.455 -29.019 1.00 36.58 H ATOM 1110 HH21 ARG A 170 -14.510 -24.319 -28.368 1.00 45.04 H ATOM 1111 HH22 ARG A 170 -14.719 -25.723 -27.914 1.00 45.04 H ATOM 1112 N LYS A 171 -10.661 -20.885 -33.367 1.00 9.10 N ANISOU 1112 N LYS A 171 933 1491 1033 -97 15 -36 N ATOM 1113 CA LYS A 171 -10.309 -19.554 -32.869 1.00 9.75 C ANISOU 1113 CA LYS A 171 1022 1570 1112 -101 5 -30 C ATOM 1114 C LYS A 171 -10.636 -19.370 -31.394 1.00 8.84 C ANISOU 1114 C LYS A 171 915 1449 996 -103 1 -31 C ATOM 1115 O LYS A 171 -11.620 -19.909 -30.878 1.00 8.82 O ANISOU 1115 O LYS A 171 914 1444 993 -100 6 -40 O ATOM 1116 CB LYS A 171 -11.044 -18.489 -33.691 1.00 12.59 C ANISOU 1116 CB LYS A 171 1385 1932 1468 -100 1 -35 C ATOM 1117 CG LYS A 171 -10.679 -18.498 -35.169 1.00 14.77 C ANISOU 1117 CG LYS A 171 1654 2214 1744 -98 3 -33 C ATOM 1118 CD LYS A 171 -11.379 -17.355 -35.867 1.00 23.24 C ANISOU 1118 CD LYS A 171 2730 3287 2812 -97 -1 -37 C ATOM 1119 CE LYS A 171 -10.843 -17.169 -37.273 1.00 37.19 C ANISOU 1119 CE LYS A 171 4491 5060 4579 -96 -1 -33 C ATOM 1120 NZ LYS A 171 -11.623 -16.126 -37.998 1.00 45.99 N ANISOU 1120 NZ LYS A 171 5609 6176 5690 -95 -5 -38 N ATOM 1121 H LYS A 171 -11.504 -20.972 -33.512 1.00 10.92 H ATOM 1122 HA LYS A 171 -9.356 -19.417 -32.984 1.00 11.70 H ATOM 1123 HB2 LYS A 171 -11.999 -18.642 -33.620 1.00 15.11 H ATOM 1124 HB3 LYS A 171 -10.824 -17.613 -33.336 1.00 15.11 H ATOM 1125 HG2 LYS A 171 -9.721 -18.383 -35.270 1.00 17.73 H ATOM 1126 HG3 LYS A 171 -10.968 -19.332 -35.572 1.00 17.73 H ATOM 1127 HD2 LYS A 171 -12.329 -17.546 -35.925 1.00 27.89 H ATOM 1128 HD3 LYS A 171 -11.229 -16.535 -35.371 1.00 27.89 H ATOM 1129 HE2 LYS A 171 -9.916 -16.885 -37.231 1.00 44.62 H ATOM 1130 HE3 LYS A 171 -10.919 -18.004 -37.761 1.00 44.62 H ATOM 1131 HZ1 LYS A 171 -11.302 -16.023 -38.822 1.00 55.19 H ATOM 1132 HZ2 LYS A 171 -12.478 -16.367 -38.049 1.00 55.19 H ATOM 1133 HZ3 LYS A 171 -11.567 -15.350 -37.567 1.00 55.19 H ATOM 1134 N PHE A 172 -9.749 -18.637 -30.710 1.00 7.93 N ANISOU 1134 N PHE A 172 803 1330 879 -108 -6 -22 N ATOM 1135 CA PHE A 172 -9.876 -18.354 -29.294 1.00 7.83 C ANISOU 1135 CA PHE A 172 797 1311 866 -110 -11 -21 C ATOM 1136 C PHE A 172 -9.656 -16.875 -28.953 1.00 6.95 C ANISOU 1136 C PHE A 172 693 1197 751 -114 -21 -16 C ATOM 1137 O PHE A 172 -8.891 -16.162 -29.628 1.00 8.39 O ANISOU 1137 O PHE A 172 874 1383 933 -116 -26 -9 O ATOM 1138 CB PHE A 172 -8.838 -19.199 -28.567 1.00 7.79 C ANISOU 1138 CB PHE A 172 790 1306 865 -113 -9 -14 C ATOM 1139 CG PHE A 172 -9.036 -20.673 -28.786 1.00 8.88 C ANISOU 1139 CG PHE A 172 921 1447 1008 -110 2 -19 C ATOM 1140 CD1 PHE A 172 -9.928 -21.386 -27.997 1.00 9.80 C ANISOU 1140 CD1 PHE A 172 1040 1560 1125 -107 7 -27 C ATOM 1141 CD2 PHE A 172 -8.404 -21.323 -29.815 1.00 10.60 C ANISOU 1141 CD2 PHE A 172 1130 1669 1227 -108 7 -16 C ATOM 1142 CE1 PHE A 172 -10.142 -22.722 -28.215 1.00 10.21 C ANISOU 1142 CE1 PHE A 172 1086 1614 1180 -104 16 -31 C ATOM 1143 CE2 PHE A 172 -8.628 -22.649 -30.053 1.00 10.17 C ANISOU 1143 CE2 PHE A 172 1070 1618 1177 -105 16 -20 C ATOM 1144 CZ PHE A 172 -9.495 -23.355 -29.237 1.00 10.98 C ANISOU 1144 CZ PHE A 172 1176 1717 1280 -103 21 -28 C ATOM 1145 H PHE A 172 -9.048 -18.288 -31.065 1.00 9.51 H ATOM 1146 HA PHE A 172 -10.758 -18.615 -28.987 1.00 9.39 H ATOM 1147 HB2 PHE A 172 -7.954 -18.964 -28.891 1.00 9.35 H ATOM 1148 HB3 PHE A 172 -8.900 -19.026 -27.614 1.00 9.35 H ATOM 1149 HD1 PHE A 172 -10.370 -20.957 -27.301 1.00 11.77 H ATOM 1150 HD2 PHE A 172 -7.821 -20.851 -30.366 1.00 12.72 H ATOM 1151 HE1 PHE A 172 -10.731 -23.195 -27.672 1.00 12.26 H ATOM 1152 HE2 PHE A 172 -8.178 -23.082 -30.742 1.00 12.21 H ATOM 1153 HZ PHE A 172 -9.638 -24.262 -29.386 1.00 13.18 H ATOM 1154 N ALA A 173 -10.298 -16.440 -27.881 1.00 8.51 N ANISOU 1154 N ALA A 173 898 1390 946 -115 -25 -19 N ATOM 1155 CA ALA A 173 -10.149 -15.074 -27.401 1.00 9.54 C ANISOU 1155 CA ALA A 173 1036 1517 1073 -118 -35 -15 C ATOM 1156 C ALA A 173 -8.797 -14.772 -26.786 1.00 9.56 C ANISOU 1156 C ALA A 173 1039 1517 1076 -124 -41 -3 C ATOM 1157 O ALA A 173 -8.358 -13.614 -26.770 1.00 12.50 O ANISOU 1157 O ALA A 173 1415 1889 1447 -127 -49 3 O ATOM 1158 CB ALA A 173 -11.239 -14.774 -26.384 1.00 11.44 C ANISOU 1158 CB ALA A 173 1284 1751 1310 -118 -37 -22 C ATOM 1159 H ALA A 173 -10.833 -16.920 -27.409 1.00 10.21 H ATOM 1160 HA ALA A 173 -10.271 -14.469 -28.149 1.00 11.45 H ATOM 1161 HB1 ALA A 173 -11.133 -13.863 -26.068 1.00 13.72 H ATOM 1162 HB2 ALA A 173 -12.104 -14.879 -26.809 1.00 13.72 H ATOM 1163 HB3 ALA A 173 -11.157 -15.393 -25.642 1.00 13.72 H ATOM 1164 N ARG A 174 -8.139 -15.795 -26.242 1.00 9.40 N ANISOU 1164 N ARG A 174 1014 1496 1059 -125 -36 1 N ATOM 1165 CA ARG A 174 -6.855 -15.609 -25.571 1.00 10.09 C ANISOU 1165 CA ARG A 174 1103 1583 1149 -129 -42 12 C ATOM 1166 C ARG A 174 -5.784 -16.559 -26.049 1.00 11.03 C ANISOU 1166 C ARG A 174 1213 1705 1272 -130 -37 19 C ATOM 1167 O ARG A 174 -6.077 -17.698 -26.442 1.00 8.57 O ANISOU 1167 O ARG A 174 896 1396 963 -126 -28 14 O ATOM 1168 CB ARG A 174 -7.000 -15.785 -24.076 1.00 11.43 C ANISOU 1168 CB ARG A 174 1278 1747 1319 -131 -43 12 C ATOM 1169 CG ARG A 174 -8.066 -14.944 -23.485 1.00 14.41 C ANISOU 1169 CG ARG A 174 1664 2119 1693 -131 -47 6 C ATOM 1170 CD ARG A 174 -8.000 -14.768 -21.966 1.00 20.28 C ANISOU 1170 CD ARG A 174 2413 2856 2435 -134 -52 8 C ATOM 1171 NE ARG A 174 -7.433 -15.881 -21.177 1.00 14.61 N ANISOU 1171 NE ARG A 174 1694 2137 1722 -135 -47 11 N ATOM 1172 CZ ARG A 174 -7.828 -16.169 -19.931 1.00 9.65 C ANISOU 1172 CZ ARG A 174 1070 1504 1094 -135 -47 8 C ATOM 1173 NH1 ARG A 174 -8.799 -15.476 -19.369 1.00 9.24 N ANISOU 1173 NH1 ARG A 174 1025 1448 1038 -135 -50 2 N ATOM 1174 NH2 ARG A 174 -7.246 -17.135 -19.251 1.00 8.45 N ANISOU 1174 NH2 ARG A 174 916 1351 946 -136 -43 11 N ATOM 1175 H ARG A 174 -8.417 -16.609 -26.248 1.00 11.27 H ATOM 1176 HA ARG A 174 -6.545 -14.705 -25.736 1.00 12.11 H ATOM 1177 HB2 ARG A 174 -7.214 -16.713 -23.888 1.00 13.72 H ATOM 1178 HB3 ARG A 174 -6.162 -15.547 -23.649 1.00 13.72 H ATOM 1179 HG2 ARG A 174 -8.016 -14.061 -23.882 1.00 17.29 H ATOM 1180 HG3 ARG A 174 -8.925 -15.345 -23.694 1.00 17.29 H ATOM 1181 HD2 ARG A 174 -7.462 -13.984 -21.778 1.00 24.33 H ATOM 1182 HD3 ARG A 174 -8.902 -14.620 -21.641 1.00 24.33 H ATOM 1183 HE ARG A 174 -6.943 -16.457 -21.587 1.00 17.54 H ATOM 1184 HH11 ARG A 174 -9.172 -14.831 -19.799 1.00 11.09 H ATOM 1185 HH12 ARG A 174 -9.056 -15.666 -18.570 1.00 11.09 H ATOM 1186 HH21 ARG A 174 -6.621 -17.600 -19.615 1.00 10.15 H ATOM 1187 HH22 ARG A 174 -7.522 -17.330 -18.460 1.00 10.15 H ATOM 1188 N SER A 175 -4.530 -16.103 -26.006 1.00 10.05 N ANISOU 1188 N SER A 175 1088 1582 1148 -134 -42 30 N ATOM 1189 CA SER A 175 -3.434 -16.932 -26.476 1.00 9.02 C ANISOU 1189 CA SER A 175 950 1456 1022 -135 -38 37 C ATOM 1190 C SER A 175 -3.270 -18.158 -25.599 1.00 8.43 C ANISOU 1190 C SER A 175 873 1379 951 -135 -32 36 C ATOM 1191 O SER A 175 -2.953 -19.218 -26.097 1.00 9.73 O ANISOU 1191 O SER A 175 1030 1547 1119 -133 -25 36 O ATOM 1192 CB SER A 175 -2.118 -16.161 -26.533 1.00 11.67 C ANISOU 1192 CB SER A 175 1285 1792 1357 -139 -46 49 C ATOM 1193 OG SER A 175 -1.727 -15.817 -25.213 1.00 16.38 O ANISOU 1193 OG SER A 175 1887 2383 1954 -143 -51 54 O ATOM 1194 H SER A 175 -4.295 -15.329 -25.713 1.00 12.06 H ATOM 1195 HA SER A 175 -3.638 -17.236 -27.374 1.00 10.83 H ATOM 1196 HB2 SER A 175 -1.435 -16.719 -26.936 1.00 14.00 H ATOM 1197 HB3 SER A 175 -2.242 -15.351 -27.053 1.00 14.00 H ATOM 1198 HG SER A 175 -1.003 -15.392 -25.230 1.00 19.66 H ATOM 1199 N ASP A 176 -3.459 -18.017 -24.290 1.00 11.56 N ANISOU 1199 N ASP A 176 1276 1770 1347 -137 -35 36 N ATOM 1200 CA ASP A 176 -3.267 -19.158 -23.397 1.00 10.91 C ANISOU 1200 CA ASP A 176 1191 1685 1268 -137 -30 36 C ATOM 1201 C ASP A 176 -4.348 -20.214 -23.605 1.00 8.88 C ANISOU 1201 C ASP A 176 932 1429 1013 -132 -21 25 C ATOM 1202 O ASP A 176 -4.127 -21.400 -23.345 1.00 9.91 O ANISOU 1202 O ASP A 176 1058 1560 1147 -131 -14 25 O ATOM 1203 CB ASP A 176 -3.201 -18.741 -21.921 1.00 12.89 C ANISOU 1203 CB ASP A 176 1450 1929 1517 -140 -36 39 C ATOM 1204 CG ASP A 176 -4.468 -18.068 -21.428 1.00 14.77 C ANISOU 1204 CG ASP A 176 1696 2164 1753 -139 -38 30 C ATOM 1205 OD1 ASP A 176 -4.855 -16.992 -21.972 1.00 14.55 O ANISOU 1205 OD1 ASP A 176 1671 2136 1720 -138 -44 29 O ATOM 1206 OD2 ASP A 176 -5.082 -18.594 -20.468 1.00 16.03 O ANISOU 1206 OD2 ASP A 176 1859 2319 1912 -138 -36 25 O ATOM 1207 H ASP A 176 -3.694 -17.288 -23.899 1.00 13.88 H ATOM 1208 HA ASP A 176 -2.417 -19.572 -23.616 1.00 13.09 H ATOM 1209 HB2 ASP A 176 -3.052 -19.531 -21.378 1.00 15.46 H ATOM 1210 HB3 ASP A 176 -2.467 -18.117 -21.804 1.00 15.46 H ATOM 1211 N GLU A 177 -5.517 -19.767 -24.043 1.00 7.73 N ANISOU 1211 N GLU A 177 790 1284 864 -128 -20 16 N ATOM 1212 CA GLU A 177 -6.637 -20.627 -24.330 1.00 10.65 C ANISOU 1212 CA GLU A 177 1157 1654 1234 -124 -12 5 C ATOM 1213 C GLU A 177 -6.321 -21.429 -25.582 1.00 6.89 C ANISOU 1213 C GLU A 177 672 1185 761 -121 -5 5 C ATOM 1214 O GLU A 177 -6.562 -22.641 -25.622 1.00 8.14 O ANISOU 1214 O GLU A 177 826 1345 923 -118 3 0 O ATOM 1215 CB GLU A 177 -7.879 -19.755 -24.530 1.00 13.08 C ANISOU 1215 CB GLU A 177 1470 1960 1538 -121 -15 -4 C ATOM 1216 CG GLU A 177 -9.164 -20.430 -24.652 1.00 14.16 C ANISOU 1216 CG GLU A 177 1607 2098 1675 -117 -8 -16 C ATOM 1217 CD GLU A 177 -10.307 -19.398 -24.806 1.00 13.86 C ANISOU 1217 CD GLU A 177 1575 2057 1632 -115 -12 -23 C ATOM 1218 OE1 GLU A 177 -10.056 -18.159 -24.911 1.00 17.57 O ANISOU 1218 OE1 GLU A 177 2050 2527 2099 -118 -20 -18 O ATOM 1219 OE2 GLU A 177 -11.449 -19.844 -24.801 1.00 24.87 O ANISOU 1219 OE2 GLU A 177 2971 3451 3026 -111 -7 -33 O ATOM 1220 H GLU A 177 -5.684 -18.935 -24.185 1.00 9.28 H ATOM 1221 HA GLU A 177 -6.790 -21.236 -23.590 1.00 12.78 H ATOM 1222 HB2 GLU A 177 -7.947 -19.152 -23.773 1.00 15.69 H ATOM 1223 HB3 GLU A 177 -7.754 -19.236 -25.339 1.00 15.69 H ATOM 1224 HG2 GLU A 177 -9.156 -20.999 -25.438 1.00 16.99 H ATOM 1225 HG3 GLU A 177 -9.330 -20.956 -23.854 1.00 16.99 H ATOM 1226 N ARG A 178 -5.782 -20.764 -26.607 1.00 6.77 N ANISOU 1226 N ARG A 178 654 1173 745 -122 -8 10 N ATOM 1227 CA ARG A 178 -5.294 -21.487 -27.760 1.00 6.71 C ANISOU 1227 CA ARG A 178 638 1172 740 -120 -3 11 C ATOM 1228 C ARG A 178 -4.223 -22.488 -27.366 1.00 7.12 C ANISOU 1228 C ARG A 178 685 1225 797 -122 1 18 C ATOM 1229 O ARG A 178 -4.243 -23.640 -27.808 1.00 8.04 O ANISOU 1229 O ARG A 178 795 1344 916 -119 9 15 O ATOM 1230 CB ARG A 178 -4.711 -20.559 -28.823 1.00 9.02 C ANISOU 1230 CB ARG A 178 928 1468 1030 -121 -8 17 C ATOM 1231 CG ARG A 178 -4.143 -21.349 -29.979 1.00 7.90 C ANISOU 1231 CG ARG A 178 778 1333 892 -119 -1 19 C ATOM 1232 CD ARG A 178 -3.580 -20.540 -31.092 1.00 14.19 C ANISOU 1232 CD ARG A 178 1571 2133 1687 -120 -6 24 C ATOM 1233 NE ARG A 178 -2.550 -19.640 -30.635 1.00 19.41 N ANISOU 1233 NE ARG A 178 2235 2792 2346 -125 -14 35 N ATOM 1234 CZ ARG A 178 -2.095 -18.611 -31.344 1.00 23.47 C ANISOU 1234 CZ ARG A 178 2750 3308 2858 -127 -20 40 C ATOM 1235 NH1 ARG A 178 -2.590 -18.327 -32.556 1.00 17.10 N ANISOU 1235 NH1 ARG A 178 1941 2506 2050 -124 -19 36 N ATOM 1236 NH2 ARG A 178 -1.156 -17.845 -30.830 1.00 21.68 N ANISOU 1236 NH2 ARG A 178 2526 3080 2631 -132 -28 50 N ATOM 1237 H ARG A 178 -5.694 -19.910 -26.652 1.00 8.12 H ATOM 1238 HA ARG A 178 -6.030 -21.976 -28.160 1.00 8.05 H ATOM 1239 HB2 ARG A 178 -5.411 -19.979 -29.163 1.00 10.82 H ATOM 1240 HB3 ARG A 178 -3.996 -20.031 -28.433 1.00 10.82 H ATOM 1241 HG2 ARG A 178 -3.432 -21.916 -29.643 1.00 9.48 H ATOM 1242 HG3 ARG A 178 -4.850 -21.901 -30.349 1.00 9.48 H ATOM 1243 HD2 ARG A 178 -3.191 -21.134 -31.753 1.00 17.03 H ATOM 1244 HD3 ARG A 178 -4.288 -20.012 -31.493 1.00 17.03 H ATOM 1245 HE ARG A 178 -2.156 -19.823 -29.893 1.00 23.29 H ATOM 1246 HH11 ARG A 178 -3.206 -18.821 -32.895 1.00 20.52 H ATOM 1247 HH12 ARG A 178 -2.285 -17.655 -32.998 1.00 20.52 H ATOM 1248 HH21 ARG A 178 -0.837 -18.021 -30.051 1.00 26.01 H ATOM 1249 HH22 ARG A 178 -0.854 -17.175 -31.276 1.00 26.01 H ATOM 1250 N LYS A 179 -3.274 -22.066 -26.538 1.00 6.50 N ANISOU 1250 N LYS A 179 615 996 860 18 303 102 N ATOM 1251 CA LYS A 179 -2.210 -22.980 -26.121 1.00 9.07 C ANISOU 1251 CA LYS A 179 939 1322 1186 21 304 109 C ATOM 1252 C LYS A 179 -2.719 -24.261 -25.468 1.00 8.49 C ANISOU 1252 C LYS A 179 868 1245 1112 22 308 110 C ATOM 1253 O LYS A 179 -2.282 -25.373 -25.802 1.00 9.93 O ANISOU 1253 O LYS A 179 1051 1425 1297 25 312 113 O ATOM 1254 CB LYS A 179 -1.213 -22.276 -25.199 1.00 8.63 C ANISOU 1254 CB LYS A 179 880 1270 1129 20 300 115 C ATOM 1255 CG LYS A 179 -0.050 -23.154 -24.742 1.00 11.51 C ANISOU 1255 CG LYS A 179 1243 1636 1494 23 301 123 C ATOM 1256 CD LYS A 179 0.803 -22.448 -23.690 1.00 18.94 C ANISOU 1256 CD LYS A 179 2182 2582 2433 21 296 128 C ATOM 1257 CE LYS A 179 1.572 -21.298 -24.242 1.00 28.01 C ANISOU 1257 CE LYS A 179 3326 3733 3582 21 293 129 C ATOM 1258 NZ LYS A 179 2.436 -20.689 -23.165 1.00 31.27 N ANISOU 1258 NZ LYS A 179 3737 4151 3993 19 288 134 N ATOM 1259 H LYS A 179 -3.221 -21.273 -26.207 1.00 7.80 H ATOM 1260 HA LYS A 179 -1.720 -23.245 -26.915 1.00 10.89 H ATOM 1261 HB2 LYS A 179 -0.840 -21.514 -25.668 1.00 10.36 H ATOM 1262 HB3 LYS A 179 -1.684 -21.974 -24.406 1.00 10.36 H ATOM 1263 HG2 LYS A 179 -0.399 -23.971 -24.352 1.00 13.81 H ATOM 1264 HG3 LYS A 179 0.514 -23.360 -25.503 1.00 13.81 H ATOM 1265 HD2 LYS A 179 0.224 -22.111 -22.988 1.00 22.73 H ATOM 1266 HD3 LYS A 179 1.437 -23.082 -23.321 1.00 22.73 H ATOM 1267 HE2 LYS A 179 2.146 -21.606 -24.961 1.00 33.61 H ATOM 1268 HE3 LYS A 179 0.957 -20.620 -24.564 1.00 33.61 H ATOM 1269 HZ1 LYS A 179 2.895 -20.002 -23.495 1.00 37.52 H ATOM 1270 HZ2 LYS A 179 1.928 -20.401 -22.494 1.00 37.52 H ATOM 1271 HZ3 LYS A 179 3.008 -21.297 -22.854 1.00 37.52 H ATOM 1272 N ARG A 180 -3.674 -24.098 -24.570 1.00 7.80 N ANISOU 1272 N ARG A 180 782 1158 1023 18 307 106 N ATOM 1273 CA ARG A 180 -4.251 -25.203 -23.866 1.00 9.04 C ANISOU 1273 CA ARG A 180 943 1313 1180 17 310 106 C ATOM 1274 C ARG A 180 -4.956 -26.147 -24.852 1.00 8.74 C ANISOU 1274 C ARG A 180 907 1269 1144 20 316 102 C ATOM 1275 O ARG A 180 -4.962 -27.361 -24.671 1.00 11.56 O ANISOU 1275 O ARG A 180 1266 1624 1502 22 319 104 O ATOM 1276 CB ARG A 180 -5.226 -24.692 -22.817 1.00 8.44 C ANISOU 1276 CB ARG A 180 868 1237 1101 13 308 102 C ATOM 1277 CG ARG A 180 -5.910 -25.793 -22.037 1.00 10.30 C ANISOU 1277 CG ARG A 180 1107 1471 1337 12 312 101 C ATOM 1278 CD ARG A 180 -6.814 -25.246 -20.943 1.00 9.24 C ANISOU 1278 CD ARG A 180 974 1337 1199 7 310 97 C ATOM 1279 NE ARG A 180 -8.014 -24.666 -21.529 1.00 8.56 N ANISOU 1279 NE ARG A 180 889 1250 1113 5 310 89 N ATOM 1280 CZ ARG A 180 -9.024 -24.109 -20.854 1.00 7.77 C ANISOU 1280 CZ ARG A 180 791 1150 1011 1 308 84 C ATOM 1281 NH1 ARG A 180 -8.974 -24.039 -19.524 1.00 7.50 N ANISOU 1281 NH1 ARG A 180 757 1118 974 -1 306 87 N ATOM 1282 NH2 ARG A 180 -10.090 -23.648 -21.489 1.00 8.28 N ANISOU 1282 NH2 ARG A 180 857 1213 1076 -1 308 77 N ATOM 1283 H ARG A 180 -4.007 -23.336 -24.353 1.00 9.36 H ATOM 1284 HA ARG A 180 -3.550 -25.699 -23.416 1.00 10.85 H ATOM 1285 HB2 ARG A 180 -4.743 -24.136 -22.185 1.00 10.13 H ATOM 1286 HB3 ARG A 180 -5.914 -24.168 -23.257 1.00 10.13 H ATOM 1287 HG2 ARG A 180 -6.454 -26.321 -22.643 1.00 12.37 H ATOM 1288 HG3 ARG A 180 -5.236 -26.353 -21.620 1.00 12.37 H ATOM 1289 HD2 ARG A 180 -7.079 -25.967 -20.350 1.00 11.08 H ATOM 1290 HD3 ARG A 180 -6.346 -24.554 -20.450 1.00 11.08 H ATOM 1291 HE ARG A 180 -8.079 -24.682 -22.386 1.00 10.27 H ATOM 1292 HH11 ARG A 180 -8.291 -24.348 -19.102 1.00 9.00 H ATOM 1293 HH12 ARG A 180 -9.622 -23.679 -19.088 1.00 9.00 H ATOM 1294 HH21 ARG A 180 -10.129 -23.685 -22.347 1.00 9.94 H ATOM 1295 HH22 ARG A 180 -10.729 -23.280 -21.045 1.00 9.94 H ATOM 1296 N HIS A 181 -5.514 -25.580 -25.903 1.00 8.13 N ANISOU 1296 N HIS A 181 829 1191 1067 20 315 96 N ATOM 1297 CA HIS A 181 -6.197 -26.364 -26.921 1.00 7.07 C ANISOU 1297 CA HIS A 181 697 1052 935 22 320 92 C ATOM 1298 C HIS A 181 -5.269 -27.138 -27.865 1.00 8.57 C ANISOU 1298 C HIS A 181 887 1241 1128 27 323 96 C ATOM 1299 O HIS A 181 -5.557 -28.279 -28.182 1.00 8.74 O ANISOU 1299 O HIS A 181 910 1259 1151 29 327 96 O ATOM 1300 CB HIS A 181 -7.113 -25.455 -27.737 1.00 6.02 C ANISOU 1300 CB HIS A 181 565 919 802 20 319 84 C ATOM 1301 CG HIS A 181 -7.489 -26.032 -29.055 1.00 5.79 C ANISOU 1301 CG HIS A 181 537 886 775 23 322 81 C ATOM 1302 ND1 HIS A 181 -8.598 -26.829 -29.207 1.00 7.64 N ANISOU 1302 ND1 HIS A 181 775 1117 1010 22 326 76 N ATOM 1303 CD2 HIS A 181 -6.886 -25.979 -30.268 1.00 10.68 C ANISOU 1303 CD2 HIS A 181 1155 1505 1396 26 323 82 C ATOM 1304 CE1 HIS A 181 -8.674 -27.235 -30.464 1.00 6.45 C ANISOU 1304 CE1 HIS A 181 625 963 862 25 329 74 C ATOM 1305 NE2 HIS A 181 -7.638 -26.741 -31.128 1.00 6.72 N ANISOU 1305 NE2 HIS A 181 656 999 897 28 327 78 N ATOM 1306 H HIS A 181 -5.513 -24.734 -26.054 1.00 9.75 H ATOM 1307 HA HIS A 181 -6.760 -27.015 -26.475 1.00 8.48 H ATOM 1308 HB2 HIS A 181 -7.929 -25.300 -27.236 1.00 7.22 H ATOM 1309 HB3 HIS A 181 -6.659 -24.613 -27.898 1.00 7.22 H ATOM 1310 HD1 HIS A 181 -9.155 -27.031 -28.584 1.00 9.17 H ATOM 1311 HD2 HIS A 181 -6.103 -25.522 -30.476 1.00 12.81 H ATOM 1312 HE1 HIS A 181 -9.340 -27.777 -30.821 1.00 7.74 H ATOM 1313 N THR A 182 -4.195 -26.514 -28.346 1.00 10.54 N ANISOU 1313 N THR A 182 1134 1493 1379 29 320 100 N ATOM 1314 CA THR A 182 -3.378 -27.146 -29.368 1.00 8.57 C ANISOU 1314 CA THR A 182 884 1242 1132 33 323 104 C ATOM 1315 C THR A 182 -2.898 -28.517 -28.958 1.00 9.57 C ANISOU 1315 C THR A 182 1010 1366 1259 36 327 109 C ATOM 1316 O THR A 182 -2.805 -29.402 -29.789 1.00 11.29 O ANISOU 1316 O THR A 182 1229 1581 1479 39 331 109 O ATOM 1317 CB THR A 182 -2.213 -26.256 -29.731 1.00 9.74 C ANISOU 1317 CB THR A 182 1027 1393 1280 34 320 108 C ATOM 1318 OG1 THR A 182 -2.699 -24.972 -30.116 1.00 10.04 O ANISOU 1318 OG1 THR A 182 1065 1433 1316 32 317 103 O ATOM 1319 CG2 THR A 182 -1.411 -26.828 -30.887 1.00 8.87 C ANISOU 1319 CG2 THR A 182 916 1281 1172 39 323 111 C ATOM 1320 H THR A 182 -3.924 -25.736 -28.099 1.00 12.65 H ATOM 1321 HA THR A 182 -3.919 -27.256 -30.166 1.00 10.29 H ATOM 1322 HB THR A 182 -1.625 -26.164 -28.965 1.00 11.69 H ATOM 1323 HG1 THR A 182 -3.125 -24.624 -29.481 1.00 12.04 H ATOM 1324 HG21 THR A 182 -0.670 -26.239 -31.100 1.00 10.64 H ATOM 1325 HG22 THR A 182 -1.061 -27.701 -30.649 1.00 10.64 H ATOM 1326 HG23 THR A 182 -1.977 -26.918 -31.670 1.00 10.64 H ATOM 1327 N LYS A 183 -2.665 -28.724 -27.660 1.00 11.96 N ANISOU 1327 N LYS A 183 1313 1670 1560 34 326 113 N ATOM 1328 CA LYS A 183 -2.184 -30.025 -27.207 1.00 12.77 C ANISOU 1328 CA LYS A 183 1416 1771 1663 37 329 118 C ATOM 1329 C LYS A 183 -3.132 -31.192 -27.358 1.00 14.73 C ANISOU 1329 C LYS A 183 1668 2015 1913 37 335 115 C ATOM 1330 O LYS A 183 -2.707 -32.349 -27.310 1.00 19.41 O ANISOU 1330 O LYS A 183 2262 2606 2507 40 338 119 O ATOM 1331 CB LYS A 183 -1.776 -29.947 -25.744 1.00 19.53 C ANISOU 1331 CB LYS A 183 2271 2631 2517 35 327 123 C ATOM 1332 CG LYS A 183 -2.959 -30.066 -24.833 1.00 21.80 C ANISOU 1332 CG LYS A 183 2562 2917 2803 31 327 118 C ATOM 1333 CD LYS A 183 -2.594 -29.875 -23.375 1.00 37.02 C ANISOU 1333 CD LYS A 183 4488 4848 4728 29 324 123 C ATOM 1334 CE LYS A 183 -3.817 -30.099 -22.511 1.00 33.17 C ANISOU 1334 CE LYS A 183 4004 4359 4239 25 325 118 C ATOM 1335 NZ LYS A 183 -4.929 -29.139 -22.839 1.00 22.82 N ANISOU 1335 NZ LYS A 183 2694 3048 2927 22 323 110 N ATOM 1336 H LYS A 183 -2.776 -28.142 -27.037 1.00 14.35 H ATOM 1337 HA LYS A 183 -1.387 -30.241 -27.715 1.00 15.32 H ATOM 1338 HB2 LYS A 183 -1.164 -30.673 -25.544 1.00 23.43 H ATOM 1339 HB3 LYS A 183 -1.349 -29.093 -25.576 1.00 23.43 H ATOM 1340 HG2 LYS A 183 -3.611 -29.389 -25.071 1.00 26.16 H ATOM 1341 HG3 LYS A 183 -3.346 -30.950 -24.932 1.00 26.16 H ATOM 1342 HD2 LYS A 183 -1.914 -30.518 -23.121 1.00 44.42 H ATOM 1343 HD3 LYS A 183 -2.278 -28.969 -23.234 1.00 44.42 H ATOM 1344 HE2 LYS A 183 -4.146 -31.001 -22.653 1.00 39.80 H ATOM 1345 HE3 LYS A 183 -3.576 -29.975 -21.579 1.00 39.80 H ATOM 1346 HZ1 LYS A 183 -5.631 -29.296 -22.316 1.00 27.38 H ATOM 1347 HZ2 LYS A 183 -4.654 -28.302 -22.711 1.00 27.38 H ATOM 1348 HZ3 LYS A 183 -5.174 -29.236 -23.689 1.00 27.38 H ATOM 1349 N ILE A 184 -4.420 -30.941 -27.544 1.00 11.90 N ANISOU 1349 N ILE A 184 1312 1655 1554 35 335 107 N ATOM 1350 CA ILE A 184 -5.346 -32.039 -27.695 1.00 13.65 C ANISOU 1350 CA ILE A 184 1537 1872 1777 35 340 103 C ATOM 1351 C ILE A 184 -5.096 -32.802 -28.984 1.00 15.31 C ANISOU 1351 C ILE A 184 1748 2080 1991 39 344 103 C ATOM 1352 O ILE A 184 -5.547 -33.930 -29.134 1.00 15.49 O ANISOU 1352 O ILE A 184 1773 2098 2014 41 349 102 O ATOM 1353 CB ILE A 184 -6.820 -31.590 -27.593 1.00 12.67 C ANISOU 1353 CB ILE A 184 1415 1747 1652 31 339 95 C ATOM 1354 CG1 ILE A 184 -7.301 -30.911 -28.872 1.00 10.32 C ANISOU 1354 CG1 ILE A 184 1118 1449 1355 31 339 89 C ATOM 1355 CG2 ILE A 184 -7.018 -30.713 -26.358 1.00 12.70 C ANISOU 1355 CG2 ILE A 184 1419 1755 1653 27 335 95 C ATOM 1356 CD1 ILE A 184 -8.779 -30.550 -28.848 1.00 12.47 C ANISOU 1356 CD1 ILE A 184 1393 1720 1627 28 339 81 C ATOM 1357 H ILE A 184 -4.774 -30.158 -27.586 1.00 14.28 H ATOM 1358 HA ILE A 184 -5.191 -32.660 -26.967 1.00 16.38 H ATOM 1359 HB ILE A 184 -7.358 -32.387 -27.470 1.00 15.20 H ATOM 1360 HG12 ILE A 184 -6.797 -30.093 -29.001 1.00 12.39 H ATOM 1361 HG13 ILE A 184 -7.153 -31.511 -29.619 1.00 12.39 H ATOM 1362 HG21 ILE A 184 -7.948 -30.441 -26.310 1.00 15.24 H ATOM 1363 HG22 ILE A 184 -6.781 -31.224 -25.568 1.00 15.24 H ATOM 1364 HG23 ILE A 184 -6.447 -29.932 -26.431 1.00 15.24 H ATOM 1365 HD11 ILE A 184 -9.013 -30.125 -29.688 1.00 14.97 H ATOM 1366 HD12 ILE A 184 -9.299 -31.360 -28.730 1.00 14.97 H ATOM 1367 HD13 ILE A 184 -8.942 -29.940 -28.111 1.00 14.97 H ATOM 1368 N HIS A 185 -4.374 -32.192 -29.913 1.00 14.04 N ANISOU 1368 N HIS A 185 1584 1919 1830 41 342 104 N ATOM 1369 CA HIS A 185 -4.112 -32.829 -31.199 1.00 14.77 C ANISOU 1369 CA HIS A 185 1677 2009 1925 45 346 104 C ATOM 1370 C HIS A 185 -2.982 -33.851 -31.131 1.00 18.04 C ANISOU 1370 C HIS A 185 2090 2422 2341 49 349 112 C ATOM 1371 O HIS A 185 -2.731 -34.543 -32.118 1.00 19.13 O ANISOU 1371 O HIS A 185 2230 2558 2482 53 352 112 O ATOM 1372 CB HIS A 185 -3.785 -31.781 -32.249 1.00 14.54 C ANISOU 1372 CB HIS A 185 1647 1982 1897 46 343 103 C ATOM 1373 CG HIS A 185 -4.910 -30.834 -32.527 1.00 9.71 C ANISOU 1373 CG HIS A 185 1036 1371 1284 43 341 95 C ATOM 1374 ND1 HIS A 185 -6.146 -31.260 -32.964 1.00 14.32 N ANISOU 1374 ND1 HIS A 185 1623 1951 1868 42 344 88 N ATOM 1375 CD2 HIS A 185 -4.990 -29.481 -32.422 1.00 10.65 C ANISOU 1375 CD2 HIS A 185 1153 1494 1401 40 336 93 C ATOM 1376 CE1 HIS A 185 -6.932 -30.204 -33.136 1.00 11.54 C ANISOU 1376 CE1 HIS A 185 1270 1600 1514 39 341 82 C ATOM 1377 NE2 HIS A 185 -6.260 -29.114 -32.809 1.00 11.99 N ANISOU 1377 NE2 HIS A 185 1324 1661 1570 38 336 85 N ATOM 1378 H HIS A 185 -4.024 -31.411 -29.826 1.00 16.85 H ATOM 1379 HA HIS A 185 -4.914 -33.294 -31.484 1.00 17.72 H ATOM 1380 HB2 HIS A 185 -3.026 -31.259 -31.945 1.00 17.45 H ATOM 1381 HB3 HIS A 185 -3.563 -32.230 -33.080 1.00 17.45 H ATOM 1382 HD1 HIS A 185 -6.367 -32.076 -33.119 1.00 17.19 H ATOM 1383 HD2 HIS A 185 -4.309 -28.908 -32.149 1.00 12.79 H ATOM 1384 HE1 HIS A 185 -7.816 -30.229 -33.423 1.00 13.85 H ATOM 1385 N LEU A 186 -2.300 -33.929 -29.986 1.00 14.47 N ANISOU 1385 N LEU A 186 1637 1973 1888 49 347 118 N ATOM 1386 CA LEU A 186 -1.245 -34.947 -29.801 1.00 15.88 C ANISOU 1386 CA LEU A 186 1816 2151 2068 52 350 126 C ATOM 1387 C LEU A 186 -1.802 -36.379 -29.777 1.00 30.54 C ANISOU 1387 C LEU A 186 3675 4003 3927 54 356 125 C ATOM 1388 O LEU A 186 -3.019 -36.597 -29.841 1.00 27.27 O ANISOU 1388 O LEU A 186 3263 3586 3512 52 357 118 O ATOM 1389 CB LEU A 186 -0.452 -34.675 -28.537 1.00 15.37 C ANISOU 1389 CB LEU A 186 1748 2089 2001 51 347 132 C ATOM 1390 CG LEU A 186 0.397 -33.407 -28.554 1.00 14.32 C ANISOU 1390 CG LEU A 186 1612 1962 1868 51 341 135 C ATOM 1391 CD1 LEU A 186 1.184 -33.366 -27.292 1.00 18.26 C ANISOU 1391 CD1 LEU A 186 2109 2464 2365 50 339 141 C ATOM 1392 CD2 LEU A 186 1.310 -33.362 -29.725 1.00 15.31 C ANISOU 1392 CD2 LEU A 186 1735 2087 1995 54 342 137 C ATOM 1393 H LEU A 186 -2.422 -33.416 -29.307 1.00 17.36 H ATOM 1394 HA LEU A 186 -0.630 -34.888 -30.549 1.00 19.06 H ATOM 1395 HB2 LEU A 186 -1.073 -34.600 -27.795 1.00 18.44 H ATOM 1396 HB3 LEU A 186 0.146 -35.423 -28.383 1.00 18.44 H ATOM 1397 HG LEU A 186 -0.181 -32.628 -28.582 1.00 17.19 H ATOM 1398 HD11 LEU A 186 1.731 -32.565 -27.287 1.00 21.91 H ATOM 1399 HD12 LEU A 186 0.573 -33.355 -26.539 1.00 21.91 H ATOM 1400 HD13 LEU A 186 1.750 -34.153 -27.248 1.00 21.91 H ATOM 1401 HD21 LEU A 186 1.826 -32.541 -29.691 1.00 18.37 H ATOM 1402 HD22 LEU A 186 1.904 -34.127 -29.691 1.00 18.37 H ATOM 1403 HD23 LEU A 186 0.782 -33.388 -30.538 1.00 18.37 H ATOM 1404 N ARG A 187 -0.894 -37.350 -29.712 1.00 31.96 N ANISOU 1404 N ARG A 187 3854 4181 4107 57 359 131 N ATOM 1405 CA ARG A 187 -1.261 -38.768 -29.713 1.00 45.21 C ANISOU 1405 CA ARG A 187 5536 5856 5788 59 364 131 C ATOM 1406 C ARG A 187 -2.433 -39.064 -28.787 1.00 50.18 C ANISOU 1406 C ARG A 187 6167 6483 6415 56 365 127 C ATOM 1407 O ARG A 187 -2.609 -38.392 -27.767 1.00 51.90 O ANISOU 1407 O ARG A 187 6385 6704 6631 52 361 127 O ATOM 1408 CB ARG A 187 -0.068 -39.620 -29.277 1.00 51.91 C ANISOU 1408 CB ARG A 187 6383 6704 6637 63 366 140 C ATOM 1409 CG ARG A 187 0.713 -40.248 -30.411 1.00 50.10 C ANISOU 1409 CG ARG A 187 6152 6472 6411 67 370 143 C ATOM 1410 CD ARG A 187 1.304 -41.578 -29.971 1.00 53.92 C ANISOU 1410 CD ARG A 187 6637 6954 6896 70 374 149 C ATOM 1411 NE ARG A 187 1.893 -41.504 -28.632 1.00 59.05 N ANISOU 1411 NE ARG A 187 7286 7607 7545 69 371 155 N ATOM 1412 CZ ARG A 187 2.685 -42.434 -28.103 1.00 64.30 C ANISOU 1412 CZ ARG A 187 7950 8272 8211 72 374 162 C ATOM 1413 NH1 ARG A 187 3.170 -42.271 -26.877 1.00 60.85 N ANISOU 1413 NH1 ARG A 187 7511 7838 7771 71 371 167 N ATOM 1414 NH2 ARG A 187 3.002 -43.522 -28.798 1.00 63.65 N ANISOU 1414 NH2 ARG A 187 7868 8186 8131 76 379 164 N ATOM 1415 H ARG A 187 -0.046 -37.213 -29.666 1.00 38.35 H ATOM 1416 HA ARG A 187 -1.511 -39.032 -30.612 1.00 54.26 H ATOM 1417 HB2 ARG A 187 0.544 -39.060 -28.775 1.00 62.29 H ATOM 1418 HB3 ARG A 187 -0.391 -40.338 -28.711 1.00 62.29 H ATOM 1419 HG2 ARG A 187 0.121 -40.408 -31.162 1.00 60.12 H ATOM 1420 HG3 ARG A 187 1.439 -39.659 -30.669 1.00 60.12 H ATOM 1421 HD2 ARG A 187 0.603 -42.248 -29.956 1.00 64.70 H ATOM 1422 HD3 ARG A 187 2.001 -41.837 -30.593 1.00 64.70 H ATOM 1423 HE ARG A 187 1.715 -40.811 -28.154 1.00 70.86 H ATOM 1424 HH11 ARG A 187 2.969 -41.568 -26.425 1.00 73.02 H ATOM 1425 HH12 ARG A 187 3.683 -42.871 -26.534 1.00 73.02 H ATOM 1426 HH21 ARG A 187 2.691 -43.631 -29.593 1.00 76.38 H ATOM 1427 HH22 ARG A 187 3.515 -44.119 -28.452 1.00 76.38 H TER 1428 ARG A 187 ATOM 1429 O5' DA B 1 -13.172 -26.384 -24.545 1.00 18.35 O ANISOU 1429 O5' DA B 1 2515 2380 2078 -822 -21 27 O ATOM 1430 C5' DA B 1 -14.513 -26.643 -24.814 1.00 16.98 C ANISOU 1430 C5' DA B 1 2339 2202 1910 -822 -21 25 C ATOM 1431 C4' DA B 1 -15.431 -25.702 -24.079 1.00 17.64 C ANISOU 1431 C4' DA B 1 2421 2286 1995 -822 -20 24 C ATOM 1432 O4' DA B 1 -15.343 -25.953 -22.647 1.00 12.85 O ANISOU 1432 O4' DA B 1 1812 1681 1388 -823 -18 26 O ATOM 1433 C3' DA B 1 -15.143 -24.221 -24.282 1.00 13.55 C ANISOU 1433 C3' DA B 1 1905 1771 1471 -822 -22 24 C ATOM 1434 O3' DA B 1 -16.373 -23.548 -24.490 1.00 15.36 O ANISOU 1434 O3' DA B 1 2133 1999 1705 -822 -22 22 O ATOM 1435 C2' DA B 1 -14.444 -23.815 -22.996 1.00 11.37 C ANISOU 1435 C2' DA B 1 1630 1500 1192 -822 -20 25 C ATOM 1436 C1' DA B 1 -15.076 -24.745 -21.964 1.00 12.89 C ANISOU 1436 C1' DA B 1 1819 1691 1389 -823 -18 26 C ATOM 1437 N9 DA B 1 -14.239 -25.077 -20.826 1.00 9.90 N ANISOU 1437 N9 DA B 1 1440 1314 1006 -823 -16 27 N ATOM 1438 C8 DA B 1 -14.512 -24.838 -19.498 1.00 9.90 C ANISOU 1438 C8 DA B 1 1439 1317 1007 -824 -14 28 C ATOM 1439 N7 DA B 1 -13.597 -25.293 -18.680 1.00 10.58 N ANISOU 1439 N7 DA B 1 1525 1405 1089 -824 -13 30 N ATOM 1440 C5 DA B 1 -12.663 -25.884 -19.532 1.00 9.88 C ANISOU 1440 C5 DA B 1 1439 1316 1000 -824 -14 30 C ATOM 1441 C6 DA B 1 -11.456 -26.554 -19.272 1.00 9.88 C ANISOU 1441 C6 DA B 1 1441 1318 996 -824 -13 32 C ATOM 1442 N6 DA B 1 -10.974 -26.730 -18.043 1.00 14.36 N ANISOU 1442 N6 DA B 1 2007 1888 1561 -824 -11 34 N ATOM 1443 N1 DA B 1 -10.757 -27.018 -20.328 1.00 11.16 N ANISOU 1443 N1 DA B 1 1604 1478 1157 -823 -14 32 N ATOM 1444 C2 DA B 1 -11.257 -26.838 -21.546 1.00 9.86 C ANISOU 1444 C2 DA B 1 1440 1312 995 -823 -16 31 C ATOM 1445 N3 DA B 1 -12.396 -26.254 -21.913 1.00 10.70 N ANISOU 1445 N3 DA B 1 1545 1416 1103 -823 -17 29 N ATOM 1446 C4 DA B 1 -13.055 -25.780 -20.838 1.00 9.88 C ANISOU 1446 C4 DA B 1 1440 1314 1001 -823 -16 29 C ATOM 1447 H5' DA B 1 -14.717 -27.554 -24.549 1.00 20.37 H ATOM 1448 H5'' DA B 1 -14.666 -26.551 -25.768 1.00 20.37 H ATOM 1449 H4' DA B 1 -16.341 -25.878 -24.365 1.00 21.17 H ATOM 1450 H3' DA B 1 -14.554 -24.093 -25.042 1.00 16.26 H ATOM 1451 H2' DA B 1 -13.489 -23.972 -23.059 1.00 13.65 H ATOM 1452 H2'' DA B 1 -14.629 -22.888 -22.782 1.00 13.65 H ATOM 1453 H1' DA B 1 -15.910 -24.360 -21.650 1.00 15.47 H ATOM 1454 H8 DA B 1 -15.273 -24.388 -19.209 1.00 11.88 H ATOM 1455 H61 DA B 1 -10.225 -27.136 -17.930 1.00 17.23 H ATOM 1456 H62 DA B 1 -11.412 -26.438 -17.364 1.00 17.23 H ATOM 1457 H2 DA B 1 -10.750 -27.192 -22.241 1.00 11.83 H ATOM 1458 HO5' DA B 1 -12.934 -26.168 -23.769 1.00 22.02 H ATOM 1459 P DG B 2 -16.440 -22.056 -25.049 1.00 21.28 P ANISOU 1459 P DG B 2 2884 2750 2451 -821 -24 21 P ATOM 1460 OP1 DG B 2 -17.796 -21.822 -25.596 1.00 27.53 O ANISOU 1460 OP1 DG B 2 3674 3539 3248 -821 -25 19 O ATOM 1461 OP2 DG B 2 -15.218 -21.885 -25.844 1.00 20.17 O ANISOU 1461 OP2 DG B 2 2747 2612 2305 -821 -25 22 O ATOM 1462 O5' DG B 2 -16.337 -21.120 -23.753 1.00 17.35 O ANISOU 1462 O5' DG B 2 2386 2256 1950 -822 -23 21 O ATOM 1463 C5' DG B 2 -17.436 -20.991 -22.898 1.00 16.73 C ANISOU 1463 C5' DG B 2 2304 2177 1875 -822 -21 21 C ATOM 1464 C4' DG B 2 -17.087 -20.106 -21.716 1.00 21.43 C ANISOU 1464 C4' DG B 2 2900 2776 2466 -823 -20 21 C ATOM 1465 O4' DG B 2 -16.081 -20.759 -20.898 1.00 16.36 O ANISOU 1465 O4' DG B 2 2259 2137 1821 -823 -19 23 O ATOM 1466 C3' DG B 2 -16.506 -18.741 -22.062 1.00 25.63 C ANISOU 1466 C3' DG B 2 3435 3311 2993 -822 -22 21 C ATOM 1467 O3' DG B 2 -17.181 -17.768 -21.249 1.00 20.10 O ANISOU 1467 O3' DG B 2 2733 2612 2293 -823 -21 20 O ATOM 1468 C2' DG B 2 -14.994 -18.896 -21.749 1.00 24.90 C ANISOU 1468 C2' DG B 2 3345 3222 2893 -822 -21 23 C ATOM 1469 C1' DG B 2 -15.063 -19.816 -20.561 1.00 14.91 C ANISOU 1469 C1' DG B 2 2078 1957 1631 -823 -19 24 C ATOM 1470 N9 DG B 2 -13.898 -20.608 -20.189 1.00 10.50 N ANISOU 1470 N9 DG B 2 1521 1400 1069 -823 -18 25 N ATOM 1471 C8 DG B 2 -13.025 -21.297 -20.993 1.00 10.73 C ANISOU 1471 C8 DG B 2 1552 1429 1096 -822 -19 26 C ATOM 1472 N7 DG B 2 -12.161 -22.025 -20.324 1.00 9.82 N ANISOU 1472 N7 DG B 2 1436 1315 978 -823 -17 28 N ATOM 1473 C5 DG B 2 -12.511 -21.818 -18.996 1.00 9.83 C ANISOU 1473 C5 DG B 2 1436 1317 980 -823 -15 28 C ATOM 1474 C6 DG B 2 -11.961 -22.326 -17.822 1.00 9.83 C ANISOU 1474 C6 DG B 2 1435 1320 979 -824 -14 30 C ATOM 1475 O6 DG B 2 -11.001 -23.069 -17.680 1.00 9.82 O ANISOU 1475 O6 DG B 2 1436 1320 976 -824 -13 31 O ATOM 1476 N1 DG B 2 -12.613 -21.845 -16.698 1.00 9.84 N ANISOU 1476 N1 DG B 2 1435 1322 981 -825 -12 29 N ATOM 1477 C2 DG B 2 -13.700 -21.015 -16.722 1.00 9.96 C ANISOU 1477 C2 DG B 2 1449 1337 1000 -825 -12 28 C ATOM 1478 N2 DG B 2 -14.220 -20.676 -15.540 1.00 12.83 N ANISOU 1478 N2 DG B 2 1809 1701 1363 -826 -11 28 N ATOM 1479 N3 DG B 2 -14.233 -20.536 -17.805 1.00 9.85 N ANISOU 1479 N3 DG B 2 1435 1320 986 -824 -14 26 N ATOM 1480 C4 DG B 2 -13.588 -20.961 -18.907 1.00 9.84 C ANISOU 1480 C4 DG B 2 1435 1318 984 -824 -16 27 C ATOM 1481 H5' DG B 2 -17.695 -21.868 -22.576 1.00 20.08 H ATOM 1482 H5'' DG B 2 -18.176 -20.596 -23.385 1.00 20.08 H ATOM 1483 H4' DG B 2 -17.885 -19.975 -21.180 1.00 25.71 H ATOM 1484 H3' DG B 2 -16.638 -18.548 -23.004 1.00 30.76 H ATOM 1485 H2' DG B 2 -14.523 -19.312 -22.488 1.00 29.88 H ATOM 1486 H2'' DG B 2 -14.596 -18.044 -21.510 1.00 29.88 H ATOM 1487 H1' DG B 2 -15.353 -19.306 -19.788 1.00 17.90 H ATOM 1488 H8 DG B 2 -13.039 -21.247 -21.922 1.00 12.88 H ATOM 1489 H1 DG B 2 -12.336 -22.116 -15.931 1.00 11.81 H ATOM 1490 H21 DG B 2 -14.883 -20.129 -15.503 1.00 15.39 H ATOM 1491 H22 DG B 2 -13.892 -21.004 -14.816 1.00 15.39 H HETATM 1492 N1 5CM B 3 -11.789 -17.764 -18.478 1.00 9.97 N ANISOU 1492 N1 5CM B 3 1458 1344 984 -823 -17 27 N HETATM 1493 C2 5CM B 3 -11.311 -18.470 -17.287 1.00 10.34 C ANISOU 1493 C2 5CM B 3 1505 1394 1031 -824 -15 28 C HETATM 1494 N3 5CM B 3 -10.258 -19.459 -17.424 1.00 9.76 N ANISOU 1494 N3 5CM B 3 1433 1320 955 -824 -15 30 N HETATM 1495 C4 5CM B 3 -9.709 -19.749 -18.692 1.00 9.75 C ANISOU 1495 C4 5CM B 3 1433 1317 952 -823 -17 30 C HETATM 1496 C5 5CM B 3 -10.195 -19.056 -19.904 1.00 9.75 C ANISOU 1496 C5 5CM B 3 1435 1317 954 -822 -19 28 C HETATM 1497 C5A 5CM B 3 -9.578 -19.416 -21.253 1.00 11.30 C ANISOU 1497 C5A 5CM B 3 1633 1511 1149 -821 -21 28 C HETATM 1498 C6 5CM B 3 -11.244 -18.049 -19.743 1.00 9.75 C ANISOU 1498 C6 5CM B 3 1433 1316 955 -822 -19 27 C HETATM 1499 O2 5CM B 3 -11.803 -18.195 -16.203 1.00 12.60 O ANISOU 1499 O2 5CM B 3 1789 1681 1318 -824 -14 28 O HETATM 1500 N4 5CM B 3 -8.698 -20.708 -18.752 1.00 13.17 N ANISOU 1500 N4 5CM B 3 1868 1752 1385 -823 -16 31 N HETATM 1501 C1' 5CM B 3 -12.697 -16.656 -18.276 1.00 13.07 C ANISOU 1501 C1' 5CM B 3 1851 1738 1379 -823 -17 25 C HETATM 1502 C2' 5CM B 3 -12.556 -15.459 -19.189 1.00 11.44 C ANISOU 1502 C2' 5CM B 3 1646 1532 1169 -822 -19 24 C HETATM 1503 C3' 5CM B 3 -13.803 -14.719 -18.748 1.00 12.62 C ANISOU 1503 C3' 5CM B 3 1793 1681 1322 -823 -19 23 C HETATM 1504 C4' 5CM B 3 -14.759 -15.836 -18.289 1.00 14.17 C ANISOU 1504 C4' 5CM B 3 1986 1874 1525 -823 -17 23 C HETATM 1505 O4' 5CM B 3 -14.017 -17.063 -18.469 1.00 11.97 O ANISOU 1505 O4' 5CM B 3 1708 1594 1245 -823 -17 24 O HETATM 1506 O3' 5CM B 3 -13.514 -13.971 -17.588 1.00 13.02 O ANISOU 1506 O3' 5CM B 3 1843 1734 1368 -823 -17 23 O HETATM 1507 C5' 5CM B 3 -16.060 -15.919 -19.041 1.00 22.59 C ANISOU 1507 C5' 5CM B 3 3050 2936 2598 -823 -18 21 C HETATM 1508 O5' 5CM B 3 -15.742 -15.881 -20.404 1.00 15.97 O ANISOU 1508 O5' 5CM B 3 2214 2097 1759 -822 -21 21 O HETATM 1509 P 5CM B 3 -16.909 -16.208 -21.456 1.00 19.69 P ANISOU 1509 P 5CM B 3 2683 2563 2236 -822 -22 19 P HETATM 1510 OP1 5CM B 3 -18.192 -15.466 -21.053 1.00 25.11 O ANISOU 1510 OP1 5CM B 3 3367 3248 2926 -822 -22 18 O HETATM 1511 OP2 5CM B 3 -16.182 -15.928 -22.738 1.00 13.46 O ANISOU 1511 OP2 5CM B 3 1897 1774 1443 -821 -24 19 O HETATM 1512 H5A1 5CM B 3 -9.988 -18.879 -21.949 1.00 13.56 H HETATM 1513 H5A2 5CM B 3 -8.624 -19.243 -21.231 1.00 13.56 H HETATM 1514 H5A3 5CM B 3 -9.732 -20.356 -21.438 1.00 13.56 H HETATM 1515 H6 5CM B 3 -11.527 -17.561 -20.483 1.00 11.70 H HETATM 1516 HN41 5CM B 3 -8.483 -21.146 -18.044 1.00 15.81 H HETATM 1517 HN42 5CM B 3 -8.386 -20.950 -19.516 1.00 15.81 H HETATM 1518 H1' 5CM B 3 -12.601 -16.352 -17.360 1.00 15.69 H HETATM 1519 H2' 5CM B 3 -11.753 -14.954 -18.991 1.00 13.73 H HETATM 1520 H2'' 5CM B 3 -12.603 -15.713 -20.124 1.00 13.73 H HETATM 1521 H3' 5CM B 3 -14.182 -14.176 -19.456 1.00 15.15 H HETATM 1522 H4' 5CM B 3 -14.950 -15.719 -17.345 1.00 17.01 H HETATM 1523 H5' 5CM B 3 -16.624 -15.164 -18.811 1.00 27.11 H HETATM 1524 H5'' 5CM B 3 -16.514 -16.750 -18.831 1.00 27.11 H ATOM 1525 P DG B 4 -13.357 -12.387 -17.568 1.00 11.88 P ANISOU 1525 P DG B 4 1701 1593 1220 -823 -18 22 P ATOM 1526 OP1 DG B 4 -14.643 -11.759 -17.939 1.00 13.56 O ANISOU 1526 OP1 DG B 4 1912 1804 1438 -823 -19 20 O ATOM 1527 OP2 DG B 4 -12.139 -11.960 -18.307 1.00 11.63 O ANISOU 1527 OP2 DG B 4 1673 1564 1183 -822 -20 23 O ATOM 1528 O5' DG B 4 -13.066 -12.151 -16.038 1.00 12.04 O ANISOU 1528 O5' DG B 4 1721 1617 1238 -824 -16 23 O ATOM 1529 C5' DG B 4 -13.952 -12.675 -15.057 1.00 11.59 C ANISOU 1529 C5' DG B 4 1660 1559 1186 -825 -14 22 C ATOM 1530 C4' DG B 4 -13.189 -13.040 -13.795 1.00 13.25 C ANISOU 1530 C4' DG B 4 1870 1772 1393 -825 -12 24 C ATOM 1531 O4' DG B 4 -12.474 -14.278 -14.006 1.00 13.54 O ANISOU 1531 O4' DG B 4 1907 1808 1428 -825 -12 25 O ATOM 1532 C3' DG B 4 -12.149 -12.009 -13.384 1.00 14.04 C ANISOU 1532 C3' DG B 4 1973 1876 1485 -825 -12 24 C ATOM 1533 O3' DG B 4 -12.142 -11.828 -11.972 1.00 13.63 O ANISOU 1533 O3' DG B 4 1919 1827 1432 -826 -10 24 O ATOM 1534 C2' DG B 4 -10.865 -12.622 -13.893 1.00 13.99 C ANISOU 1534 C2' DG B 4 1969 1871 1475 -825 -13 26 C ATOM 1535 C1' DG B 4 -11.112 -14.105 -13.721 1.00 13.18 C ANISOU 1535 C1' DG B 4 1865 1766 1377 -825 -12 27 C ATOM 1536 N9 DG B 4 -10.330 -14.930 -14.624 1.00 10.18 N ANISOU 1536 N9 DG B 4 1487 1385 996 -825 -13 28 N ATOM 1537 C8 DG B 4 -10.379 -14.917 -15.995 1.00 9.71 C ANISOU 1537 C8 DG B 4 1429 1324 937 -824 -15 27 C ATOM 1538 N7 DG B 4 -9.540 -15.731 -16.560 1.00 9.70 N ANISOU 1538 N7 DG B 4 1429 1322 935 -823 -16 28 N ATOM 1539 C5 DG B 4 -8.864 -16.291 -15.491 1.00 9.70 C ANISOU 1539 C5 DG B 4 1429 1325 933 -824 -14 30 C ATOM 1540 C6 DG B 4 -7.841 -17.241 -15.479 1.00 9.69 C ANISOU 1540 C6 DG B 4 1430 1324 930 -824 -14 31 C ATOM 1541 O6 DG B 4 -7.303 -17.795 -16.424 1.00 10.65 O ANISOU 1541 O6 DG B 4 1552 1444 1051 -823 -15 32 O ATOM 1542 N1 DG B 4 -7.439 -17.537 -14.179 1.00 10.97 N ANISOU 1542 N1 DG B 4 1590 1488 1089 -825 -12 32 N ATOM 1543 C2 DG B 4 -7.987 -17.001 -13.055 1.00 10.92 C ANISOU 1543 C2 DG B 4 1581 1483 1083 -825 -10 32 C ATOM 1544 N2 DG B 4 -7.481 -17.412 -11.880 1.00 16.15 N ANISOU 1544 N2 DG B 4 2244 2149 1744 -826 -9 33 N ATOM 1545 N3 DG B 4 -8.949 -16.116 -13.057 1.00 12.78 N ANISOU 1545 N3 DG B 4 1816 1719 1321 -826 -11 30 N ATOM 1546 C4 DG B 4 -9.344 -15.812 -14.299 1.00 10.05 C ANISOU 1546 C4 DG B 4 1471 1370 976 -825 -12 29 C ATOM 1547 H5' DG B 4 -14.386 -13.468 -15.409 1.00 13.91 H ATOM 1548 H5'' DG B 4 -14.624 -12.009 -14.844 1.00 13.91 H ATOM 1549 H4' DG B 4 -13.820 -13.159 -13.067 1.00 15.90 H ATOM 1550 H3' DG B 4 -12.319 -11.166 -13.832 1.00 16.85 H ATOM 1551 H2' DG B 4 -10.727 -12.403 -14.828 1.00 16.79 H ATOM 1552 H2'' DG B 4 -10.110 -12.335 -13.356 1.00 16.79 H ATOM 1553 H1' DG B 4 -10.934 -14.363 -12.803 1.00 15.82 H ATOM 1554 H8 DG B 4 -10.977 -14.391 -16.475 1.00 11.65 H ATOM 1555 H1 DG B 4 -6.820 -18.125 -14.078 1.00 13.16 H ATOM 1556 H21 DG B 4 -7.762 -17.063 -11.145 1.00 19.38 H ATOM 1557 H22 DG B 4 -6.876 -18.022 -11.863 1.00 19.38 H ATOM 1558 P DT B 5 -11.472 -10.521 -11.328 1.00 15.99 P ANISOU 1558 P DT B 5 2220 2130 1724 -827 -10 24 P ATOM 1559 OP1 DT B 5 -12.107 -10.383 -9.984 1.00 17.94 O ANISOU 1559 OP1 DT B 5 2465 2379 1974 -828 -8 24 O ATOM 1560 OP2 DT B 5 -11.546 -9.354 -12.200 1.00 16.76 O ANISOU 1560 OP2 DT B 5 2319 2228 1820 -826 -12 23 O ATOM 1561 O5' DT B 5 -9.953 -10.926 -11.191 1.00 15.66 O ANISOU 1561 O5' DT B 5 2181 2092 1677 -826 -10 26 O ATOM 1562 C5' DT B 5 -9.510 -11.902 -10.272 1.00 18.40 C ANISOU 1562 C5' DT B 5 2528 2440 2024 -827 -8 27 C ATOM 1563 C4' DT B 5 -8.054 -12.190 -10.503 1.00 19.05 C ANISOU 1563 C4' DT B 5 2613 2526 2101 -827 -9 29 C ATOM 1564 O4' DT B 5 -7.914 -13.007 -11.695 1.00 15.33 O ANISOU 1564 O4' DT B 5 2143 2051 1631 -826 -10 29 O ATOM 1565 C3' DT B 5 -7.169 -10.945 -10.765 1.00 21.22 C ANISOU 1565 C3' DT B 5 2891 2803 2369 -826 -10 29 C ATOM 1566 O3' DT B 5 -6.027 -10.975 -9.977 1.00 18.36 O ANISOU 1566 O3' DT B 5 2530 2444 2000 -827 -9 30 O ATOM 1567 C2' DT B 5 -6.805 -11.103 -12.229 1.00 13.75 C ANISOU 1567 C2' DT B 5 1947 1855 1422 -825 -12 29 C ATOM 1568 C1' DT B 5 -6.730 -12.598 -12.304 1.00 16.95 C ANISOU 1568 C1' DT B 5 2351 2258 1831 -825 -12 30 C ATOM 1569 N1 DT B 5 -6.601 -13.166 -13.655 1.00 11.93 N ANISOU 1569 N1 DT B 5 1717 1620 1197 -824 -13 30 N ATOM 1570 C2 DT B 5 -5.767 -14.242 -13.823 1.00 10.64 C ANISOU 1570 C2 DT B 5 1555 1457 1033 -824 -13 32 C ATOM 1571 O2 DT B 5 -5.144 -14.767 -12.902 1.00 16.21 O ANISOU 1571 O2 DT B 5 2260 2164 1736 -825 -12 33 O ATOM 1572 N3 DT B 5 -5.671 -14.690 -15.096 1.00 11.87 N ANISOU 1572 N3 DT B 5 1711 1609 1189 -823 -15 32 N ATOM 1573 C4 DT B 5 -6.322 -14.195 -16.215 1.00 13.35 C ANISOU 1573 C4 DT B 5 1899 1794 1379 -823 -17 30 C ATOM 1574 O4 DT B 5 -6.152 -14.692 -17.334 1.00 14.88 O ANISOU 1574 O4 DT B 5 2094 1986 1573 -822 -18 30 O ATOM 1575 C5 DT B 5 -7.203 -13.075 -15.968 1.00 10.52 C ANISOU 1575 C5 DT B 5 1540 1437 1022 -823 -17 29 C ATOM 1576 C7 DT B 5 -7.991 -12.448 -17.079 1.00 12.01 C ANISOU 1576 C7 DT B 5 1728 1622 1212 -822 -18 27 C ATOM 1577 C6 DT B 5 -7.301 -12.617 -14.708 1.00 12.03 C ANISOU 1577 C6 DT B 5 1730 1630 1211 -824 -15 29 C ATOM 1578 H5' DT B 5 -10.024 -12.716 -10.393 1.00 22.08 H ATOM 1579 H5'' DT B 5 -9.635 -11.573 -9.367 1.00 22.08 H ATOM 1580 H4' DT B 5 -7.702 -12.677 -9.742 1.00 22.87 H ATOM 1581 H3' DT B 5 -7.670 -10.128 -10.620 1.00 25.47 H ATOM 1582 H2' DT B 5 -7.504 -10.756 -12.805 1.00 16.50 H ATOM 1583 H2'' DT B 5 -5.946 -10.697 -12.425 1.00 16.50 H ATOM 1584 H1' DT B 5 -5.982 -12.900 -11.765 1.00 20.34 H ATOM 1585 H3 DT B 5 -5.146 -15.357 -15.225 1.00 14.24 H ATOM 1586 H71 DT B 5 -7.802 -12.911 -17.911 1.00 14.41 H ATOM 1587 H72 DT B 5 -8.939 -12.514 -16.881 1.00 14.41 H ATOM 1588 H73 DT B 5 -7.743 -11.514 -17.165 1.00 14.41 H ATOM 1589 H6 DT B 5 -7.859 -11.893 -14.540 1.00 14.43 H ATOM 1590 P DG B 6 -5.358 -9.626 -9.390 1.00 20.46 P ANISOU 1590 P DG B 6 2669 2547 2559 -764 81 235 P ATOM 1591 OP1 DG B 6 -6.279 -9.161 -8.312 1.00 20.24 O ANISOU 1591 OP1 DG B 6 2639 2531 2521 -767 77 236 O ATOM 1592 OP2 DG B 6 -5.023 -8.683 -10.499 1.00 21.29 O ANISOU 1592 OP2 DG B 6 2777 2649 2665 -761 86 229 O ATOM 1593 O5' DG B 6 -4.013 -10.224 -8.774 1.00 22.99 O ANISOU 1593 O5' DG B 6 2984 2862 2888 -764 82 238 O ATOM 1594 C5' DG B 6 -4.067 -11.344 -7.872 1.00 21.42 C ANISOU 1594 C5' DG B 6 2782 2664 2691 -766 78 244 C ATOM 1595 C4' DG B 6 -2.961 -12.374 -8.151 1.00 21.87 C ANISOU 1595 C4' DG B 6 2839 2712 2760 -765 81 246 C ATOM 1596 O4' DG B 6 -3.155 -12.969 -9.460 1.00 21.03 O ANISOU 1596 O4' DG B 6 2736 2598 2657 -764 83 245 O ATOM 1597 C3' DG B 6 -1.512 -11.854 -8.161 1.00 22.00 C ANISOU 1597 C3' DG B 6 2852 2723 2784 -763 85 244 C ATOM 1598 O3' DG B 6 -0.599 -12.866 -7.627 1.00 25.25 O ANISOU 1598 O3' DG B 6 3261 3130 3204 -763 85 249 O ATOM 1599 C2' DG B 6 -1.265 -11.607 -9.634 1.00 21.45 C ANISOU 1599 C2' DG B 6 2787 2646 2718 -760 89 240 C ATOM 1600 C1' DG B 6 -1.956 -12.809 -10.225 1.00 24.72 C ANISOU 1600 C1' DG B 6 3204 3056 3133 -761 88 242 C ATOM 1601 N9 DG B 6 -2.303 -12.675 -11.631 1.00 15.55 N ANISOU 1601 N9 DG B 6 2046 1890 1971 -760 91 238 N ATOM 1602 C8 DG B 6 -3.282 -11.881 -12.171 1.00 17.60 C ANISOU 1602 C8 DG B 6 2310 2154 2223 -759 91 234 C ATOM 1603 N7 DG B 6 -3.351 -11.966 -13.471 1.00 13.71 N ANISOU 1603 N7 DG B 6 1821 1655 1732 -758 94 231 N ATOM 1604 C5 DG B 6 -2.404 -12.903 -13.803 1.00 11.75 C ANISOU 1604 C5 DG B 6 1571 1398 1494 -757 96 233 C ATOM 1605 C6 DG B 6 -2.051 -13.418 -15.061 1.00 13.04 C ANISOU 1605 C6 DG B 6 1738 1552 1664 -755 99 231 C ATOM 1606 O6 DG B 6 -2.550 -13.146 -16.163 1.00 13.48 O ANISOU 1606 O6 DG B 6 1798 1606 1718 -754 101 228 O ATOM 1607 N1 DG B 6 -1.012 -14.334 -14.968 1.00 15.98 N ANISOU 1607 N1 DG B 6 2107 1916 2046 -754 101 234 N ATOM 1608 C2 DG B 6 -0.407 -14.716 -13.778 1.00 13.35 C ANISOU 1608 C2 DG B 6 1771 1586 1717 -756 99 239 C ATOM 1609 N2 DG B 6 0.602 -15.591 -13.865 1.00 21.40 N ANISOU 1609 N2 DG B 6 2788 2597 2746 -755 101 241 N ATOM 1610 N3 DG B 6 -0.734 -14.235 -12.607 1.00 15.74 N ANISOU 1610 N3 DG B 6 2070 1896 2013 -757 96 240 N ATOM 1611 C4 DG B 6 -1.734 -13.345 -12.683 1.00 14.48 C ANISOU 1611 C4 DG B 6 1913 1744 1844 -758 94 237 C ATOM 1612 H5' DG B 6 -4.930 -11.778 -7.961 1.00 25.70 H ATOM 1613 H5'' DG B 6 -3.971 -11.019 -6.963 1.00 25.70 H ATOM 1614 H4' DG B 6 -3.026 -13.076 -7.485 1.00 26.25 H ATOM 1615 H3' DG B 6 -1.443 -11.027 -7.659 1.00 26.40 H ATOM 1616 H2' DG B 6 -1.685 -10.783 -9.926 1.00 25.74 H ATOM 1617 H2'' DG B 6 -0.317 -11.613 -9.836 1.00 25.74 H ATOM 1618 H1' DG B 6 -1.394 -13.591 -10.107 1.00 29.67 H ATOM 1619 H8 DG B 6 -3.824 -11.320 -11.664 1.00 21.12 H ATOM 1620 H1 DG B 6 -0.727 -14.693 -15.696 1.00 19.17 H ATOM 1621 H21 DG B 6 1.026 -15.831 -13.156 1.00 25.68 H ATOM 1622 H22 DG B 6 0.826 -15.914 -14.630 1.00 25.68 H ATOM 1623 P DG B 7 1.013 -12.685 -7.638 1.00 26.62 P ANISOU 1623 P DG B 7 3431 3297 3388 -760 89 248 P ATOM 1624 OP1 DG B 7 1.480 -13.580 -6.551 1.00 31.99 O ANISOU 1624 OP1 DG B 7 4107 3977 4072 -762 86 254 O ATOM 1625 OP2 DG B 7 1.369 -11.251 -7.688 1.00 23.01 O ANISOU 1625 OP2 DG B 7 2973 2842 2927 -758 91 244 O ATOM 1626 O5' DG B 7 1.515 -13.258 -9.053 1.00 31.98 O ANISOU 1626 O5' DG B 7 4112 3963 4074 -758 93 246 O ATOM 1627 C5' DG B 7 1.663 -14.641 -9.265 1.00 33.47 C ANISOU 1627 C5' DG B 7 4301 4146 4269 -759 92 250 C ATOM 1628 C4' DG B 7 2.932 -14.934 -10.042 1.00 29.33 C ANISOU 1628 C4' DG B 7 3777 3612 3756 -756 97 249 C ATOM 1629 O4' DG B 7 2.738 -14.685 -11.468 1.00 26.32 O ANISOU 1629 O4' DG B 7 3400 3225 3375 -754 100 244 O ATOM 1630 C3' DG B 7 4.126 -14.089 -9.665 1.00 33.27 C ANISOU 1630 C3' DG B 7 4273 4110 4259 -754 100 247 C ATOM 1631 O3' DG B 7 5.306 -14.867 -9.865 1.00 36.17 O ANISOU 1631 O3' DG B 7 4638 4468 4637 -753 102 249 O ATOM 1632 C2' DG B 7 4.005 -12.884 -10.622 1.00 36.62 C ANISOU 1632 C2' DG B 7 4701 4534 4680 -751 103 241 C ATOM 1633 C1' DG B 7 3.539 -13.563 -11.895 1.00 30.68 C ANISOU 1633 C1' DG B 7 3952 3775 3929 -751 104 240 C ATOM 1634 N9 DG B 7 2.691 -12.797 -12.813 1.00 17.67 N ANISOU 1634 N9 DG B 7 2310 2130 2276 -750 105 235 N ATOM 1635 C8 DG B 7 1.666 -11.942 -12.509 1.00 17.28 C ANISOU 1635 C8 DG B 7 2261 2089 2215 -751 103 233 C ATOM 1636 N7 DG B 7 1.036 -11.510 -13.566 1.00 14.48 N ANISOU 1636 N7 DG B 7 1910 1734 1857 -750 104 229 N ATOM 1637 C5 DG B 7 1.675 -12.135 -14.613 1.00 11.75 C ANISOU 1637 C5 DG B 7 1567 1379 1520 -748 108 229 C ATOM 1638 C6 DG B 7 1.426 -12.076 -15.991 1.00 10.76 C ANISOU 1638 C6 DG B 7 1446 1248 1395 -746 110 225 C ATOM 1639 O6 DG B 7 0.561 -11.417 -16.582 1.00 14.27 O ANISOU 1639 O6 DG B 7 1894 1696 1832 -746 110 222 O ATOM 1640 N1 DG B 7 2.320 -12.866 -16.715 1.00 15.66 N ANISOU 1640 N1 DG B 7 2067 1859 2026 -745 113 226 N ATOM 1641 C2 DG B 7 3.305 -13.627 -16.152 1.00 12.49 C ANISOU 1641 C2 DG B 7 1662 1453 1633 -745 114 230 C ATOM 1642 N2 DG B 7 4.068 -14.331 -16.979 1.00 22.56 N ANISOU 1642 N2 DG B 7 2938 2719 2917 -743 117 230 N ATOM 1643 N3 DG B 7 3.522 -13.701 -14.866 1.00 18.50 N ANISOU 1643 N3 DG B 7 2418 2218 2392 -747 111 233 N ATOM 1644 C4 DG B 7 2.683 -12.930 -14.163 1.00 13.61 C ANISOU 1644 C4 DG B 7 1799 1609 1764 -748 108 232 C ATOM 1645 H5' DG B 7 0.899 -14.971 -9.765 1.00 40.16 H ATOM 1646 H5'' DG B 7 1.701 -15.093 -8.408 1.00 40.16 H ATOM 1647 H4' DG B 7 3.162 -15.869 -9.918 1.00 35.20 H ATOM 1648 H3' DG B 7 4.058 -13.800 -8.741 1.00 39.93 H ATOM 1649 H2' DG B 7 3.342 -12.251 -10.303 1.00 43.95 H ATOM 1650 H2'' DG B 7 4.865 -12.455 -10.751 1.00 43.95 H ATOM 1651 H1' DG B 7 4.313 -13.893 -12.379 1.00 36.81 H ATOM 1652 H8 DG B 7 1.440 -11.698 -11.641 1.00 20.73 H ATOM 1653 H1 DG B 7 2.243 -12.878 -17.571 1.00 18.80 H ATOM 1654 H21 DG B 7 4.698 -14.826 -16.667 1.00 27.08 H ATOM 1655 H22 DG B 7 3.931 -14.292 -17.827 1.00 27.08 H ATOM 1656 P DG B 8 6.751 -14.324 -9.430 1.00 40.78 P ANISOU 1656 P DG B 8 5218 5049 5227 -751 105 248 P ATOM 1657 OP1 DG B 8 7.564 -15.534 -9.174 1.00 48.44 O ANISOU 1657 OP1 DG B 8 6186 6013 6206 -751 105 252 O ATOM 1658 OP2 DG B 8 6.632 -13.240 -8.427 1.00 36.75 O ANISOU 1658 OP2 DG B 8 4706 4548 4711 -751 103 247 O ATOM 1659 O5' DG B 8 7.292 -13.649 -10.770 1.00 35.74 O ANISOU 1659 O5' DG B 8 4583 4405 4593 -747 110 243 O ATOM 1660 C5' DG B 8 7.563 -14.475 -11.856 1.00 28.06 C ANISOU 1660 C5' DG B 8 3612 3423 3627 -746 112 243 C ATOM 1661 C4' DG B 8 7.891 -13.671 -13.091 1.00 27.83 C ANISOU 1661 C4' DG B 8 3586 3388 3599 -743 117 237 C ATOM 1662 O4' DG B 8 6.728 -12.957 -13.524 1.00 21.78 O ANISOU 1662 O4' DG B 8 2823 2628 2823 -743 116 234 O ATOM 1663 C3' DG B 8 8.990 -12.601 -12.938 1.00 29.56 C ANISOU 1663 C3' DG B 8 3802 3607 3821 -740 119 235 C ATOM 1664 O3' DG B 8 10.103 -12.975 -13.748 1.00 25.39 O ANISOU 1664 O3' DG B 8 3274 3069 3303 -737 123 234 O ATOM 1665 C2' DG B 8 8.311 -11.296 -13.412 1.00 25.41 C ANISOU 1665 C2' DG B 8 3280 3087 3287 -739 120 230 C ATOM 1666 C1' DG B 8 7.186 -11.849 -14.264 1.00 23.68 C ANISOU 1666 C1' DG B 8 3066 2867 3065 -740 119 229 C ATOM 1667 N9 DG B 8 6.043 -10.985 -14.515 1.00 12.85 N ANISOU 1667 N9 DG B 8 1697 1503 1683 -740 118 226 N ATOM 1668 C8 DG B 8 5.292 -10.327 -13.581 1.00 13.16 C ANISOU 1668 C8 DG B 8 1735 1551 1712 -742 115 226 C ATOM 1669 N7 DG B 8 4.285 -9.676 -14.094 1.00 13.07 N ANISOU 1669 N7 DG B 8 1728 1545 1694 -742 114 223 N ATOM 1670 C5 DG B 8 4.362 -9.928 -15.453 1.00 10.71 C ANISOU 1670 C5 DG B 8 1433 1239 1399 -740 117 220 C ATOM 1671 C6 DG B 8 3.533 -9.480 -16.496 1.00 10.68 C ANISOU 1671 C6 DG B 8 1433 1235 1389 -740 118 216 C ATOM 1672 O6 DG B 8 2.546 -8.743 -16.407 1.00 12.09 O ANISOU 1672 O6 DG B 8 1614 1421 1558 -740 117 214 O ATOM 1673 N1 DG B 8 3.937 -9.972 -17.732 1.00 10.69 N ANISOU 1673 N1 DG B 8 1437 1227 1397 -738 121 215 N ATOM 1674 C2 DG B 8 5.008 -10.802 -17.930 1.00 11.86 C ANISOU 1674 C2 DG B 8 1584 1367 1556 -736 123 217 C ATOM 1675 N2 DG B 8 5.242 -11.195 -19.195 1.00 14.53 N ANISOU 1675 N2 DG B 8 1925 1697 1899 -735 126 215 N ATOM 1676 N3 DG B 8 5.787 -11.244 -16.947 1.00 12.56 N ANISOU 1676 N3 DG B 8 1668 1455 1649 -737 123 221 N ATOM 1677 C4 DG B 8 5.409 -10.762 -15.738 1.00 12.04 C ANISOU 1677 C4 DG B 8 1600 1398 1578 -739 119 222 C ATOM 1678 H5' DG B 8 6.788 -15.029 -12.035 1.00 33.67 H ATOM 1679 H5'' DG B 8 8.317 -15.046 -11.639 1.00 33.67 H ATOM 1680 H4' DG B 8 8.156 -14.284 -13.795 1.00 33.39 H ATOM 1681 H3' DG B 8 9.258 -12.524 -12.008 1.00 35.47 H ATOM 1682 H2' DG B 8 7.962 -10.792 -12.660 1.00 30.49 H ATOM 1683 H2'' DG B 8 8.920 -10.760 -13.943 1.00 30.49 H ATOM 1684 H1' DG B 8 7.547 -12.157 -15.111 1.00 28.42 H ATOM 1685 H8 DG B 8 5.492 -10.325 -12.673 1.00 15.79 H ATOM 1686 H1 DG B 8 3.470 -9.752 -18.420 1.00 12.83 H ATOM 1687 H21 DG B 8 5.899 -11.723 -19.366 1.00 17.44 H ATOM 1688 H22 DG B 8 4.734 -10.919 -19.832 1.00 17.44 H HETATM 1689 N1 5CM B 9 7.886 -8.323 -16.947 1.00 15.68 N ANISOU 1689 N1 5CM B 9 2060 1851 2047 -731 129 212 N HETATM 1690 C2 5CM B 9 6.799 -7.850 -17.834 1.00 10.84 C ANISOU 1690 C2 5CM B 9 1451 1240 1426 -731 129 208 C HETATM 1691 N3 5CM B 9 5.703 -7.068 -17.266 1.00 11.01 N ANISOU 1691 N3 5CM B 9 1474 1272 1437 -733 126 207 N HETATM 1692 C4 5CM B 9 5.688 -6.743 -15.859 1.00 10.60 C ANISOU 1692 C4 5CM B 9 1419 1228 1382 -734 123 210 C HETATM 1693 C5 5CM B 9 6.791 -7.190 -14.956 1.00 10.64 C ANISOU 1693 C5 5CM B 9 1418 1230 1394 -734 123 214 C HETATM 1694 C5A 5CM B 9 6.759 -6.854 -13.455 1.00 15.25 C ANISOU 1694 C5A 5CM B 9 1998 1822 1973 -736 120 216 C HETATM 1695 C6 5CM B 9 7.883 -7.983 -15.547 1.00 13.71 C ANISOU 1695 C6 5CM B 9 1806 1609 1793 -733 126 215 C HETATM 1696 O2 5CM B 9 6.839 -8.132 -19.023 1.00 15.45 O ANISOU 1696 O2 5CM B 9 2039 1818 2014 -729 131 206 O HETATM 1697 N4 5CM B 9 4.605 -5.994 -15.382 1.00 13.54 N ANISOU 1697 N4 5CM B 9 1792 1610 1743 -736 121 208 N HETATM 1698 C1' 5CM B 9 9.014 -9.031 -17.536 1.00 27.45 C ANISOU 1698 C1' 5CM B 9 3549 3332 3549 -729 132 213 C HETATM 1699 C2' 5CM B 9 10.371 -8.561 -17.073 1.00 22.96 C ANISOU 1699 C2' 5CM B 9 2977 2761 2986 -727 134 213 C HETATM 1700 C3' 5CM B 9 11.207 -9.703 -17.603 1.00 27.41 C ANISOU 1700 C3' 5CM B 9 3539 3314 3560 -726 136 216 C HETATM 1701 C4' 5CM B 9 10.278 -10.918 -17.481 1.00 22.11 C ANISOU 1701 C4' 5CM B 9 2869 2643 2887 -729 133 219 C HETATM 1702 O4' 5CM B 9 8.985 -10.373 -17.120 1.00 20.25 O ANISOU 1702 O4' 5CM B 9 2636 2418 2642 -731 130 218 O HETATM 1703 O3' 5CM B 9 11.469 -9.402 -18.964 1.00 30.33 O ANISOU 1703 O3' 5CM B 9 3912 3678 3932 -724 139 212 O HETATM 1704 C5' 5CM B 9 10.710 -11.909 -16.430 1.00 20.27 C ANISOU 1704 C5' 5CM B 9 2632 2410 2660 -731 131 225 C HETATM 1705 O5' 5CM B 9 11.085 -11.201 -15.264 1.00 25.05 O ANISOU 1705 O5' 5CM B 9 3234 3022 3263 -732 130 226 O HETATM 1706 P 5CM B 9 11.393 -12.037 -13.906 1.00 24.58 P ANISOU 1706 P 5CM B 9 3170 2964 3206 -734 127 231 P HETATM 1707 OP1 5CM B 9 12.519 -13.000 -14.222 1.00 33.17 O ANISOU 1707 OP1 5CM B 9 4256 4042 4305 -733 130 233 O HETATM 1708 OP2 5CM B 9 11.515 -11.071 -12.753 1.00 26.60 O ANISOU 1708 OP2 5CM B 9 3422 3227 3456 -735 126 231 O HETATM 1709 H5A1 5CM B 9 5.968 -7.246 -13.053 1.00 18.30 H HETATM 1710 H5A2 5CM B 9 6.737 -5.891 -13.338 1.00 18.30 H HETATM 1711 H5A3 5CM B 9 7.551 -7.213 -13.026 1.00 18.30 H HETATM 1712 H6 5CM B 9 8.587 -8.265 -15.008 1.00 16.45 H HETATM 1713 HN41 5CM B 9 4.555 -5.794 -14.547 1.00 16.25 H HETATM 1714 HN42 5CM B 9 3.977 -5.757 -15.919 1.00 16.25 H HETATM 1715 H1' 5CM B 9 8.961 -8.984 -18.503 1.00 32.94 H HETATM 1716 H2' 5CM B 9 10.615 -7.720 -17.491 1.00 27.55 H HETATM 1717 H2'' 5CM B 9 10.419 -8.506 -16.105 1.00 27.55 H HETATM 1718 H3' 5CM B 9 12.024 -9.819 -17.093 1.00 32.89 H HETATM 1719 H4' 5CM B 9 10.213 -11.365 -18.339 1.00 26.53 H HETATM 1720 H5' 5CM B 9 9.973 -12.505 -16.226 1.00 24.32 H HETATM 1721 H5'' 5CM B 9 11.466 -12.422 -16.756 1.00 24.32 H ATOM 1722 P DG B 10 12.930 -9.489 -19.582 1.00 25.48 P ANISOU 1722 P DG B 10 3297 3055 3330 -721 143 211 P ATOM 1723 OP1 DG B 10 13.231 -10.932 -19.763 1.00 40.34 O ANISOU 1723 OP1 DG B 10 5179 4930 5220 -721 143 215 O ATOM 1724 OP2 DG B 10 13.779 -8.658 -18.724 1.00 22.81 O ANISOU 1724 OP2 DG B 10 2956 2720 2993 -720 144 211 O ATOM 1725 O5' DG B 10 12.684 -8.868 -21.022 1.00 23.41 O ANISOU 1725 O5' DG B 10 3040 2790 3066 -718 146 206 O ATOM 1726 C5' DG B 10 11.817 -9.515 -21.913 1.00 18.27 C ANISOU 1726 C5' DG B 10 2394 2137 2413 -719 146 205 C ATOM 1727 C4' DG B 10 11.184 -8.537 -22.867 1.00 14.23 C ANISOU 1727 C4' DG B 10 1886 1626 1894 -717 147 200 C ATOM 1728 O4' DG B 10 10.025 -7.916 -22.245 1.00 14.47 O ANISOU 1728 O4' DG B 10 1917 1666 1913 -719 144 199 O ATOM 1729 C3' DG B 10 12.092 -7.412 -23.305 1.00 15.61 C ANISOU 1729 C3' DG B 10 2060 1799 2070 -714 150 195 C ATOM 1730 O3' DG B 10 11.886 -7.164 -24.652 1.00 17.28 O ANISOU 1730 O3' DG B 10 2277 2007 2281 -712 152 191 O ATOM 1731 C2' DG B 10 11.643 -6.258 -22.398 1.00 14.49 C ANISOU 1731 C2' DG B 10 1918 1668 1920 -715 148 194 C ATOM 1732 C1' DG B 10 10.151 -6.530 -22.297 1.00 13.70 C ANISOU 1732 C1' DG B 10 1821 1574 1812 -718 145 194 C ATOM 1733 N9 DG B 10 9.514 -5.973 -21.104 1.00 10.55 N ANISOU 1733 N9 DG B 10 1420 1185 1405 -720 142 195 N ATOM 1734 C8 DG B 10 9.985 -6.038 -19.817 1.00 14.00 C ANISOU 1734 C8 DG B 10 1851 1624 1843 -721 141 199 C ATOM 1735 N7 DG B 10 9.195 -5.464 -18.941 1.00 10.77 N ANISOU 1735 N7 DG B 10 1442 1225 1425 -723 138 199 N ATOM 1736 C5 DG B 10 8.148 -4.994 -19.710 1.00 10.52 C ANISOU 1736 C5 DG B 10 1415 1196 1386 -723 138 195 C ATOM 1737 C6 DG B 10 7.005 -4.276 -19.332 1.00 10.48 C ANISOU 1737 C6 DG B 10 1412 1201 1371 -725 135 194 C ATOM 1738 O6 DG B 10 6.669 -3.913 -18.195 1.00 10.48 O ANISOU 1738 O6 DG B 10 1409 1208 1365 -726 133 195 O ATOM 1739 N1 DG B 10 6.187 -3.994 -20.425 1.00 10.45 N ANISOU 1739 N1 DG B 10 1414 1196 1362 -724 136 190 N ATOM 1740 C2 DG B 10 6.441 -4.367 -21.728 1.00 10.46 C ANISOU 1740 C2 DG B 10 1417 1189 1367 -722 139 188 C ATOM 1741 N2 DG B 10 5.532 -3.998 -22.644 1.00 10.46 N ANISOU 1741 N2 DG B 10 1422 1190 1361 -722 140 184 N ATOM 1742 N3 DG B 10 7.519 -5.038 -22.098 1.00 10.49 N ANISOU 1742 N3 DG B 10 1420 1184 1381 -721 141 189 N ATOM 1743 C4 DG B 10 8.325 -5.309 -21.049 1.00 10.52 C ANISOU 1743 C4 DG B 10 1418 1188 1390 -721 141 193 C ATOM 1744 H5' DG B 10 11.121 -9.964 -21.409 1.00 21.93 H ATOM 1745 H5'' DG B 10 12.317 -10.174 -22.420 1.00 21.93 H ATOM 1746 H4' DG B 10 10.889 -9.021 -23.655 1.00 17.07 H ATOM 1747 H3' DG B 10 13.020 -7.638 -23.135 1.00 18.73 H ATOM 1748 H2' DG B 10 12.066 -6.314 -21.527 1.00 17.39 H ATOM 1749 H2'' DG B 10 11.812 -5.400 -22.818 1.00 17.39 H ATOM 1750 H1' DG B 10 9.705 -6.194 -23.090 1.00 16.44 H ATOM 1751 H8 DG B 10 10.786 -6.450 -19.588 1.00 16.80 H ATOM 1752 H1 DG B 10 5.455 -3.569 -20.272 1.00 12.55 H ATOM 1753 H21 DG B 10 5.652 -4.194 -23.473 1.00 12.55 H ATOM 1754 H22 DG B 10 4.829 -3.565 -22.402 1.00 12.55 H ATOM 1755 P DT B 11 12.820 -6.136 -25.462 1.00 17.90 P ANISOU 1755 P DT B 11 2356 2082 2362 -709 156 187 P ATOM 1756 OP1 DT B 11 12.787 -6.641 -26.856 1.00 21.85 O ANISOU 1756 OP1 DT B 11 2861 2575 2866 -707 158 185 O ATOM 1757 OP2 DT B 11 14.077 -5.902 -24.730 1.00 16.42 O ANISOU 1757 OP2 DT B 11 2164 1893 2180 -708 157 188 O ATOM 1758 O5' DT B 11 11.949 -4.794 -25.448 1.00 16.04 O ANISOU 1758 O5' DT B 11 2124 1856 2116 -709 156 182 O ATOM 1759 C5' DT B 11 10.696 -4.774 -26.069 1.00 14.06 C ANISOU 1759 C5' DT B 11 1877 1607 1857 -710 155 180 C ATOM 1760 C4' DT B 11 9.934 -3.524 -25.697 1.00 13.54 C ANISOU 1760 C4' DT B 11 1813 1551 1782 -710 154 176 C ATOM 1761 O4' DT B 11 9.625 -3.558 -24.290 1.00 12.58 O ANISOU 1761 O4' DT B 11 1687 1436 1656 -713 151 180 O ATOM 1762 C3' DT B 11 10.700 -2.193 -25.927 1.00 13.08 C ANISOU 1762 C3' DT B 11 1754 1493 1722 -708 156 172 C ATOM 1763 O3' DT B 11 10.038 -1.385 -26.886 1.00 12.38 O ANISOU 1763 O3' DT B 11 1671 1406 1627 -706 158 166 O ATOM 1764 C2' DT B 11 10.718 -1.545 -24.546 1.00 12.35 C ANISOU 1764 C2' DT B 11 1658 1409 1626 -709 154 173 C ATOM 1765 C1' DT B 11 9.542 -2.234 -23.870 1.00 10.38 C ANISOU 1765 C1' DT B 11 1409 1165 1372 -712 151 177 C ATOM 1766 N1 DT B 11 9.546 -2.156 -22.382 1.00 10.70 N ANISOU 1766 N1 DT B 11 1445 1212 1410 -714 148 180 N ATOM 1767 C2 DT B 11 8.451 -1.590 -21.744 1.00 10.37 C ANISOU 1767 C2 DT B 11 1404 1179 1358 -716 145 180 C ATOM 1768 O2 DT B 11 7.486 -1.147 -22.326 1.00 12.26 O ANISOU 1768 O2 DT B 11 1648 1422 1590 -716 145 176 O ATOM 1769 N3 DT B 11 8.558 -1.510 -20.390 1.00 10.39 N ANISOU 1769 N3 DT B 11 1401 1186 1358 -718 143 183 N ATOM 1770 C4 DT B 11 9.584 -1.964 -19.611 1.00 10.42 C ANISOU 1770 C4 DT B 11 1401 1188 1370 -718 142 187 C ATOM 1771 O4 DT B 11 9.559 -1.843 -18.388 1.00 11.56 O ANISOU 1771 O4 DT B 11 1542 1339 1512 -720 140 189 O ATOM 1772 C5 DT B 11 10.702 -2.563 -20.326 1.00 11.37 C ANISOU 1772 C5 DT B 11 1520 1298 1501 -716 145 187 C ATOM 1773 C7 DT B 11 11.903 -3.083 -19.576 1.00 13.60 C ANISOU 1773 C7 DT B 11 1798 1577 1792 -716 146 191 C ATOM 1774 C6 DT B 11 10.623 -2.639 -21.664 1.00 10.52 C ANISOU 1774 C6 DT B 11 1417 1185 1394 -714 148 184 C ATOM 1775 H5' DT B 11 10.189 -5.552 -25.790 1.00 16.87 H ATOM 1776 H5'' DT B 11 10.816 -4.800 -27.031 1.00 16.87 H ATOM 1777 H4' DT B 11 9.105 -3.500 -26.200 1.00 16.25 H ATOM 1778 H3' DT B 11 11.607 -2.379 -26.218 1.00 15.69 H ATOM 1779 HO3' DT B 11 9.328 -1.655 -27.244 1.00 14.86 H ATOM 1780 H2' DT B 11 11.548 -1.740 -24.082 1.00 14.82 H ATOM 1781 H2'' DT B 11 10.570 -0.589 -24.610 1.00 14.82 H ATOM 1782 H1' DT B 11 8.717 -1.848 -24.203 1.00 12.46 H ATOM 1783 H3 DT B 11 7.890 -1.161 -19.975 1.00 12.46 H ATOM 1784 H71 DT B 11 12.010 -4.031 -19.755 1.00 16.32 H ATOM 1785 H72 DT B 11 12.697 -2.607 -19.867 1.00 16.32 H ATOM 1786 H73 DT B 11 11.774 -2.947 -18.624 1.00 16.32 H ATOM 1787 H6 DT B 11 11.338 -3.007 -22.130 1.00 12.62 H TER 1788 DT B 11 ATOM 1789 O5' DT C 51 5.175 2.327 -10.818 1.00 17.37 O ANISOU 1789 O5' DT C 51 2369 2120 2112 -755 36 -126 O ATOM 1790 C5' DT C 51 4.590 3.577 -10.523 1.00 20.46 C ANISOU 1790 C5' DT C 51 2759 2507 2506 -755 31 -129 C ATOM 1791 C4' DT C 51 4.393 4.389 -11.786 1.00 16.94 C ANISOU 1791 C4' DT C 51 2314 2059 2063 -755 28 -128 C ATOM 1792 O4' DT C 51 5.680 4.710 -12.318 1.00 17.04 O ANISOU 1792 O4' DT C 51 2327 2072 2075 -757 26 -122 O ATOM 1793 C3' DT C 51 3.660 3.676 -12.908 1.00 18.11 C ANISOU 1793 C3' DT C 51 2463 2208 2211 -753 30 -129 C ATOM 1794 O3' DT C 51 2.261 3.887 -12.785 1.00 17.71 O ANISOU 1794 O3' DT C 51 2412 2155 2162 -752 30 -135 O ATOM 1795 C2' DT C 51 4.238 4.324 -14.158 1.00 18.74 C ANISOU 1795 C2' DT C 51 2543 2286 2292 -754 27 -126 C ATOM 1796 C1' DT C 51 5.652 4.668 -13.744 1.00 15.60 C ANISOU 1796 C1' DT C 51 2146 1889 1893 -756 25 -121 C ATOM 1797 N1 DT C 51 6.678 3.727 -14.204 1.00 13.09 N ANISOU 1797 N1 DT C 51 1827 1573 1572 -757 29 -116 N ATOM 1798 C2 DT C 51 6.972 3.714 -15.538 1.00 14.07 C ANISOU 1798 C2 DT C 51 1953 1698 1697 -757 28 -113 C ATOM 1799 O2 DT C 51 6.360 4.385 -16.342 1.00 12.63 O ANISOU 1799 O2 DT C 51 1770 1512 1516 -756 25 -115 O ATOM 1800 N3 DT C 51 7.971 2.853 -15.893 1.00 10.23 N ANISOU 1800 N3 DT C 51 1466 1213 1207 -758 31 -109 N ATOM 1801 C4 DT C 51 8.707 2.044 -15.055 1.00 10.26 C ANISOU 1801 C4 DT C 51 1469 1220 1208 -758 35 -107 C ATOM 1802 O4 DT C 51 9.580 1.301 -15.460 1.00 14.48 O ANISOU 1802 O4 DT C 51 2005 1758 1741 -759 38 -103 O ATOM 1803 C5 DT C 51 8.351 2.119 -13.654 1.00 12.32 C ANISOU 1803 C5 DT C 51 1730 1482 1469 -758 35 -110 C ATOM 1804 C7 DT C 51 9.095 1.305 -12.648 1.00 18.81 C ANISOU 1804 C7 DT C 51 2552 2307 2288 -759 38 -108 C ATOM 1805 C6 DT C 51 7.382 2.962 -13.298 1.00 13.11 C ANISOU 1805 C6 DT C 51 1830 1579 1572 -758 32 -114 C ATOM 1806 H5' DT C 51 5.168 4.065 -9.916 1.00 24.55 H ATOM 1807 H5'' DT C 51 3.730 3.434 -10.098 1.00 24.55 H ATOM 1808 H4' DT C 51 3.923 5.210 -11.569 1.00 20.33 H ATOM 1809 H3' DT C 51 3.863 2.727 -12.894 1.00 21.73 H ATOM 1810 H2' DT C 51 4.241 3.698 -14.899 1.00 22.49 H ATOM 1811 H2'' DT C 51 3.744 5.127 -14.387 1.00 22.49 H ATOM 1812 H1' DT C 51 5.868 5.550 -14.084 1.00 18.72 H ATOM 1813 H3 DT C 51 8.157 2.807 -16.732 1.00 12.27 H ATOM 1814 H71 DT C 51 9.508 1.894 -11.997 1.00 22.57 H ATOM 1815 H72 DT C 51 8.480 0.705 -12.198 1.00 22.57 H ATOM 1816 H73 DT C 51 9.782 0.786 -13.096 1.00 22.57 H ATOM 1817 H6 DT C 51 7.163 3.029 -12.397 1.00 15.73 H ATOM 1818 HO5' DT C 51 4.688 1.661 -10.973 1.00 20.84 H ATOM 1819 P DA C 52 1.209 2.821 -13.342 1.00 17.25 P ANISOU 1819 P DA C 52 2354 2097 2103 -750 34 -138 P ATOM 1820 OP1 DA C 52 -0.097 3.217 -12.745 1.00 18.25 O ANISOU 1820 OP1 DA C 52 2480 2222 2232 -749 33 -144 O ATOM 1821 OP2 DA C 52 1.727 1.459 -13.101 1.00 18.39 O ANISOU 1821 OP2 DA C 52 2498 2245 2243 -750 39 -137 O ATOM 1822 O5' DA C 52 1.188 3.050 -14.935 1.00 17.15 O ANISOU 1822 O5' DA C 52 2342 2083 2092 -750 32 -136 O ATOM 1823 C5' DA C 52 0.954 4.341 -15.472 1.00 16.56 C ANISOU 1823 C5' DA C 52 2267 2005 2020 -750 27 -137 C ATOM 1824 C4' DA C 52 1.004 4.281 -16.974 1.00 12.41 C ANISOU 1824 C4' DA C 52 1741 1478 1495 -750 26 -135 C ATOM 1825 O4' DA C 52 2.341 3.866 -17.397 1.00 14.15 O ANISOU 1825 O4' DA C 52 1963 1701 1713 -751 28 -129 O ATOM 1826 C3' DA C 52 0.039 3.267 -17.583 1.00 13.23 C ANISOU 1826 C3' DA C 52 1846 1583 1598 -748 30 -138 C ATOM 1827 O3' DA C 52 -0.465 3.754 -18.830 1.00 15.75 O ANISOU 1827 O3' DA C 52 2165 1900 1919 -747 28 -138 O ATOM 1828 C2' DA C 52 0.900 2.024 -17.740 1.00 17.35 C ANISOU 1828 C2' DA C 52 2369 2109 2116 -748 35 -134 C ATOM 1829 C1' DA C 52 2.285 2.605 -18.045 1.00 17.37 C ANISOU 1829 C1' DA C 52 2371 2111 2118 -750 32 -128 C ATOM 1830 N9 DA C 52 3.397 1.803 -17.536 1.00 13.32 N ANISOU 1830 N9 DA C 52 1858 1601 1602 -751 36 -125 N ATOM 1831 C8 DA C 52 3.676 1.553 -16.227 1.00 11.16 C ANISOU 1831 C8 DA C 52 1584 1329 1327 -752 37 -125 C ATOM 1832 N7 DA C 52 4.740 0.824 -16.041 1.00 13.33 N ANISOU 1832 N7 DA C 52 1859 1607 1599 -753 40 -121 N ATOM 1833 C5 DA C 52 5.213 0.598 -17.322 1.00 9.79 C ANISOU 1833 C5 DA C 52 1411 1159 1150 -753 40 -118 C ATOM 1834 C6 DA C 52 6.324 -0.100 -17.789 1.00 9.78 C ANISOU 1834 C6 DA C 52 1410 1159 1146 -754 43 -113 C ATOM 1835 N6 DA C 52 7.192 -0.742 -16.975 1.00 12.74 N ANISOU 1835 N6 DA C 52 1785 1537 1518 -754 46 -111 N ATOM 1836 N1 DA C 52 6.516 -0.145 -19.120 1.00 9.77 N ANISOU 1836 N1 DA C 52 1410 1158 1145 -754 43 -111 N ATOM 1837 C2 DA C 52 5.644 0.468 -19.918 1.00 9.78 C ANISOU 1837 C2 DA C 52 1412 1157 1149 -753 40 -113 C ATOM 1838 N3 DA C 52 4.568 1.188 -19.594 1.00 9.80 N ANISOU 1838 N3 DA C 52 1413 1156 1153 -752 37 -118 N ATOM 1839 C4 DA C 52 4.404 1.206 -18.256 1.00 9.80 C ANISOU 1839 C4 DA C 52 1413 1157 1154 -752 38 -120 C ATOM 1840 H5' DA C 52 1.636 4.952 -15.151 1.00 19.87 H ATOM 1841 H5'' DA C 52 0.081 4.654 -15.191 1.00 19.87 H ATOM 1842 H4' DA C 52 0.814 5.160 -17.336 1.00 14.89 H ATOM 1843 H3' DA C 52 -0.692 3.093 -16.971 1.00 15.87 H ATOM 1844 H2' DA C 52 0.916 1.512 -16.916 1.00 20.83 H ATOM 1845 H2'' DA C 52 0.586 1.480 -18.479 1.00 20.83 H ATOM 1846 H1' DA C 52 2.383 2.727 -19.003 1.00 20.85 H ATOM 1847 H8 DA C 52 3.144 1.860 -15.529 1.00 13.39 H ATOM 1848 H61 DA C 52 7.857 -1.172 -17.309 1.00 15.29 H ATOM 1849 H62 DA C 52 7.079 -0.719 -16.123 1.00 15.29 H ATOM 1850 H2 DA C 52 5.830 0.416 -20.827 1.00 11.74 H HETATM 1851 N1 5CM C 53 1.754 -1.426 -20.620 1.00 9.74 N ANISOU 1851 N1 5CM C 53 1406 1150 1143 -747 48 -128 N HETATM 1852 C2 5CM C 53 3.035 -2.084 -20.883 1.00 9.72 C ANISOU 1852 C2 5CM C 53 1405 1151 1138 -748 50 -123 C HETATM 1853 N3 5CM C 53 3.826 -2.558 -19.773 1.00 9.72 N ANISOU 1853 N3 5CM C 53 1404 1153 1135 -749 52 -121 N HETATM 1854 C4 5CM C 53 3.402 -2.324 -18.434 1.00 9.72 C ANISOU 1854 C4 5CM C 53 1404 1154 1137 -749 52 -124 C HETATM 1855 C5 5CM C 53 2.119 -1.638 -18.151 1.00 9.92 C ANISOU 1855 C5 5CM C 53 1428 1176 1164 -748 50 -129 C HETATM 1856 C5A 5CM C 53 1.596 -1.398 -16.725 1.00 14.25 C ANISOU 1856 C5A 5CM C 53 1976 1725 1714 -748 49 -133 C HETATM 1857 C6 5CM C 53 1.336 -1.174 -19.283 1.00 9.74 C ANISOU 1857 C6 5CM C 53 1406 1151 1145 -747 47 -131 C HETATM 1858 O2 5CM C 53 3.389 -2.243 -22.031 1.00 11.23 O ANISOU 1858 O2 5CM C 53 1596 1341 1328 -748 50 -120 O HETATM 1859 N4 5CM C 53 4.227 -2.774 -17.417 1.00 10.86 N ANISOU 1859 N4 5CM C 53 1547 1300 1279 -750 54 -122 N HETATM 1860 C1' 5CM C 53 1.021 -0.857 -21.721 1.00 12.13 C ANISOU 1860 C1' 5CM C 53 1709 1450 1448 -747 45 -129 C HETATM 1861 C2' 5CM C 53 -0.474 -1.100 -21.730 1.00 14.56 C ANISOU 1861 C2' 5CM C 53 2017 1757 1757 -745 46 -135 C HETATM 1862 C3' 5CM C 53 -0.997 0.106 -22.491 1.00 15.74 C ANISOU 1862 C3' 5CM C 53 2167 1903 1911 -745 41 -136 C HETATM 1863 C4' 5CM C 53 0.089 1.172 -22.327 1.00 15.67 C ANISOU 1863 C4' 5CM C 53 2158 1894 1903 -746 36 -132 C HETATM 1864 O4' 5CM C 53 1.138 0.536 -21.569 1.00 13.47 O ANISOU 1864 O4' 5CM C 53 1879 1618 1622 -747 39 -129 O HETATM 1865 O3' 5CM C 53 -1.098 -0.137 -23.886 1.00 15.27 O ANISOU 1865 O3' 5CM C 53 2108 1843 1851 -744 41 -134 O HETATM 1866 C5' 5CM C 53 -0.370 2.404 -21.589 1.00 15.32 C ANISOU 1866 C5' 5CM C 53 2112 1846 1862 -746 32 -134 C HETATM 1867 O5' 5CM C 53 -1.160 1.988 -20.484 1.00 14.81 O ANISOU 1867 O5' 5CM C 53 2047 1782 1797 -745 34 -139 O HETATM 1868 P 5CM C 53 -1.773 3.101 -19.509 1.00 16.70 P ANISOU 1868 P 5CM C 53 2286 2020 2040 -745 30 -142 P HETATM 1869 OP1 5CM C 53 -2.375 4.188 -20.380 1.00 18.60 O ANISOU 1869 OP1 5CM C 53 2526 2256 2284 -745 25 -143 O HETATM 1870 OP2 5CM C 53 -2.604 2.388 -18.473 1.00 16.15 O ANISOU 1870 OP2 5CM C 53 2215 1951 1969 -744 33 -147 O HETATM 1871 H5A1 5CM C 53 2.230 -0.850 -16.236 1.00 17.10 H HETATM 1872 H5A2 5CM C 53 1.486 -2.248 -16.272 1.00 17.10 H HETATM 1873 H5A3 5CM C 53 0.741 -0.941 -16.767 1.00 17.10 H HETATM 1874 H6 5CM C 53 0.534 -0.729 -19.133 1.00 11.69 H HETATM 1875 HN41 5CM C 53 4.943 -3.211 -17.608 1.00 13.03 H HETATM 1876 HN42 5CM C 53 3.976 -2.701 -16.598 1.00 13.03 H HETATM 1877 H1' 5CM C 53 1.412 -1.137 -22.564 1.00 14.55 H HETATM 1878 H2' 5CM C 53 -0.825 -1.114 -20.825 1.00 17.47 H HETATM 1879 H2'' 5CM C 53 -0.689 -1.923 -22.197 1.00 17.47 H HETATM 1880 H3' 5CM C 53 -1.842 0.411 -22.126 1.00 18.89 H HETATM 1881 H4' 5CM C 53 0.429 1.425 -23.200 1.00 18.81 H HETATM 1882 H5' 5CM C 53 -0.901 2.960 -22.180 1.00 18.38 H HETATM 1883 H5'' 5CM C 53 0.399 2.903 -21.271 1.00 18.38 H ATOM 1884 P DG C 54 -2.247 -1.067 -24.437 1.00 14.86 P ANISOU 1884 P DG C 54 2057 1792 1798 -742 45 -138 P ATOM 1885 OP1 DG C 54 -2.392 -0.670 -25.857 1.00 16.73 O ANISOU 1885 OP1 DG C 54 2294 2027 2037 -742 42 -137 O ATOM 1886 OP2 DG C 54 -3.391 -1.069 -23.503 1.00 13.46 O ANISOU 1886 OP2 DG C 54 1879 1614 1622 -741 45 -143 O ATOM 1887 O5' DG C 54 -1.621 -2.524 -24.428 1.00 11.97 O ANISOU 1887 O5' DG C 54 1691 1429 1427 -743 51 -136 O ATOM 1888 C5' DG C 54 -0.549 -2.848 -25.253 1.00 11.28 C ANISOU 1888 C5' DG C 54 1604 1343 1338 -744 52 -131 C ATOM 1889 C4' DG C 54 0.039 -4.171 -24.830 1.00 9.67 C ANISOU 1889 C4' DG C 54 1401 1143 1131 -744 57 -129 C ATOM 1890 O4' DG C 54 0.731 -4.051 -23.531 1.00 11.34 O ANISOU 1890 O4' DG C 54 1612 1356 1342 -744 57 -128 O ATOM 1891 C3' DG C 54 -0.994 -5.278 -24.644 1.00 13.25 C ANISOU 1891 C3' DG C 54 1854 1598 1582 -742 62 -134 C ATOM 1892 O3' DG C 54 -0.537 -6.422 -25.213 1.00 16.87 O ANISOU 1892 O3' DG C 54 2314 2059 2038 -742 66 -131 O ATOM 1893 C2' DG C 54 -1.066 -5.440 -23.139 1.00 10.75 C ANISOU 1893 C2' DG C 54 1537 1282 1265 -742 63 -136 C ATOM 1894 C1' DG C 54 0.388 -5.217 -22.804 1.00 9.65 C ANISOU 1894 C1' DG C 54 1398 1145 1125 -744 62 -131 C ATOM 1895 N9 DG C 54 0.662 -5.065 -21.394 1.00 9.66 N ANISOU 1895 N9 DG C 54 1398 1146 1126 -744 62 -131 N ATOM 1896 C8 DG C 54 -0.174 -4.560 -20.437 1.00 9.67 C ANISOU 1896 C8 DG C 54 1398 1147 1129 -744 61 -135 C ATOM 1897 N7 DG C 54 0.326 -4.635 -19.221 1.00 9.67 N ANISOU 1897 N7 DG C 54 1398 1148 1128 -744 62 -135 N ATOM 1898 C5 DG C 54 1.563 -5.246 -19.395 1.00 9.66 C ANISOU 1898 C5 DG C 54 1397 1149 1124 -745 64 -130 C ATOM 1899 C6 DG C 54 2.557 -5.589 -18.456 1.00 9.66 C ANISOU 1899 C6 DG C 54 1396 1151 1121 -746 65 -128 C ATOM 1900 O6 DG C 54 2.532 -5.439 -17.231 1.00 10.10 O ANISOU 1900 O6 DG C 54 1452 1208 1178 -747 65 -129 O ATOM 1901 N1 DG C 54 3.646 -6.202 -19.063 1.00 9.64 N ANISOU 1901 N1 DG C 54 1395 1151 1118 -747 67 -123 N ATOM 1902 C2 DG C 54 3.767 -6.442 -20.396 1.00 9.64 C ANISOU 1902 C2 DG C 54 1395 1150 1117 -747 68 -121 C ATOM 1903 N2 DG C 54 4.898 -7.055 -20.798 1.00 10.81 N ANISOU 1903 N2 DG C 54 1544 1301 1263 -748 70 -117 N ATOM 1904 N3 DG C 54 2.841 -6.113 -21.286 1.00 9.64 N ANISOU 1904 N3 DG C 54 1396 1149 1119 -746 66 -123 N ATOM 1905 C4 DG C 54 1.791 -5.514 -20.726 1.00 9.65 C ANISOU 1905 C4 DG C 54 1397 1148 1123 -745 64 -128 C ATOM 1906 H5' DG C 54 0.129 -2.158 -25.186 1.00 13.53 H ATOM 1907 H5'' DG C 54 -0.856 -2.911 -26.171 1.00 13.53 H ATOM 1908 H4' DG C 54 0.682 -4.454 -25.499 1.00 11.61 H ATOM 1909 H3' DG C 54 -1.854 -5.019 -25.010 1.00 15.90 H ATOM 1910 H2' DG C 54 -1.629 -4.760 -22.737 1.00 12.90 H ATOM 1911 H2'' DG C 54 -1.352 -6.334 -22.894 1.00 12.90 H ATOM 1912 H1' DG C 54 0.907 -5.963 -23.145 1.00 11.58 H ATOM 1913 H8 DG C 54 -1.006 -4.192 -20.626 1.00 11.60 H ATOM 1914 H1 DG C 54 4.298 -6.443 -18.556 1.00 11.57 H ATOM 1915 H21 DG C 54 5.021 -7.226 -21.631 1.00 12.97 H ATOM 1916 H22 DG C 54 5.496 -7.274 -20.220 1.00 12.97 H ATOM 1917 P A DC C 55 -1.125 -6.925 -26.628 0.60 15.34 P ANISOU 1917 P A DC C 55 2120 1864 1843 -741 68 -132 P ATOM 1918 P B DC C 55 -0.892 -6.807 -26.733 0.40 18.70 P ANISOU 1918 P B DC C 55 2547 2290 2269 -741 67 -131 P ATOM 1919 OP1A DC C 55 -0.921 -5.883 -27.666 0.60 17.69 O ANISOU 1919 OP1A DC C 55 2419 2159 2143 -742 63 -130 O ATOM 1920 OP1B DC C 55 -0.348 -5.785 -27.653 0.40 14.55 O ANISOU 1920 OP1B DC C 55 2021 1762 1745 -742 63 -128 O ATOM 1921 OP2A DC C 55 -2.432 -7.585 -26.452 0.60 18.27 O ANISOU 1921 OP2A DC C 55 2493 2236 2215 -739 70 -137 O ATOM 1922 OP2B DC C 55 -2.317 -7.178 -26.772 0.40 11.22 O ANISOU 1922 OP2B DC C 55 1600 1342 1323 -740 69 -136 O ATOM 1923 O5'A DC C 55 -0.132 -8.053 -26.944 0.60 14.53 O ANISOU 1923 O5'A DC C 55 2019 1765 1737 -741 72 -128 O ATOM 1924 O5'B DC C 55 -0.067 -8.130 -26.964 0.40 18.38 O ANISOU 1924 O5'B DC C 55 2506 2252 2224 -741 72 -128 O ATOM 1925 C5'A DC C 55 0.025 -9.003 -26.028 0.60 25.86 C ANISOU 1925 C5'A DC C 55 3453 3202 3169 -741 76 -129 C ATOM 1926 C5'B DC C 55 -0.188 -9.186 -26.063 0.40 22.80 C ANISOU 1926 C5'B DC C 55 3066 2815 2781 -741 77 -130 C ATOM 1927 C4'A DC C 55 1.456 -9.396 -25.951 0.60 25.35 C ANISOU 1927 C4'A DC C 55 3390 3140 3103 -742 78 -124 C ATOM 1928 C4'B DC C 55 1.178 -9.644 -25.630 0.40 24.36 C ANISOU 1928 C4'B DC C 55 3264 3015 2977 -742 79 -125 C ATOM 1929 O4'A DC C 55 2.056 -8.821 -24.754 0.60 19.11 O ANISOU 1929 O4'A DC C 55 2599 2350 2314 -743 76 -123 O ATOM 1930 O4'B DC C 55 1.693 -8.762 -24.604 0.40 16.40 O ANISOU 1930 O4'B DC C 55 2255 2006 1970 -743 76 -125 O ATOM 1931 C3'A DC C 55 1.603 -10.883 -25.867 0.60 22.43 C ANISOU 1931 C3'A DC C 55 3020 2773 2729 -742 84 -124 C ATOM 1932 C3'B DC C 55 1.211 -11.023 -25.029 0.40 13.13 C ANISOU 1932 C3'B DC C 55 1842 1596 1552 -741 85 -126 C ATOM 1933 O3'A DC C 55 2.594 -11.344 -26.739 0.60 23.26 O ANISOU 1933 O3'A DC C 55 3126 2879 2833 -742 85 -120 O ATOM 1934 O3'B DC C 55 1.299 -11.985 -26.074 0.40 17.15 O ANISOU 1934 O3'B DC C 55 2352 2106 2058 -741 88 -125 O ATOM 1935 C2'A DC C 55 1.886 -11.154 -24.407 0.60 14.85 C ANISOU 1935 C2'A DC C 55 2059 1815 1768 -742 85 -125 C ATOM 1936 C2'B DC C 55 2.451 -10.967 -24.153 0.40 17.03 C ANISOU 1936 C2'B DC C 55 2335 2092 2044 -743 85 -123 C ATOM 1937 C1'A DC C 55 2.450 -9.853 -23.870 0.60 10.71 C ANISOU 1937 C1'A DC C 55 1534 1289 1246 -743 80 -123 C ATOM 1938 C1'B DC C 55 2.480 -9.513 -23.697 0.40 9.93 C ANISOU 1938 C1'B DC C 55 1435 1189 1148 -743 79 -123 C ATOM 1939 N1 A DC C 55 1.973 -9.515 -22.504 0.60 10.16 N ANISOU 1939 N1 A DC C 55 1463 1219 1177 -743 80 -126 N ATOM 1940 N1 B DC C 55 1.960 -9.278 -22.327 0.40 12.73 N ANISOU 1940 N1 B DC C 55 1789 1545 1504 -743 79 -126 N ATOM 1941 C2 A DC C 55 2.786 -9.782 -21.394 0.60 10.09 C ANISOU 1941 C2 A DC C 55 1454 1213 1168 -744 81 -124 C ATOM 1942 C2 B DC C 55 2.752 -9.599 -21.228 0.40 10.95 C ANISOU 1942 C2 B DC C 55 1563 1321 1277 -744 80 -125 C ATOM 1943 O2 A DC C 55 3.893 -10.292 -21.564 0.60 17.43 O ANISOU 1943 O2 A DC C 55 2384 2145 2095 -745 83 -120 O ATOM 1944 O2 B DC C 55 3.864 -10.101 -21.417 0.40 14.91 O ANISOU 1944 O2 B DC C 55 2065 1825 1776 -745 82 -121 O ATOM 1945 N3 A DC C 55 2.342 -9.453 -20.156 0.60 11.04 N ANISOU 1945 N3 A DC C 55 1574 1333 1289 -744 80 -127 N ATOM 1946 N3 B DC C 55 2.285 -9.341 -19.983 0.40 9.58 N ANISOU 1946 N3 B DC C 55 1388 1148 1104 -744 80 -128 N ATOM 1947 C4 A DC C 55 1.151 -8.888 -20.002 0.60 9.90 C ANISOU 1947 C4 A DC C 55 1428 1186 1146 -743 78 -132 C ATOM 1948 C4 B DC C 55 1.088 -8.783 -19.821 0.40 9.59 C ANISOU 1948 C4 B DC C 55 1389 1147 1107 -743 78 -132 C ATOM 1949 N4 A DC C 55 0.763 -8.584 -18.758 0.60 10.11 N ANISOU 1949 N4 A DC C 55 1454 1213 1174 -743 78 -135 N ATOM 1950 N4 B DC C 55 0.672 -8.551 -18.573 0.40 9.69 N ANISOU 1950 N4 B DC C 55 1402 1160 1121 -743 78 -135 N ATOM 1951 C5 A DC C 55 0.291 -8.636 -21.109 0.60 9.59 C ANISOU 1951 C5 A DC C 55 1390 1145 1108 -742 77 -134 C ATOM 1952 C5 B DC C 55 0.256 -8.457 -20.929 0.40 13.24 C ANISOU 1952 C5 B DC C 55 1852 1607 1571 -742 76 -134 C ATOM 1953 C6 A DC C 55 0.743 -8.947 -22.333 0.60 13.47 C ANISOU 1953 C6 A DC C 55 1883 1637 1600 -742 78 -131 C ATOM 1954 C6 B DC C 55 0.732 -8.705 -22.153 0.40 14.72 C ANISOU 1954 C6 B DC C 55 2041 1795 1758 -742 77 -131 C ATOM 1955 H5'A DC C 55 -0.509 -9.776 -26.271 0.60 31.03 H ATOM 1956 H5'B DC C 55 -0.655 -9.922 -26.489 0.40 27.36 H ATOM 1957 H5''A DC C 55 -0.265 -8.670 -25.164 0.60 31.03 H ATOM 1958 H5''B DC C 55 -0.691 -8.892 -25.287 0.40 27.36 H ATOM 1959 H4'A DC C 55 1.924 -9.070 -26.736 0.60 30.42 H ATOM 1960 H4'B DC C 55 1.774 -9.619 -26.395 0.40 29.23 H ATOM 1961 H3'A DC C 55 0.759 -11.297 -26.105 0.60 26.91 H ATOM 1962 H3'B DC C 55 0.420 -11.176 -24.489 0.40 15.76 H ATOM 1963 H2'A DC C 55 1.067 -11.384 -23.942 0.60 17.82 H ATOM 1964 H2'B DC C 55 2.361 -11.563 -23.393 0.40 20.44 H ATOM 1965 H2''A DC C 55 2.539 -11.866 -24.317 0.60 17.82 H ATOM 1966 H2''B DC C 55 3.244 -11.181 -24.668 0.40 20.44 H ATOM 1967 H1'A DC C 55 3.418 -9.908 -23.861 0.60 12.85 H ATOM 1968 H1'B DC C 55 3.395 -9.193 -23.741 0.40 11.91 H ATOM 1969 H41A DC C 55 0.001 -8.208 -18.624 0.60 12.13 H ATOM 1970 H41B DC C 55 -0.092 -8.180 -18.436 0.40 11.63 H ATOM 1971 H42A DC C 55 1.276 -8.765 -18.091 0.60 12.13 H ATOM 1972 H42B DC C 55 1.169 -8.770 -17.907 0.40 11.63 H ATOM 1973 H5 A DC C 55 -0.536 -8.228 -20.991 0.60 11.50 H ATOM 1974 H5 B DC C 55 -0.575 -8.060 -20.807 0.40 15.89 H ATOM 1975 H6 A DC C 55 0.211 -8.774 -23.075 0.60 16.17 H ATOM 1976 H6 B DC C 55 0.219 -8.486 -22.897 0.40 17.67 H ATOM 1977 P A DC C 56 2.356 -12.764 -27.447 0.49 18.89 P ANISOU 1977 P A DC C 56 2574 2328 2276 -741 91 -120 P ATOM 1978 P B DC C 56 0.738 -13.477 -25.884 0.51 20.34 P ANISOU 1978 P B DC C 56 2756 2512 2459 -739 94 -128 P ATOM 1979 OP1A DC C 56 3.295 -12.872 -28.595 0.49 16.83 O ANISOU 1979 OP1A DC C 56 2314 2067 2014 -742 91 -115 O ATOM 1980 OP1B DC C 56 0.845 -14.133 -27.204 0.51 23.87 O ANISOU 1980 OP1B DC C 56 3205 2960 2905 -739 97 -126 O ATOM 1981 OP2A DC C 56 0.902 -12.944 -27.702 0.49 18.34 O ANISOU 1981 OP2A DC C 56 2505 2257 2208 -740 92 -125 O ATOM 1982 OP2B DC C 56 -0.577 -13.428 -25.205 0.51 10.82 O ANISOU 1982 OP2B DC C 56 1550 1306 1254 -738 95 -134 O ATOM 1983 O5'A DC C 56 2.762 -13.811 -26.299 0.49 20.42 O ANISOU 1983 O5'A DC C 56 2767 2525 2467 -741 95 -120 O ATOM 1984 O5'B DC C 56 1.833 -14.139 -24.940 0.51 21.88 O ANISOU 1984 O5'B DC C 56 2951 2710 2651 -740 97 -125 O ATOM 1985 C5'A DC C 56 4.156 -14.048 -26.019 0.49 24.60 C ANISOU 1985 C5'A DC C 56 3296 3056 2995 -742 96 -116 C ATOM 1986 C5'B DC C 56 3.184 -14.106 -25.339 0.51 22.56 C ANISOU 1986 C5'B DC C 56 3038 2798 2737 -741 97 -120 C ATOM 1987 C4'A DC C 56 4.411 -14.632 -24.619 0.49 24.67 C ANISOU 1987 C4'A DC C 56 3304 3067 3002 -742 99 -116 C ATOM 1988 C4'B DC C 56 4.057 -14.677 -24.266 0.51 24.19 C ANISOU 1988 C4'B DC C 56 3243 3006 2941 -742 99 -118 C ATOM 1989 O4'A DC C 56 3.775 -13.808 -23.605 0.49 23.32 O ANISOU 1989 O4'A DC C 56 3133 2895 2834 -742 96 -120 O ATOM 1990 O4'B DC C 56 3.900 -13.895 -23.046 0.51 20.96 O ANISOU 1990 O4'B DC C 56 2833 2597 2534 -742 97 -120 O ATOM 1991 C3'A DC C 56 3.907 -16.071 -24.334 0.49 28.53 C ANISOU 1991 C3'A DC C 56 3794 3559 3488 -741 105 -119 C ATOM 1992 C3'B DC C 56 3.723 -16.111 -23.896 0.51 28.94 C ANISOU 1992 C3'B DC C 56 3846 3611 3540 -741 105 -120 C ATOM 1993 O3'A DC C 56 4.956 -16.836 -23.681 0.49 28.00 O ANISOU 1993 O3'A DC C 56 3726 3493 3418 -741 108 -116 O ATOM 1994 O3'B DC C 56 4.907 -16.836 -23.612 0.51 27.28 O ANISOU 1994 O3'B DC C 56 3635 3403 3327 -741 108 -117 O ATOM 1995 C2'A DC C 56 2.734 -15.830 -23.395 0.49 23.27 C ANISOU 1995 C2'A DC C 56 3127 2892 2823 -740 104 -124 C ATOM 1996 C2'B DC C 56 2.809 -15.956 -22.684 0.51 23.87 C ANISOU 1996 C2'B DC C 56 3202 2968 2898 -740 105 -125 C ATOM 1997 C1'A DC C 56 3.296 -14.674 -22.608 0.49 18.57 C ANISOU 1997 C1'A DC C 56 2530 2295 2229 -741 100 -123 C ATOM 1998 C1'B DC C 56 3.331 -14.687 -22.019 0.51 19.53 C ANISOU 1998 C1'B DC C 56 2652 2418 2351 -741 100 -123 C ATOM 1999 N1 A DC C 56 2.350 -13.940 -21.745 0.49 16.80 N ANISOU 1999 N1 A DC C 56 2306 2070 2008 -741 97 -127 N ATOM 2000 N1 B DC C 56 2.264 -13.866 -21.318 0.51 13.69 N ANISOU 2000 N1 B DC C 56 1911 1676 1614 -741 97 -128 N ATOM 2001 C2 A DC C 56 2.661 -13.745 -20.392 0.49 19.26 C ANISOU 2001 C2 A DC C 56 2616 2382 2319 -742 97 -127 C ATOM 2002 C2 B DC C 56 2.403 -13.552 -19.968 0.51 21.07 C ANISOU 2002 C2 B DC C 56 2845 2611 2549 -742 97 -129 C ATOM 2003 O2 A DC C 56 3.702 -14.223 -19.927 0.49 24.27 O ANISOU 2003 O2 A DC C 56 3251 3019 2952 -742 99 -124 O ATOM 2004 O2 B DC C 56 3.377 -13.962 -19.361 0.51 23.21 O ANISOU 2004 O2 B DC C 56 3116 2885 2819 -742 98 -126 O ATOM 2005 N3 A DC C 56 1.811 -13.037 -19.620 0.49 12.97 N ANISOU 2005 N3 A DC C 56 1819 1585 1525 -741 95 -131 N ATOM 2006 N3 B DC C 56 1.462 -12.801 -19.361 0.51 12.54 N ANISOU 2006 N3 B DC C 56 1764 1529 1471 -741 94 -133 N ATOM 2007 C4 A DC C 56 0.702 -12.532 -20.146 0.49 12.69 C ANISOU 2007 C4 A DC C 56 1783 1546 1491 -740 93 -134 C ATOM 2008 C4 B DC C 56 0.414 -12.364 -20.041 0.51 13.89 C ANISOU 2008 C4 B DC C 56 1935 1698 1644 -740 92 -136 C ATOM 2009 N4 A DC C 56 -0.102 -11.842 -19.334 0.49 9.53 N ANISOU 2009 N4 A DC C 56 1382 1144 1093 -740 91 -138 N ATOM 2010 N4 B DC C 56 -0.488 -11.634 -19.376 0.51 19.61 N ANISOU 2010 N4 B DC C 56 2659 2420 2371 -740 90 -139 N ATOM 2011 C5 A DC C 56 0.374 -12.697 -21.524 0.49 10.66 C ANISOU 2011 C5 A DC C 56 1528 1289 1235 -740 93 -134 C ATOM 2012 C5 B DC C 56 0.249 -12.650 -21.427 0.51 11.80 C ANISOU 2012 C5 B DC C 56 1672 1433 1380 -740 93 -135 C ATOM 2013 C6 A DC C 56 1.221 -13.407 -22.280 0.49 13.42 C ANISOU 2013 C6 A DC C 56 1877 1639 1581 -740 95 -130 C ATOM 2014 C6 B DC C 56 1.189 -13.403 -22.020 0.51 13.99 C ANISOU 2014 C6 B DC C 56 1949 1711 1654 -740 95 -131 C ATOM 2015 H5'A DC C 56 4.635 -13.207 -26.096 0.49 29.52 H ATOM 2016 H5'B DC C 56 3.445 -13.188 -25.510 0.51 27.08 H ATOM 2017 H5''A DC C 56 4.505 -14.665 -26.680 0.49 29.52 H ATOM 2018 H5''B DC C 56 3.291 -14.627 -26.150 0.51 27.08 H ATOM 2019 H4'A DC C 56 5.367 -14.615 -24.460 0.49 29.60 H ATOM 2020 H4'B DC C 56 4.982 -14.632 -24.554 0.51 29.03 H ATOM 2021 H3'A DC C 56 3.614 -16.504 -25.151 0.49 34.24 H ATOM 2022 H3'B DC C 56 3.240 -16.536 -24.622 0.51 34.73 H ATOM 2023 H2'A DC C 56 1.937 -15.570 -23.883 0.49 27.92 H ATOM 2024 H2'B DC C 56 1.887 -15.842 -22.963 0.51 28.64 H ATOM 2025 H2''A DC C 56 2.572 -16.599 -22.826 0.49 27.92 H ATOM 2026 H2''B DC C 56 2.897 -16.717 -22.089 0.51 28.64 H ATOM 2027 H1'A DC C 56 4.041 -14.986 -22.072 0.49 22.28 H ATOM 2028 H1'B DC C 56 4.022 -14.924 -21.380 0.51 23.44 H ATOM 2029 H41A DC C 56 -0.829 -11.498 -19.639 0.49 11.43 H ATOM 2030 H41B DC C 56 -1.181 -11.331 -19.785 0.51 23.53 H ATOM 2031 H42A DC C 56 0.106 -11.741 -18.506 0.49 11.43 H ATOM 2032 H42B DC C 56 -0.374 -11.468 -18.540 0.51 23.53 H ATOM 2033 H5 A DC C 56 -0.405 -12.336 -21.881 0.49 12.80 H ATOM 2034 H5 B DC C 56 -0.490 -12.340 -21.899 0.51 14.16 H ATOM 2035 H6 A DC C 56 1.041 -13.525 -23.185 0.49 16.10 H ATOM 2036 H6 B DC C 56 1.112 -13.603 -22.924 0.51 16.78 H ATOM 2037 P DC C 57 4.860 -18.430 -23.480 1.00 37.51 P ANISOU 2037 P DC C 57 4886 4778 4586 -708 -102 245 P ATOM 2038 OP1 DC C 57 6.247 -18.941 -23.523 1.00 42.61 O ANISOU 2038 OP1 DC C 57 5530 5422 5238 -708 -102 247 O ATOM 2039 OP2 DC C 57 3.865 -18.902 -24.483 1.00 22.90 O ANISOU 2039 OP2 DC C 57 3038 2928 2735 -706 -99 243 O ATOM 2040 O5' DC C 57 4.380 -18.633 -21.960 1.00 26.88 O ANISOU 2040 O5' DC C 57 3541 3437 3235 -712 -106 246 O ATOM 2041 C5' DC C 57 5.228 -18.072 -20.918 1.00 33.58 C ANISOU 2041 C5' DC C 57 4388 4286 4084 -714 -109 247 C ATOM 2042 C4' DC C 57 4.576 -18.084 -19.545 1.00 32.20 C ANISOU 2042 C4' DC C 57 4214 4116 3903 -717 -112 248 C ATOM 2043 O4' DC C 57 3.517 -17.105 -19.469 1.00 30.87 O ANISOU 2043 O4' DC C 57 4048 3950 3731 -718 -113 245 O ATOM 2044 C3' DC C 57 3.919 -19.403 -19.128 1.00 25.36 C ANISOU 2044 C3' DC C 57 3350 3251 3034 -718 -113 249 C ATOM 2045 O3' DC C 57 4.690 -20.038 -18.156 1.00 30.46 O ANISOU 2045 O3' DC C 57 3995 3898 3682 -720 -116 252 O ATOM 2046 C2' DC C 57 2.552 -18.996 -18.573 1.00 21.09 C ANISOU 2046 C2' DC C 57 2812 2715 2488 -719 -114 247 C ATOM 2047 C1' DC C 57 2.689 -17.510 -18.404 1.00 26.02 C ANISOU 2047 C1' DC C 57 3435 3340 3111 -720 -115 246 C ATOM 2048 N1 DC C 57 1.419 -16.748 -18.454 1.00 18.89 N ANISOU 2048 N1 DC C 57 2535 2440 2205 -720 -115 243 N ATOM 2049 C2 DC C 57 0.938 -16.173 -17.295 1.00 15.79 C ANISOU 2049 C2 DC C 57 2142 2050 1806 -723 -118 242 C ATOM 2050 O2 DC C 57 1.573 -16.348 -16.246 1.00 18.93 O ANISOU 2050 O2 DC C 57 2539 2450 2204 -726 -121 244 O ATOM 2051 N3 DC C 57 -0.213 -15.430 -17.353 1.00 14.75 N ANISOU 2051 N3 DC C 57 2013 1922 1672 -723 -117 239 N ATOM 2052 C4 DC C 57 -0.850 -15.279 -18.529 1.00 9.11 C ANISOU 2052 C4 DC C 57 1299 1205 958 -721 -114 237 C ATOM 2053 N4 DC C 57 -1.984 -14.545 -18.574 1.00 14.44 N ANISOU 2053 N4 DC C 57 1975 1882 1630 -721 -114 235 N ATOM 2054 C5 DC C 57 -0.361 -15.870 -19.723 1.00 19.44 C ANISOU 2054 C5 DC C 57 2606 2509 2270 -718 -112 238 C ATOM 2055 C6 DC C 57 0.760 -16.592 -19.642 1.00 17.14 C ANISOU 2055 C6 DC C 57 2313 2216 1983 -718 -112 240 C ATOM 2056 H5' DC C 57 5.444 -17.155 -21.152 1.00 40.29 H ATOM 2057 H5'' DC C 57 6.051 -18.584 -20.876 1.00 40.29 H ATOM 2058 H4' DC C 57 5.250 -17.857 -18.885 1.00 38.64 H ATOM 2059 H3' DC C 57 3.808 -19.980 -19.900 1.00 30.43 H ATOM 2060 H2' DC C 57 1.848 -19.205 -19.206 1.00 25.31 H ATOM 2061 H2'' DC C 57 2.387 -19.424 -17.718 1.00 25.31 H ATOM 2062 H1' DC C 57 3.138 -17.325 -17.564 1.00 31.22 H ATOM 2063 H41 DC C 57 -2.399 -14.440 -19.320 1.00 17.33 H ATOM 2064 H42 DC C 57 -2.290 -14.183 -17.857 1.00 17.33 H ATOM 2065 H5 DC C 57 -0.804 -15.756 -20.532 1.00 23.32 H ATOM 2066 H6 DC C 57 1.113 -16.973 -20.414 1.00 20.57 H ATOM 2067 P DA C 58 4.377 -21.548 -17.722 1.00 33.32 P ANISOU 2067 P DA C 58 4358 4261 4042 -720 -117 255 P ATOM 2068 OP1 DA C 58 5.658 -22.068 -17.172 1.00 37.88 O ANISOU 2068 OP1 DA C 58 4933 4837 4623 -721 -118 258 O ATOM 2069 OP2 DA C 58 3.659 -22.252 -18.823 1.00 38.90 O ANISOU 2069 OP2 DA C 58 5065 4965 4749 -718 -113 254 O ATOM 2070 O5' DA C 58 3.317 -21.434 -16.542 1.00 26.16 O ANISOU 2070 O5' DA C 58 3452 3358 3128 -723 -120 254 O ATOM 2071 C5' DA C 58 3.674 -20.756 -15.365 1.00 36.48 C ANISOU 2071 C5' DA C 58 4759 4669 4433 -726 -123 255 C ATOM 2072 C4' DA C 58 2.446 -20.468 -14.553 1.00 38.86 C ANISOU 2072 C4' DA C 58 5063 4974 4727 -729 -125 254 C ATOM 2073 O4' DA C 58 1.588 -19.567 -15.283 1.00 26.46 O ANISOU 2073 O4' DA C 58 3493 3404 3155 -727 -123 250 O ATOM 2074 C3' DA C 58 1.580 -21.694 -14.267 1.00 36.72 C ANISOU 2074 C3' DA C 58 4794 4705 4454 -729 -125 255 C ATOM 2075 O3' DA C 58 1.806 -22.151 -12.956 1.00 40.30 O ANISOU 2075 O3' DA C 58 5247 5161 4904 -732 -129 257 O ATOM 2076 C2' DA C 58 0.143 -21.200 -14.483 1.00 23.74 C ANISOU 2076 C2' DA C 58 3152 3064 2805 -729 -124 252 C ATOM 2077 C1' DA C 58 0.302 -19.718 -14.764 1.00 22.42 C ANISOU 2077 C1' DA C 58 2984 2896 2638 -729 -124 249 C ATOM 2078 N9 DA C 58 -0.649 -19.183 -15.723 1.00 15.75 N ANISOU 2078 N9 DA C 58 2141 2050 1792 -727 -121 246 N ATOM 2079 C8 DA C 58 -0.709 -19.429 -17.061 1.00 19.50 C ANISOU 2079 C8 DA C 58 2616 2523 2271 -723 -117 245 C ATOM 2080 N7 DA C 58 -1.676 -18.781 -17.669 1.00 15.33 N ANISOU 2080 N7 DA C 58 2089 1995 1742 -722 -116 242 N ATOM 2081 C5 DA C 58 -2.284 -18.077 -16.653 1.00 11.36 C ANISOU 2081 C5 DA C 58 1586 1495 1233 -725 -118 241 C ATOM 2082 C6 DA C 58 -3.388 -17.217 -16.626 1.00 10.40 C ANISOU 2082 C6 DA C 58 1467 1377 1109 -725 -118 238 C ATOM 2083 N6 DA C 58 -4.103 -16.894 -17.711 1.00 11.03 N ANISOU 2083 N6 DA C 58 1547 1455 1188 -723 -115 236 N ATOM 2084 N1 DA C 58 -3.733 -16.689 -15.447 1.00 12.23 N ANISOU 2084 N1 DA C 58 1699 1612 1336 -728 -121 238 N ATOM 2085 C2 DA C 58 -3.034 -17.012 -14.366 1.00 12.07 C ANISOU 2085 C2 DA C 58 1678 1593 1314 -731 -123 240 C ATOM 2086 N3 DA C 58 -1.993 -17.816 -14.258 1.00 12.29 N ANISOU 2086 N3 DA C 58 1704 1619 1345 -731 -124 243 N ATOM 2087 C4 DA C 58 -1.666 -18.320 -15.449 1.00 10.26 C ANISOU 2087 C4 DA C 58 1447 1359 1093 -728 -121 244 C ATOM 2088 H5' DA C 58 4.113 -19.922 -15.594 1.00 43.78 H ATOM 2089 H5'' DA C 58 4.281 -21.308 -14.847 1.00 43.78 H ATOM 2090 H4' DA C 58 2.706 -20.055 -13.714 1.00 46.63 H ATOM 2091 H3' DA C 58 1.785 -22.397 -14.902 1.00 44.07 H ATOM 2092 H2' DA C 58 -0.260 -21.649 -15.243 1.00 28.49 H ATOM 2093 H2'' DA C 58 -0.388 -21.339 -13.683 1.00 28.49 H ATOM 2094 H1' DA C 58 0.232 -19.224 -13.932 1.00 26.90 H ATOM 2095 H8 DA C 58 -0.113 -19.988 -17.504 1.00 23.40 H ATOM 2096 H61 DA C 58 -4.767 -16.352 -17.643 1.00 13.23 H ATOM 2097 H62 DA C 58 -3.897 -17.227 -18.477 1.00 13.23 H ATOM 2098 H2 DA C 58 -3.316 -16.615 -13.574 1.00 14.48 H HETATM 2099 N1 5CM C 59 -3.841 -20.806 -12.451 1.00 19.63 N ANISOU 2099 N1 5CM C 59 2638 2555 2264 -735 -128 247 N HETATM 2100 C2 5CM C 59 -4.859 -19.756 -12.646 1.00 17.03 C ANISOU 2100 C2 5CM C 59 2311 2228 1933 -735 -127 244 C HETATM 2101 N3 5CM C 59 -5.364 -19.498 -13.983 1.00 10.39 N ANISOU 2101 N3 5CM C 59 1470 1384 1094 -732 -123 241 N HETATM 2102 C4 5CM C 59 -4.854 -20.228 -15.106 1.00 9.48 C ANISOU 2102 C4 5CM C 59 1353 1264 983 -728 -121 242 C HETATM 2103 C5 5CM C 59 -3.797 -21.266 -14.931 1.00 14.14 C ANISOU 2103 C5 5CM C 59 1943 1854 1577 -728 -122 246 C HETATM 2104 C5A 5CM C 59 -3.251 -22.035 -16.156 1.00 18.01 C ANISOU 2104 C5A 5CM C 59 2432 2339 2073 -725 -119 246 C HETATM 2105 C6 5CM C 59 -3.298 -21.510 -13.575 1.00 16.52 C ANISOU 2105 C6 5CM C 59 2244 2157 1876 -732 -125 248 C HETATM 2106 O2 5CM C 59 -5.274 -19.154 -11.684 1.00 18.90 O ANISOU 2106 O2 5CM C 59 2548 2468 2165 -738 -129 243 O HETATM 2107 N4 5CM C 59 -5.361 -19.905 -16.364 1.00 11.11 N ANISOU 2107 N4 5CM C 59 1561 1469 1192 -725 -118 240 N HETATM 2108 C1' 5CM C 59 -3.303 -21.024 -11.112 1.00 24.83 C ANISOU 2108 C1' 5CM C 59 3296 3216 2921 -738 -131 250 C HETATM 2109 C2' 5CM C 59 -3.210 -22.470 -10.683 1.00 33.20 C ANISOU 2109 C2' 5CM C 59 4357 4277 3981 -739 -133 253 C HETATM 2110 C3' 5CM C 59 -2.119 -22.403 -9.628 1.00 38.00 C ANISOU 2110 C3' 5CM C 59 4964 4886 4590 -742 -136 256 C HETATM 2111 C4' 5CM C 59 -1.215 -21.261 -10.101 1.00 28.75 C ANISOU 2111 C4' 5CM C 59 3790 3712 3422 -741 -135 254 C HETATM 2112 O4' 5CM C 59 -1.964 -20.573 -11.136 1.00 24.55 O ANISOU 2112 O4' 5CM C 59 3259 3178 2890 -738 -132 251 O HETATM 2113 O3' 5CM C 59 -2.626 -22.047 -8.341 1.00 34.40 O ANISOU 2113 O3' 5CM C 59 4508 4434 4128 -746 -139 255 O HETATM 2114 C5' 5CM C 59 0.106 -21.720 -10.672 1.00 39.67 C ANISOU 2114 C5' 5CM C 59 5170 5090 4811 -739 -134 257 C HETATM 2115 O5' 5CM C 59 -0.087 -22.914 -11.430 1.00 50.68 O ANISOU 2115 O5' 5CM C 59 6565 6482 6208 -737 -132 258 O HETATM 2116 P 5CM C 59 1.078 -23.477 -12.424 1.00 52.91 P ANISOU 2116 P 5CM C 59 6845 6760 6497 -734 -130 259 P HETATM 2117 OP1 5CM C 59 2.139 -24.207 -11.621 1.00 55.57 O ANISOU 2117 OP1 5CM C 59 7182 7097 6837 -735 -133 263 O HETATM 2118 OP2 5CM C 59 0.365 -24.182 -13.582 1.00 37.24 O ANISOU 2118 OP2 5CM C 59 4862 4773 4514 -730 -126 258 O HETATM 2119 H5A1 5CM C 59 -2.853 -21.408 -16.780 1.00 21.62 H HETATM 2120 H5A2 5CM C 59 -3.977 -22.508 -16.593 1.00 21.62 H HETATM 2121 H5A3 5CM C 59 -2.579 -22.672 -15.865 1.00 21.62 H HETATM 2122 H6 5CM C 59 -2.644 -22.156 -13.437 1.00 19.82 H HETATM 2123 HN41 5CM C 59 -5.091 -20.333 -17.059 1.00 13.34 H HETATM 2124 HN42 5CM C 59 -5.981 -19.313 -16.438 1.00 13.34 H HETATM 2125 H1' 5CM C 59 -3.814 -20.516 -10.463 1.00 29.79 H HETATM 2126 H2' 5CM C 59 -4.048 -22.770 -10.296 1.00 39.84 H HETATM 2127 H2'' 5CM C 59 -2.944 -23.037 -11.423 1.00 39.84 H HETATM 2128 H3' 5CM C 59 -1.627 -23.238 -9.588 1.00 45.60 H HETATM 2129 H4' 5CM C 59 -1.052 -20.652 -9.364 1.00 34.50 H HETATM 2130 H5' 5CM C 59 0.726 -21.894 -9.947 1.00 47.60 H HETATM 2131 H5'' 5CM C 59 0.467 -21.028 -11.249 1.00 47.60 H ATOM 2132 P DG C 60 -3.455 -23.097 -7.468 1.00 32.27 P ANISOU 2132 P DG C 60 4241 4168 3853 -748 -141 257 P ATOM 2133 OP1 DG C 60 -3.333 -22.666 -6.063 1.00 31.46 O ANISOU 2133 OP1 DG C 60 4138 4069 3746 -752 -145 258 O ATOM 2134 OP2 DG C 60 -3.118 -24.461 -7.908 1.00 34.07 O ANISOU 2134 OP2 DG C 60 4468 4393 4084 -746 -140 260 O ATOM 2135 O5' DG C 60 -4.968 -22.832 -7.895 1.00 32.06 O ANISOU 2135 O5' DG C 60 4216 4142 3822 -747 -139 254 O ATOM 2136 C5' DG C 60 -5.585 -21.613 -7.552 1.00 23.01 C ANISOU 2136 C5' DG C 60 3071 2999 2672 -749 -139 251 C ATOM 2137 C4' DG C 60 -6.935 -21.513 -8.202 1.00 19.97 C ANISOU 2137 C4' DG C 60 2688 2615 2285 -747 -137 248 C ATOM 2138 O4' DG C 60 -6.763 -21.324 -9.622 1.00 20.93 O ANISOU 2138 O4' DG C 60 2809 2732 2412 -743 -133 246 O ATOM 2139 C3' DG C 60 -7.819 -22.761 -8.050 1.00 23.95 C ANISOU 2139 C3' DG C 60 3193 3120 2786 -747 -137 249 C ATOM 2140 O3' DG C 60 -8.875 -22.496 -7.170 1.00 25.95 O ANISOU 2140 O3' DG C 60 3448 3377 3033 -750 -138 247 O ATOM 2141 C2' DG C 60 -8.304 -23.053 -9.470 1.00 21.19 C ANISOU 2141 C2' DG C 60 2845 2767 2440 -743 -133 247 C ATOM 2142 C1' DG C 60 -7.927 -21.790 -10.233 1.00 23.54 C ANISOU 2142 C1' DG C 60 3141 3063 2740 -741 -131 245 C ATOM 2143 N9 DG C 60 -7.684 -22.000 -11.654 1.00 17.34 N ANISOU 2143 N9 DG C 60 2355 2273 1961 -737 -128 244 N ATOM 2144 C8 DG C 60 -6.794 -22.858 -12.239 1.00 20.40 C ANISOU 2144 C8 DG C 60 2741 2657 2352 -735 -127 246 C ATOM 2145 N7 DG C 60 -6.828 -22.827 -13.556 1.00 16.44 N ANISOU 2145 N7 DG C 60 2239 2152 1855 -732 -124 245 N ATOM 2146 C5 DG C 60 -7.816 -21.903 -13.842 1.00 9.55 C ANISOU 2146 C5 DG C 60 1368 1281 979 -732 -123 242 C ATOM 2147 C6 DG C 60 -8.301 -21.450 -15.087 1.00 10.11 C ANISOU 2147 C6 DG C 60 1439 1349 1052 -729 -120 239 C ATOM 2148 O6 DG C 60 -7.971 -21.802 -16.231 1.00 12.23 O ANISOU 2148 O6 DG C 60 1707 1615 1325 -726 -117 239 O ATOM 2149 N1 DG C 60 -9.284 -20.497 -14.921 1.00 9.24 N ANISOU 2149 N1 DG C 60 1331 1243 939 -729 -120 237 N ATOM 2150 C2 DG C 60 -9.751 -20.041 -13.725 1.00 11.30 C ANISOU 2150 C2 DG C 60 1592 1507 1195 -733 -122 236 C ATOM 2151 N2 DG C 60 -10.714 -19.128 -13.788 1.00 13.81 N ANISOU 2151 N2 DG C 60 1911 1826 1510 -733 -122 233 N ATOM 2152 N3 DG C 60 -9.313 -20.455 -12.555 1.00 11.98 N ANISOU 2152 N3 DG C 60 1678 1595 1279 -736 -125 238 N ATOM 2153 C4 DG C 60 -8.347 -21.381 -12.687 1.00 13.08 C ANISOU 2153 C4 DG C 60 1816 1732 1421 -735 -125 241 C ATOM 2154 H5' DG C 60 -5.029 -20.877 -7.853 1.00 27.61 H ATOM 2155 H5'' DG C 60 -5.688 -21.565 -6.589 1.00 27.61 H ATOM 2156 H4' DG C 60 -7.405 -20.748 -7.836 1.00 23.96 H ATOM 2157 H3' DG C 60 -7.289 -23.504 -7.721 1.00 28.74 H ATOM 2158 H2' DG C 60 -7.844 -23.824 -9.837 1.00 25.43 H ATOM 2159 H2'' DG C 60 -9.265 -23.186 -9.483 1.00 25.43 H ATOM 2160 H1' DG C 60 -8.630 -21.130 -10.124 1.00 28.25 H ATOM 2161 H8 DG C 60 -6.221 -23.409 -11.755 1.00 24.48 H ATOM 2162 H1 DG C 60 -9.641 -20.171 -15.633 1.00 11.09 H ATOM 2163 H21 DG C 60 -11.052 -18.808 -13.064 1.00 16.57 H ATOM 2164 H22 DG C 60 -11.000 -18.856 -14.552 1.00 16.57 H ATOM 2165 P DC C 61 -9.722 -23.699 -6.514 1.00 35.09 P ANISOU 2165 P DC C 61 4608 4538 4187 -752 -140 249 P ATOM 2166 OP1 DC C 61 -10.528 -23.120 -5.418 1.00 33.61 O ANISOU 2166 OP1 DC C 61 4422 4355 3993 -755 -141 247 O ATOM 2167 OP2 DC C 61 -8.837 -24.863 -6.280 1.00 44.63 O ANISOU 2167 OP2 DC C 61 5816 5745 5398 -752 -141 252 O ATOM 2168 O5' DC C 61 -10.684 -24.178 -7.684 1.00 28.15 O ANISOU 2168 O5' DC C 61 3730 3656 3308 -748 -136 247 O ATOM 2169 C5' DC C 61 -12.078 -23.953 -7.604 1.00 28.59 C ANISOU 2169 C5' DC C 61 3789 3716 3360 -749 -136 244 C ATOM 2170 C4' DC C 61 -12.482 -22.642 -8.252 1.00 20.90 C ANISOU 2170 C4' DC C 61 2814 2741 2386 -747 -133 241 C ATOM 2171 O4' DC C 61 -11.692 -22.407 -9.473 1.00 21.93 O ANISOU 2171 O4' DC C 61 2943 2867 2523 -744 -131 240 O ATOM 2172 C3' DC C 61 -13.930 -22.613 -8.689 1.00 27.94 C ANISOU 2172 C3' DC C 61 3708 3633 3275 -746 -132 238 C ATOM 2173 O3' DC C 61 -14.505 -21.326 -8.468 1.00 32.15 O ANISOU 2173 O3' DC C 61 4242 4169 3806 -748 -131 235 O ATOM 2174 C2' DC C 61 -13.831 -22.964 -10.167 1.00 16.54 C ANISOU 2174 C2' DC C 61 2263 2185 1836 -742 -129 238 C ATOM 2175 C1' DC C 61 -12.561 -22.269 -10.566 1.00 16.83 C ANISOU 2175 C1' DC C 61 2298 2219 1877 -741 -128 238 C ATOM 2176 N1 DC C 61 -11.903 -22.840 -11.802 1.00 12.24 N ANISOU 2176 N1 DC C 61 1716 1633 1302 -737 -126 239 N ATOM 2177 C2 DC C 61 -12.316 -22.388 -13.026 1.00 10.39 C ANISOU 2177 C2 DC C 61 1481 1396 1069 -734 -123 237 C ATOM 2178 O2 DC C 61 -13.217 -21.551 -13.080 1.00 12.24 O ANISOU 2178 O2 DC C 61 1717 1633 1302 -735 -122 234 O ATOM 2179 N3 DC C 61 -11.707 -22.875 -14.151 1.00 10.45 N ANISOU 2179 N3 DC C 61 1489 1401 1083 -731 -121 237 N ATOM 2180 C4 DC C 61 -10.737 -23.781 -14.030 1.00 9.14 C ANISOU 2180 C4 DC C 61 1321 1233 920 -731 -121 240 C ATOM 2181 N4 DC C 61 -10.166 -24.244 -15.141 1.00 10.53 N ANISOU 2181 N4 DC C 61 1496 1405 1100 -728 -119 241 N ATOM 2182 C5 DC C 61 -10.314 -24.267 -12.769 1.00 12.51 C ANISOU 2182 C5 DC C 61 1748 1662 1344 -734 -124 243 C ATOM 2183 C6 DC C 61 -10.925 -23.773 -11.688 1.00 11.80 C ANISOU 2183 C6 DC C 61 1658 1575 1248 -737 -127 242 C ATOM 2184 H5' DC C 61 -12.341 -23.937 -6.671 1.00 34.31 H ATOM 2185 H5'' DC C 61 -12.540 -24.680 -8.049 1.00 34.31 H ATOM 2186 H4' DC C 61 -12.324 -21.917 -7.628 1.00 25.08 H ATOM 2187 H3' DC C 61 -14.436 -23.292 -8.216 1.00 33.53 H ATOM 2188 HO3' DC C 61 -14.813 -20.888 -9.115 1.00 38.58 H ATOM 2189 H2' DC C 61 -13.754 -23.924 -10.290 1.00 19.85 H ATOM 2190 H2'' DC C 61 -14.589 -22.609 -10.659 1.00 19.85 H ATOM 2191 H1' DC C 61 -12.745 -21.328 -10.709 1.00 20.19 H ATOM 2192 H41 DC C 61 -9.538 -24.829 -15.090 1.00 12.64 H ATOM 2193 H42 DC C 61 -10.427 -23.958 -15.909 1.00 12.64 H ATOM 2194 H5 DC C 61 -9.632 -24.894 -12.696 1.00 15.01 H ATOM 2195 H6 DC C 61 -10.655 -24.053 -10.843 1.00 14.16 H TER 2196 DC C 61 HETATM 2197 ZN ZN A 501 0.917 -7.083 -0.070 0.84 19.25 ZN HETATM 2198 ZN ZN A 502 -17.896 -6.140 -19.590 0.91 13.27 ZN HETATM 2199 ZN ZN A 503 -6.904 -27.219 -32.954 0.91 8.10 ZN HETATM 2200 O HOH A 601 -1.502 -19.495 -33.967 1.00 26.84 O HETATM 2201 O HOH A 602 -1.031 -1.067 6.121 1.00 21.42 O HETATM 2202 O HOH A 603 -21.102 2.161 -22.460 1.00 27.85 O HETATM 2203 O HOH A 604 6.387 -6.631 4.272 1.00 28.06 O HETATM 2204 O HOH A 605 -16.996 6.737 -26.012 1.00 24.70 O HETATM 2205 O HOH A 606 -17.106 -15.125 -31.944 1.00 27.64 O HETATM 2206 O HOH A 607 -6.949 -3.797 2.606 1.00 36.37 O HETATM 2207 O HOH A 608 -6.622 -29.853 -39.596 1.00 23.91 O HETATM 2208 O HOH A 609 7.293 1.976 -9.134 1.00 20.17 O HETATM 2209 O HOH A 610 -9.489 -9.239 -34.208 1.00 35.34 O HETATM 2210 O HOH A 611 -11.914 -28.582 -30.968 1.00 23.43 O HETATM 2211 O HOH A 612 -1.587 -36.731 -33.004 1.00 19.79 O HETATM 2212 O HOH A 613 -2.926 -20.575 -36.705 1.00 16.04 O HETATM 2213 O HOH A 614 -16.805 -18.598 -32.378 1.00 36.84 O HETATM 2214 O HOH A 615 0.872 -19.508 -36.034 1.00 20.85 O HETATM 2215 O HOH A 616 -10.031 -28.012 -39.151 1.00 25.92 O HETATM 2216 O HOH A 617 -0.204 -27.117 -25.767 1.00 25.66 O HETATM 2217 O HOH A 618 -6.708 -35.805 -27.545 1.00 25.94 O HETATM 2218 O HOH A 619 -9.182 -19.984 -38.547 1.00 24.06 O HETATM 2219 O HOH A 620 -1.820 -23.693 -32.549 1.00 13.80 O HETATM 2220 O HOH A 621 -3.992 1.414 -5.329 1.00 18.20 O HETATM 2221 O HOH A 622 -13.068 -7.086 -28.657 1.00 17.65 O HETATM 2222 O HOH A 623 -7.672 -28.913 -23.388 1.00 19.57 O HETATM 2223 O HOH A 624 -15.395 2.473 -19.006 1.00 36.76 O HETATM 2224 O HOH A 625 -0.132 -17.893 -24.156 1.00 24.38 O HETATM 2225 O HOH A 626 -14.623 -13.995 -27.765 1.00 11.65 O HETATM 2226 O HOH A 627 -14.638 -1.562 -22.385 1.00 27.54 O HETATM 2227 O HOH A 628 -22.259 -9.839 -23.422 1.00 25.61 O HETATM 2228 O HOH A 629 -4.722 -28.728 -20.023 1.00 39.61 O HETATM 2229 O HOH A 630 -0.572 -37.615 -25.923 1.00 25.43 O HETATM 2230 O HOH A 631 12.241 1.711 -9.578 1.00 24.05 O HETATM 2231 O HOH A 632 -4.448 -16.494 -35.352 1.00 18.30 O HETATM 2232 O HOH A 633 6.801 0.647 -5.593 1.00 30.01 O HETATM 2233 O HOH A 634 12.259 -1.283 -10.111 1.00 31.85 O HETATM 2234 O HOH A 635 6.409 2.892 -6.606 1.00 36.92 O HETATM 2235 O HOH A 636 -7.229 -34.036 -32.866 1.00 23.01 O HETATM 2236 O HOH A 637 -4.048 3.034 -12.279 1.00 37.04 O HETATM 2237 O HOH A 638 4.525 -4.995 6.556 1.00 37.18 O HETATM 2238 O HOH A 639 -5.790 -36.572 -31.350 1.00 37.00 O HETATM 2239 O HOH A 640 0.885 -15.528 -31.505 1.00 34.33 O HETATM 2240 O HOH A 641 -12.361 3.377 -16.631 1.00 36.45 O HETATM 2241 O HOH A 642 0.000 -21.347 -32.238 0.50 25.19 O HETATM 2242 O HOH A 643 -16.860 -17.535 -26.861 1.00 33.25 O HETATM 2243 O HOH A 644 -21.388 -11.673 -22.487 1.00 35.49 O HETATM 2244 O HOH A 645 -12.982 3.786 -14.130 1.00 32.17 O HETATM 2245 O HOH A 646 -23.081 -7.591 -24.067 1.00 32.49 O HETATM 2246 O HOH A 647 -2.595 -27.159 -20.798 1.00 33.91 O HETATM 2247 O HOH A 648 -1.435 -24.979 -21.742 1.00 23.25 O HETATM 2248 O HOH A 649 -8.956 -27.030 -24.783 1.00 11.06 O HETATM 2249 O HOH A 650 -6.705 -15.993 -37.208 1.00 26.45 O HETATM 2250 O HOH A 651 -12.052 -0.146 -22.738 1.00 29.62 O HETATM 2251 O HOH A 652 -9.524 -5.443 -31.727 1.00 25.66 O HETATM 2252 O HOH A 653 -9.156 -30.167 -37.926 1.00 29.09 O HETATM 2253 O HOH A 654 -8.426 -24.293 -24.471 1.00 9.89 O HETATM 2254 O HOH A 655 -3.201 -3.220 -21.578 1.00 11.57 O HETATM 2255 O HOH A 656 -12.455 -18.185 -26.895 1.00 11.42 O HETATM 2256 O HOH A 657 -4.596 -4.738 -23.511 1.00 12.44 O HETATM 2257 O HOH A 658 -5.681 -10.903 -19.884 1.00 12.41 O HETATM 2258 O HOH A 659 -1.492 -4.481 -17.039 1.00 13.22 O HETATM 2259 O HOH A 660 -7.755 -7.430 -13.761 1.00 13.86 O HETATM 2260 O HOH A 661 -7.510 -1.881 -21.537 1.00 14.43 O HETATM 2261 O HOH A 662 -13.453 -21.169 -34.500 1.00 14.25 O HETATM 2262 O HOH A 663 -11.320 -13.658 -22.371 1.00 14.40 O HETATM 2263 O HOH A 664 -10.952 -6.287 -26.376 1.00 15.39 O HETATM 2264 O HOH A 665 -11.010 -23.732 -24.478 1.00 15.61 O HETATM 2265 O HOH A 666 4.143 -1.781 -14.726 1.00 15.46 O HETATM 2266 O HOH A 667 -11.747 -16.345 -22.916 1.00 16.31 O HETATM 2267 O HOH A 668 2.052 -2.984 -13.651 1.00 16.48 O HETATM 2268 O HOH A 669 -2.866 -2.589 -15.680 1.00 17.12 O HETATM 2269 O HOH A 670 -4.392 -13.483 -24.842 1.00 17.45 O HETATM 2270 O HOH A 671 -1.566 -0.099 -15.214 1.00 17.89 O HETATM 2271 O HOH A 672 -9.119 -6.646 -28.435 1.00 17.35 O HETATM 2272 O HOH A 673 -2.364 -22.309 -21.503 1.00 18.41 O HETATM 2273 O HOH A 674 -13.248 -20.147 -28.464 1.00 20.60 O HETATM 2274 O HOH A 675 -4.200 -20.335 -18.901 1.00 21.38 O HETATM 2275 O HOH A 676 1.925 -7.251 -9.095 1.00 21.14 O HETATM 2276 O HOH A 677 -12.590 -12.751 -34.269 1.00 21.86 O HETATM 2277 O HOH A 678 -4.819 -22.811 -19.428 1.00 22.32 O HETATM 2278 O HOH A 679 -7.376 0.410 -20.223 1.00 23.19 O HETATM 2279 O HOH A 680 -3.544 -14.615 -21.368 1.00 23.97 O HETATM 2280 O HOH A 681 12.693 -5.402 -16.361 1.00 25.42 O HETATM 2281 O HOH A 682 -12.330 1.373 -20.371 1.00 25.90 O HETATM 2282 O HOH A 683 -4.340 -7.438 -23.547 1.00 24.90 O HETATM 2283 O HOH A 684 -9.698 -1.616 -23.046 1.00 26.26 O HETATM 2284 O HOH A 685 -7.779 -4.222 -7.134 1.00 26.68 O HETATM 2285 O HOH A 686 -8.924 -15.340 -35.596 1.00 27.87 O HETATM 2286 O HOH A 687 -10.749 -3.770 -26.671 1.00 28.09 O HETATM 2287 O HOH A 688 -8.916 -2.979 -24.993 1.00 27.25 O HETATM 2288 O HOH A 689 -16.799 -4.481 -10.648 1.00 28.36 O HETATM 2289 O HOH A 690 0.463 -19.120 -21.821 1.00 28.97 O HETATM 2290 O HOH A 691 -12.476 -21.682 -24.322 1.00 30.03 O HETATM 2291 O HOH A 692 -18.179 -10.504 -15.868 1.00 29.18 O HETATM 2292 O HOH A 693 12.783 -7.237 -14.259 1.00 29.45 O HETATM 2293 O HOH A 694 -19.656 -8.900 -17.408 1.00 29.44 O HETATM 2294 O HOH A 695 -14.001 -20.649 -31.821 1.00 31.33 O HETATM 2295 O HOH A 696 7.146 -12.847 -2.459 1.00 30.96 O HETATM 2296 O HOH A 697 -3.094 -24.753 -19.280 1.00 32.89 O HETATM 2297 O HOH A 698 -3.052 -2.635 -12.109 1.00 32.75 O HETATM 2298 O HOH A 699 8.921 -10.132 -8.408 1.00 31.98 O HETATM 2299 O HOH A 700 -4.946 -10.580 -25.867 1.00 31.10 O HETATM 2300 O HOH A 701 -19.311 -11.150 -20.454 1.00 34.17 O HETATM 2301 O HOH A 702 -24.187 -3.804 -16.532 1.00 33.98 O HETATM 2302 O HOH A 703 -12.979 1.567 -12.671 1.00 36.38 O HETATM 2303 O HOH A 704 -6.858 -8.222 -31.776 1.00 37.60 O HETATM 2304 O HOH A 705 9.217 -7.516 -10.090 1.00 44.85 O HETATM 2305 O HOH B 101 -12.269 -25.011 -26.467 1.00 20.31 O HETATM 2306 O HOH B 102 9.674 -2.650 -29.231 1.00 18.26 O HETATM 2307 O HOH B 103 11.582 0.894 -27.130 1.00 9.42 O HETATM 2308 O HOH B 104 -17.227 -22.904 -19.478 1.00 26.12 O HETATM 2309 O HOH B 105 11.564 -2.010 -16.401 1.00 20.12 O HETATM 2310 O HOH B 106 -8.266 -28.358 -20.639 1.00 16.04 O HETATM 2311 O HOH B 107 7.311 -0.907 -27.549 1.00 32.01 O HETATM 2312 O HOH B 108 -16.578 -18.882 -17.478 1.00 24.54 O HETATM 2313 O HOH B 109 13.790 -3.584 -22.972 1.00 16.86 O HETATM 2314 O HOH B 110 -8.519 -28.104 -17.033 1.00 21.97 O HETATM 2315 O HOH B 111 -19.496 -24.264 -23.779 1.00 34.23 O HETATM 2316 O HOH B 112 -14.535 -16.309 -26.328 1.00 14.91 O HETATM 2317 O HOH B 113 14.775 -4.735 -20.530 1.00 21.76 O HETATM 2318 O HOH B 114 -10.251 -12.810 -20.007 1.00 10.72 O HETATM 2319 O HOH B 115 -10.546 -10.082 -16.945 1.00 11.16 O HETATM 2320 O HOH B 116 -6.844 -21.193 -20.864 1.00 11.35 O HETATM 2321 O HOH B 117 -9.528 -9.623 -14.318 1.00 11.59 O HETATM 2322 O HOH B 118 -17.079 -12.702 -17.387 1.00 15.42 O HETATM 2323 O HOH B 119 4.203 -4.804 -12.936 1.00 17.04 O HETATM 2324 O HOH B 120 7.723 -9.374 -21.187 1.00 17.05 O HETATM 2325 O HOH B 121 7.438 -6.083 -24.681 1.00 18.41 O HETATM 2326 O HOH B 122 -13.503 -7.618 -11.807 1.00 19.06 O HETATM 2327 O HOH B 123 -9.755 -7.313 -11.243 1.00 19.58 O HETATM 2328 O HOH B 124 -5.534 -13.564 -19.735 1.00 20.03 O HETATM 2329 O HOH B 125 -13.670 -16.884 -14.743 1.00 20.43 O HETATM 2330 O HOH B 126 -8.751 -7.966 -8.795 1.00 21.54 O HETATM 2331 O HOH B 127 -2.053 -8.611 -10.809 1.00 22.06 O HETATM 2332 O HOH B 128 -18.828 -13.503 -19.326 1.00 23.22 O HETATM 2333 O HOH B 129 13.176 -6.332 -18.975 1.00 23.54 O HETATM 2334 O HOH B 130 2.595 -9.784 -9.518 1.00 24.08 O HETATM 2335 O HOH B 131 10.669 -8.284 -13.040 1.00 23.87 O HETATM 2336 O HOH B 132 -14.405 -16.186 -23.587 1.00 22.98 O HETATM 2337 O HOH B 133 7.416 -13.522 -17.677 1.00 26.18 O HETATM 2338 O HOH B 134 -5.655 -6.295 -7.761 1.00 26.45 O HETATM 2339 O HOH B 135 -0.692 -8.154 -8.493 1.00 27.03 O HETATM 2340 O HOH B 136 8.525 -8.238 -26.031 1.00 28.36 O HETATM 2341 O HOH B 137 -11.053 -9.281 -7.712 1.00 27.81 O HETATM 2342 O HOH B 138 -13.734 -22.780 -27.430 1.00 27.63 O HETATM 2343 O HOH B 139 -10.343 -15.766 -10.573 1.00 29.05 O HETATM 2344 O HOH B 140 6.321 -4.206 -26.007 1.00 29.42 O HETATM 2345 O HOH B 141 -13.174 -12.855 -8.959 1.00 31.93 O HETATM 2346 O HOH B 142 11.715 -9.350 -26.983 1.00 30.90 O HETATM 2347 O HOH B 143 0.239 -9.743 -6.576 1.00 32.41 O HETATM 2348 O HOH B 144 -4.902 -15.077 -10.331 1.00 30.74 O HETATM 2349 O HOH B 145 3.797 -4.502 -26.029 1.00 30.83 O HETATM 2350 O HOH B 146 -17.205 -14.945 -15.371 1.00 32.80 O HETATM 2351 O HOH B 147 10.962 -12.816 -20.761 1.00 32.16 O HETATM 2352 O HOH B 148 8.348 -12.000 -20.343 1.00 35.09 O HETATM 2353 O HOH B 149 -7.094 -9.817 -6.174 1.00 36.45 O HETATM 2354 O HOH B 150 3.582 -15.579 -5.720 1.00 36.36 O HETATM 2355 O HOH B 151 14.241 -12.863 -18.572 1.00 37.64 O HETATM 2356 O HOH B 152 -12.839 -15.402 -10.468 1.00 37.76 O HETATM 2357 O HOH B 153 1.825 -17.929 -11.661 1.00 37.74 O HETATM 2358 O HOH B 154 -16.052 -17.357 -15.493 1.00 37.33 O HETATM 2359 O HOH B 155 -1.608 -16.330 -9.948 1.00 45.57 O HETATM 2360 O HOH C 101 2.323 -18.537 -25.908 1.00 26.51 O HETATM 2361 O HOH C 102 0.140 -15.260 -28.932 1.00 23.47 O HETATM 2362 O HOH C 103 -0.647 5.353 -12.849 1.00 40.41 O HETATM 2363 O HOH C 104 6.499 -20.865 -22.378 1.00 32.99 O HETATM 2364 O HOH C 105 10.328 -1.022 -14.497 1.00 29.45 O HETATM 2365 O HOH C 106 3.191 -13.318 -31.240 1.00 24.42 O HETATM 2366 O HOH C 107 4.972 -0.521 -23.450 1.00 24.21 O HETATM 2367 O HOH C 108 3.516 1.839 -22.332 1.00 29.15 O HETATM 2368 O HOH C 109 7.566 -17.762 -25.745 1.00 33.22 O HETATM 2369 O HOH C 110 -8.157 -26.420 -14.958 1.00 19.47 O HETATM 2370 O HOH C 111 3.716 -26.580 -10.586 1.00 36.37 O HETATM 2371 O HOH C 112 3.041 4.273 -21.174 1.00 33.75 O HETATM 2372 O HOH C 113 12.731 -0.766 -12.611 1.00 28.87 O HETATM 2373 O HOH C 114 0.721 -4.789 -15.386 1.00 13.88 O HETATM 2374 O HOH C 115 -1.911 -0.270 -18.101 1.00 15.16 O HETATM 2375 O HOH C 116 -2.719 -10.509 -20.216 1.00 15.22 O HETATM 2376 O HOH C 117 -6.807 -23.880 -17.583 1.00 17.50 O HETATM 2377 O HOH C 118 3.132 0.491 -11.250 1.00 19.89 O HETATM 2378 O HOH C 119 3.376 -6.148 -24.138 1.00 19.32 O HETATM 2379 O HOH C 120 -2.269 2.246 -14.144 1.00 19.73 O HETATM 2380 O HOH C 121 -2.397 -9.888 -22.978 1.00 19.95 O HETATM 2381 O HOH C 122 0.222 -0.870 -13.389 1.00 19.79 O HETATM 2382 O HOH C 123 -3.329 3.743 -16.315 1.00 20.65 O HETATM 2383 O HOH C 124 5.701 -7.731 -23.633 1.00 21.23 O HETATM 2384 O HOH C 125 -4.725 -4.252 -26.199 1.00 21.18 O HETATM 2385 O HOH C 126 -6.181 -1.339 -23.808 1.00 21.74 O HETATM 2386 O HOH C 127 -5.022 1.545 -19.969 1.00 22.77 O HETATM 2387 O HOH C 128 -4.665 1.254 -22.586 1.00 24.15 O HETATM 2388 O HOH C 129 6.028 -10.065 -22.949 1.00 25.02 O HETATM 2389 O HOH C 130 -5.599 -24.862 -15.092 1.00 25.88 O HETATM 2390 O HOH C 131 -2.887 -10.008 -27.309 1.00 28.46 O HETATM 2391 O HOH C 132 -1.134 -17.895 -11.588 1.00 27.47 O HETATM 2392 O HOH C 133 3.155 -2.433 -24.643 1.00 29.46 O HETATM 2393 O HOH C 134 -0.340 -11.533 -29.352 1.00 29.95 O HETATM 2394 O HOH C 135 5.813 -10.318 -25.377 1.00 32.25 O HETATM 2395 O HOH C 136 -2.119 -13.273 -23.442 1.00 33.83 O HETATM 2396 O HOH C 137 -6.660 3.844 -19.647 1.00 31.14 O HETATM 2397 O HOH C 138 3.609 -16.825 -14.544 1.00 32.94 O HETATM 2398 O HOH C 139 6.005 -12.196 -22.509 1.00 34.77 O HETATM 2399 O HOH C 140 -3.603 -1.989 -27.586 1.00 36.67 O HETATM 2400 O HOH C 141 -0.434 1.279 -26.750 1.00 35.04 O HETATM 2401 O HOH C 142 -13.144 -17.735 -12.200 1.00 33.39 O HETATM 2402 O HOH C 143 -0.752 -20.602 -20.170 1.00 33.07 O HETATM 2403 O HOH C 144 -2.471 -11.395 -25.268 1.00 37.17 O HETATM 2404 O HOH C 145 -4.409 -17.802 -9.608 1.00 34.85 O HETATM 2405 O HOH C 146 1.589 -22.182 -19.403 1.00 37.27 O HETATM 2406 O HOH C 147 6.443 -14.523 -19.578 1.00 38.98 O HETATM 2407 O HOH C 148 -3.138 -25.775 -15.266 1.00 42.61 O CONECT 89 2197 CONECT 155 2197 CONECT 379 2197 CONECT 458 2197 CONECT 582 2198 CONECT 635 2198 CONECT 846 2198 CONECT 920 2198 CONECT 1035 2199 CONECT 1076 2199 CONECT 1305 2199 CONECT 1377 2199 CONECT 1467 1509 CONECT 1492 1493 1498 1501 CONECT 1493 1492 1494 1499 CONECT 1494 1493 1495 CONECT 1495 1494 1496 1500 CONECT 1496 1495 1497 1498 CONECT 1497 1496 1512 1513 1514 CONECT 1498 1492 1496 1515 CONECT 1499 1493 CONECT 1500 1495 1516 1517 CONECT 1501 1492 1502 1505 1518 CONECT 1502 1501 1503 1519 1520 CONECT 1503 1502 1504 1506 1521 CONECT 1504 1503 1505 1507 1522 CONECT 1505 1501 1504 CONECT 1506 1503 1525 CONECT 1507 1504 1508 1523 1524 CONECT 1508 1507 1509 CONECT 1509 1467 1508 1510 1511 CONECT 1510 1509 CONECT 1511 1509 CONECT 1512 1497 CONECT 1513 1497 CONECT 1514 1497 CONECT 1515 1498 CONECT 1516 1500 CONECT 1517 1500 CONECT 1518 1501 CONECT 1519 1502 CONECT 1520 1502 CONECT 1521 1503 CONECT 1522 1504 CONECT 1523 1507 CONECT 1524 1507 CONECT 1525 1506 CONECT 1664 1706 CONECT 1689 1690 1695 1698 CONECT 1690 1689 1691 1696 CONECT 1691 1690 1692 CONECT 1692 1691 1693 1697 CONECT 1693 1692 1694 1695 CONECT 1694 1693 1709 1710 1711 CONECT 1695 1689 1693 1712 CONECT 1696 1690 CONECT 1697 1692 1713 1714 CONECT 1698 1689 1699 1702 1715 CONECT 1699 1698 1700 1716 1717 CONECT 1700 1699 1701 1703 1718 CONECT 1701 1700 1702 1704 1719 CONECT 1702 1698 1701 CONECT 1703 1700 1722 CONECT 1704 1701 1705 1720 1721 CONECT 1705 1704 1706 CONECT 1706 1664 1705 1707 1708 CONECT 1707 1706 CONECT 1708 1706 CONECT 1709 1694 CONECT 1710 1694 CONECT 1711 1694 CONECT 1712 1695 CONECT 1713 1697 CONECT 1714 1697 CONECT 1715 1698 CONECT 1716 1699 CONECT 1717 1699 CONECT 1718 1700 CONECT 1719 1701 CONECT 1720 1704 CONECT 1721 1704 CONECT 1722 1703 CONECT 1827 1868 CONECT 1851 1852 1857 1860 CONECT 1852 1851 1853 1858 CONECT 1853 1852 1854 CONECT 1854 1853 1855 1859 CONECT 1855 1854 1856 1857 CONECT 1856 1855 1871 1872 1873 CONECT 1857 1851 1855 1874 CONECT 1858 1852 CONECT 1859 1854 1875 1876 CONECT 1860 1851 1861 1864 1877 CONECT 1861 1860 1862 1878 1879 CONECT 1862 1861 1863 1865 1880 CONECT 1863 1862 1864 1866 1881 CONECT 1864 1860 1863 CONECT 1865 1862 1884 CONECT 1866 1863 1867 1882 1883 CONECT 1867 1866 1868 CONECT 1868 1827 1867 1869 1870 CONECT 1869 1868 CONECT 1870 1868 CONECT 1871 1856 CONECT 1872 1856 CONECT 1873 1856 CONECT 1874 1857 CONECT 1875 1859 CONECT 1876 1859 CONECT 1877 1860 CONECT 1878 1861 CONECT 1879 1861 CONECT 1880 1862 CONECT 1881 1863 CONECT 1882 1866 CONECT 1883 1866 CONECT 1884 1865 CONECT 2075 2116 CONECT 2099 2100 2105 2108 CONECT 2100 2099 2101 2106 CONECT 2101 2100 2102 CONECT 2102 2101 2103 2107 CONECT 2103 2102 2104 2105 CONECT 2104 2103 2119 2120 2121 CONECT 2105 2099 2103 2122 CONECT 2106 2100 CONECT 2107 2102 2123 2124 CONECT 2108 2099 2109 2112 2125 CONECT 2109 2108 2110 2126 2127 CONECT 2110 2109 2111 2113 2128 CONECT 2111 2110 2112 2114 2129 CONECT 2112 2108 2111 CONECT 2113 2110 2132 CONECT 2114 2111 2115 2130 2131 CONECT 2115 2114 2116 CONECT 2116 2075 2115 2117 2118 CONECT 2117 2116 CONECT 2118 2116 CONECT 2119 2104 CONECT 2120 2104 CONECT 2121 2104 CONECT 2122 2105 CONECT 2123 2107 CONECT 2124 2107 CONECT 2125 2108 CONECT 2126 2109 CONECT 2127 2109 CONECT 2128 2110 CONECT 2129 2111 CONECT 2130 2114 CONECT 2131 2114 CONECT 2132 2113 CONECT 2197 89 155 379 458 CONECT 2198 582 635 846 920 CONECT 2199 1035 1076 1305 1377 MASTER 510 0 7 4 6 0 3 6 1381 3 155 9 END
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Related entries of code: 4x9j
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1jk1
RCSB PDB
PDBbind
11aa, >1JK1_2|Chain... at 90%
1p47
RCSB PDB
PDBbind
22aa, >1P47_2|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4x9j
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Early growth response protein 1, EGR-1
Ligand Name
12-bp Doubly Methylated DNA
EC.Number
E.C.-.-.-.-
Resolution
1.41(Å)
Affinity (Kd/Ki/IC50)
Kd=10nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Febs Lett. Vol. 589: pp. 1748-1753
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):
P18146
Entrez Gene ID
NCBI Entrez Gene ID:
1958
ASD
Information of known allosteric effects of PDB entries
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