Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION REGULATOR/DNA 27-APR-16 5JLW TITLE ANTPHD WITH 15BP DNA DUPLEX R-MONOTHIOATED AT CYTIDINE-8 COMPND MOL_ID: 1; COMPND 2 MOLECULE: HOMEOTIC PROTEIN ANTENNAPEDIA; COMPND 3 CHAIN: A, D; COMPND 4 ENGINEERED: YES; COMPND 5 MUTATION: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: DNA (5'-D(*AP*GP*AP*AP*AP*GP*CP*(C7R) COMPND 8 P*AP*TP*TP*AP*GP*AP*G)-3'); COMPND 9 CHAIN: B, E; COMPND 10 ENGINEERED: YES; COMPND 11 OTHER_DETAILS: R-MONOTHIOLATED PHOSPHATE AT CYTIDINE 8; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'-D(*TP*CP*TP*CP*TP*AP*AP*TP*GP*GP*CP*TP*TP*TP*C)- COMPND 14 3'); COMPND 15 CHAIN: C, F; COMPND 16 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; SOURCE 3 ORGANISM_COMMON: FRUIT FLY; SOURCE 4 ORGANISM_TAXID: 7227; SOURCE 5 GENE: ANTP, CG1028; 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: UNIDENTIFIED; SOURCE 11 ORGANISM_TAXID: 32644; SOURCE 12 MOL_ID: 3; SOURCE 13 SYNTHETIC: YES; SOURCE 14 ORGANISM_SCIENTIFIC: UNIDENTIFIED; SOURCE 15 ORGANISM_TAXID: 32644 KEYWDS HOMEODOMAIN, DNA-BINDING PROTEIN, COMPLEX (HOMEODOMAIN-DNA), KEYWDS 2 TRANSCRIPTION-DNA COMPLEX, TRANSCRIPTION REGULATOR-DNA COMPLEX, KEYWDS 3 MONOTHIOLATED DNA EXPDTA X-RAY DIFFRACTION AUTHOR M.A.WHITE,L.ZANDARASHVILI,J.IWAHARA,D.NGUYEN REVDAT 7 25-DEC-19 5JLW 1 DBREF REVDAT 6 07-MAR-18 5JLW 1 REMARK REVDAT 5 27-SEP-17 5JLW 1 REMARK REVDAT 4 20-SEP-17 5JLW 1 REMARK REVDAT 3 14-SEP-16 5JLW 1 JRNL REVDAT 2 13-JUL-16 5JLW 1 TITLE REVDAT 1 22-JUN-16 5JLW 0 JRNL AUTH D.NGUYEN,L.ZANDARASHVILI,M.A.WHITE,J.IWAHARA JRNL TITL STEREOSPECIFIC EFFECTS OF OXYGEN-TO-SULFUR SUBSTITUTION IN JRNL TITL 2 DNA PHOSPHATE ON ION PAIR DYNAMICS AND PROTEIN-DNA AFFINITY. JRNL REF CHEMBIOCHEM V. 17 1636 2016 JRNL REFN ESSN 1439-7633 JRNL PMID 27271797 JRNL DOI 10.1002/CBIC.201600265 REMARK 2 REMARK 2 RESOLUTION. 2.09 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.10_2155 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 : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.09 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 19.30 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 96.1 REMARK 3 NUMBER OF REFLECTIONS : 48110 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.219 REMARK 3 R VALUE (WORKING SET) : 0.218 REMARK 3 FREE R VALUE : 0.242 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.970 REMARK 3 FREE R VALUE TEST SET COUNT : 2390 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 19.2984 - 5.3334 0.89 2530 123 0.1974 0.2063 REMARK 3 2 5.3334 - 4.2481 0.99 2775 146 0.1672 0.2012 REMARK 3 3 4.2481 - 3.7155 0.99 2750 150 0.1661 0.1956 REMARK 3 4 3.7155 - 3.3778 0.98 2716 142 0.1729 0.1849 REMARK 3 5 3.3778 - 3.1368 0.95 2670 140 0.1893 0.2540 REMARK 3 6 3.1368 - 2.9525 0.98 2762 144 0.2309 0.2196 REMARK 3 7 2.9525 - 2.8051 0.99 2759 141 0.2501 0.2547 REMARK 3 8 2.8051 - 2.6833 0.98 2764 142 0.2556 0.3459 REMARK 3 9 2.6833 - 2.5803 0.98 2772 143 0.2754 0.2874 REMARK 3 10 2.5803 - 2.4914 0.98 2723 146 0.2711 0.2916 REMARK 3 11 2.4914 - 2.4137 0.98 2729 140 0.2873 0.3712 REMARK 3 12 2.4137 - 2.3448 0.99 2765 145 0.2776 0.2849 REMARK 3 13 2.3448 - 2.2832 0.98 2743 143 0.2904 0.3455 REMARK 3 14 2.2832 - 2.2276 0.98 2758 148 0.3105 0.2875 REMARK 3 15 2.2276 - 2.1770 0.97 2728 144 0.3112 0.3401 REMARK 3 16 2.1770 - 2.1307 0.96 2691 142 0.3272 0.3511 REMARK 3 17 2.1307 - 2.0881 0.75 2085 111 0.4013 0.3914 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL 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) : 0.290 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 28.320 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 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 : 0.009 2479 REMARK 3 ANGLE : 1.117 3595 REMARK 3 CHIRALITY : 0.049 383 REMARK 3 PLANARITY : 0.007 248 REMARK 3 DIHEDRAL : 27.454 1265 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 33 REMARK 3 TLS GROUP : 1 REMARK 3 SELECTION: (CHAIN A AND RESID 1:13) REMARK 3 ORIGIN FOR THE GROUP (A): 24.5127 14.2077 2.2277 REMARK 3 T TENSOR REMARK 3 T11: 0.4573 T22: 0.4652 REMARK 3 T33: 0.3360 T12: 0.0799 REMARK 3 T13: 0.0037 T23: -0.0086 REMARK 3 L TENSOR REMARK 3 L11: 0.0496 L22: 0.0448 REMARK 3 L33: 0.0184 L12: -0.0397 REMARK 3 L13: 0.0075 L23: -0.0222 REMARK 3 S TENSOR REMARK 3 S11: 0.1582 S12: 0.2623 S13: 0.1354 REMARK 3 S21: 0.1984 S22: 0.1272 S23: -0.1624 REMARK 3 S31: 0.0791 S32: 0.1457 S33: 0.0011 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: (CHAIN A AND RESID 14:17) REMARK 3 ORIGIN FOR THE GROUP (A): 17.2594 14.5362 7.9079 REMARK 3 T TENSOR REMARK 3 T11: 0.3348 T22: 0.3417 REMARK 3 T33: 0.3302 T12: 0.0752 REMARK 3 T13: 0.0221 T23: 0.0026 REMARK 3 L TENSOR REMARK 3 L11: 0.0123 L22: 0.0157 REMARK 3 L33: 0.0182 L12: 0.0145 REMARK 3 L13: -0.0053 L23: -0.0107 REMARK 3 S TENSOR REMARK 3 S11: 0.2069 S12: -0.0810 S13: -0.0267 REMARK 3 S21: 0.0920 S22: 0.0851 S23: 0.0857 REMARK 3 S31: 0.0318 S32: 0.0469 S33: 0.0006 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: (CHAIN A AND RESID 18:23) REMARK 3 ORIGIN FOR THE GROUP (A): 9.5248 14.9218 8.4647 REMARK 3 T TENSOR REMARK 3 T11: 0.3967 T22: 0.4196 REMARK 3 T33: 0.3487 T12: 0.1307 REMARK 3 T13: -0.0003 T23: 0.0249 REMARK 3 L TENSOR REMARK 3 L11: 0.0056 L22: 0.0293 REMARK 3 L33: 0.0141 L12: 0.0127 REMARK 3 L13: -0.0065 L23: -0.0155 REMARK 3 S TENSOR REMARK 3 S11: 0.0803 S12: -0.0071 S13: 0.2150 REMARK 3 S21: -0.0494 S22: -0.0060 S23: 0.1344 REMARK 3 S31: 0.2600 S32: -0.0501 S33: -0.0001 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: (CHAIN A AND RESID 24:28) REMARK 3 ORIGIN FOR THE GROUP (A): 5.7271 21.1037 2.8856 REMARK 3 T TENSOR REMARK 3 T11: 0.3865 T22: 0.4398 REMARK 3 T33: 0.4324 T12: 0.1128 REMARK 3 T13: -0.0996 T23: -0.0525 REMARK 3 L TENSOR REMARK 3 L11: 0.0177 L22: 0.0148 REMARK 3 L33: 0.0147 L12: -0.0012 REMARK 3 L13: -0.0174 L23: 0.0015 REMARK 3 S TENSOR REMARK 3 S11: 0.0079 S12: -0.1423 S13: 0.0548 REMARK 3 S21: 0.0684 S22: 0.1946 S23: 0.1679 REMARK 3 S31: 0.0724 S32: -0.1323 S33: 0.0005 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: (CHAIN A AND RESID 29:33) REMARK 3 ORIGIN FOR THE GROUP (A): 12.4297 29.3937 4.8370 REMARK 3 T TENSOR REMARK 3 T11: 0.5808 T22: 0.3685 REMARK 3 T33: 0.4730 T12: 0.0606 REMARK 3 T13: -0.0752 T23: -0.0030 REMARK 3 L TENSOR REMARK 3 L11: 0.0360 L22: 0.0168 REMARK 3 L33: 0.0164 L12: 0.0080 REMARK 3 L13: 0.0184 L23: 0.0119 REMARK 3 S TENSOR REMARK 3 S11: 0.0431 S12: 0.0576 S13: 0.3126 REMARK 3 S21: -0.0903 S22: 0.1155 S23: 0.2068 REMARK 3 S31: -0.0268 S32: -0.0923 S33: -0.0007 REMARK 3 TLS GROUP : 6 REMARK 3 SELECTION: (CHAIN A AND RESID 34:38) REMARK 3 ORIGIN FOR THE GROUP (A): 18.8118 26.2080 8.1274 REMARK 3 T TENSOR REMARK 3 T11: 0.2853 T22: 0.3870 REMARK 3 T33: 0.4014 T12: 0.0485 REMARK 3 T13: -0.0002 T23: -0.0058 REMARK 3 L TENSOR REMARK 3 L11: 0.0325 L22: 0.0025 REMARK 3 L33: 0.0130 L12: 0.0043 REMARK 3 L13: -0.0019 L23: -0.0030 REMARK 3 S TENSOR REMARK 3 S11: 0.0978 S12: -0.1561 S13: 0.0818 REMARK 3 S21: 0.0434 S22: -0.0178 S23: 0.0050 REMARK 3 S31: 0.0465 S32: 0.0008 S33: -0.0005 REMARK 3 TLS GROUP : 7 REMARK 3 SELECTION: (CHAIN A AND RESID 39:44) REMARK 3 ORIGIN FOR THE GROUP (A): 20.6622 24.4167 0.5328 REMARK 3 T TENSOR REMARK 3 T11: 0.4368 T22: 0.4818 REMARK 3 T33: 0.3506 T12: 0.1320 REMARK 3 T13: 0.0265 T23: 0.0872 REMARK 3 L TENSOR REMARK 3 L11: 0.0178 L22: 0.0250 REMARK 3 L33: 0.0142 L12: -0.0056 REMARK 3 L13: -0.0126 L23: 0.0133 REMARK 3 S TENSOR REMARK 3 S11: -0.0825 S12: 0.0699 S13: 0.1150 REMARK 3 S21: -0.2164 S22: -0.1068 S23: -0.1041 REMARK 3 S31: -0.1018 S32: 0.1311 S33: -0.0009 REMARK 3 TLS GROUP : 8 REMARK 3 SELECTION: (CHAIN A AND RESID 45:52) REMARK 3 ORIGIN FOR THE GROUP (A): 14.3651 19.0645 -2.4554 REMARK 3 T TENSOR REMARK 3 T11: 0.3601 T22: 0.3333 REMARK 3 T33: 0.2816 T12: 0.0779 REMARK 3 T13: -0.0508 T23: 0.0425 REMARK 3 L TENSOR REMARK 3 L11: 0.0141 L22: 0.0095 REMARK 3 L33: 0.0300 L12: -0.0059 REMARK 3 L13: -0.0064 L23: 0.0132 REMARK 3 S TENSOR REMARK 3 S11: 0.0999 S12: 0.0915 S13: -0.0167 REMARK 3 S21: -0.2433 S22: -0.0625 S23: 0.1602 REMARK 3 S31: -0.1857 S32: -0.0217 S33: 0.0001 REMARK 3 TLS GROUP : 9 REMARK 3 SELECTION: (CHAIN A AND RESID 53:56) REMARK 3 ORIGIN FOR THE GROUP (A): 8.8167 12.6528 -3.0156 REMARK 3 T TENSOR REMARK 3 T11: 0.4677 T22: 0.3049 REMARK 3 T33: 0.4312 T12: 0.0096 REMARK 3 T13: -0.1706 T23: -0.0070 REMARK 3 L TENSOR REMARK 3 L11: 0.0037 L22: 0.0206 REMARK 3 L33: 0.0113 L12: -0.0098 REMARK 3 L13: -0.0063 L23: 0.0110 REMARK 3 S TENSOR REMARK 3 S11: 0.2079 S12: 0.1872 S13: -0.1025 REMARK 3 S21: 0.1173 S22: -0.0062 S23: 0.1016 REMARK 3 S31: 0.0706 S32: -0.0812 S33: 0.0001 REMARK 3 TLS GROUP : 10 REMARK 3 SELECTION: (CHAIN A AND RESID 57:61) REMARK 3 ORIGIN FOR THE GROUP (A): 4.1260 7.6904 -2.5273 REMARK 3 T TENSOR REMARK 3 T11: 0.7798 T22: 0.6843 REMARK 3 T33: 0.9737 T12: -0.1291 REMARK 3 T13: -0.0380 T23: 0.0341 REMARK 3 L TENSOR REMARK 3 L11: 0.0036 L22: 0.0122 REMARK 3 L33: 0.0052 L12: 0.0035 REMARK 3 L13: 0.0029 L23: -0.0037 REMARK 3 S TENSOR REMARK 3 S11: -0.1025 S12: -0.0175 S13: -0.0883 REMARK 3 S21: 0.0239 S22: 0.0138 S23: -0.0294 REMARK 3 S31: 0.0604 S32: -0.1447 S33: 0.0000 REMARK 3 TLS GROUP : 11 REMARK 3 SELECTION: (CHAIN B AND RESID 1:5) REMARK 3 ORIGIN FOR THE GROUP (A): 6.5180 34.7578 -11.2167 REMARK 3 T TENSOR REMARK 3 T11: 0.5190 T22: 0.4169 REMARK 3 T33: 0.4931 T12: 0.1482 REMARK 3 T13: -0.0803 T23: 0.1150 REMARK 3 L TENSOR REMARK 3 L11: 0.0395 L22: 0.0588 REMARK 3 L33: 0.0199 L12: 0.0490 REMARK 3 L13: 0.0251 L23: 0.0154 REMARK 3 S TENSOR REMARK 3 S11: 0.0536 S12: 0.4066 S13: -0.0416 REMARK 3 S21: 0.2230 S22: -0.3126 S23: 0.0450 REMARK 3 S31: -0.1630 S32: 0.3569 S33: 0.0002 REMARK 3 TLS GROUP : 12 REMARK 3 SELECTION: (CHAIN B AND RESID 6:11) REMARK 3 ORIGIN FOR THE GROUP (A): 10.3663 15.6961 -13.4554 REMARK 3 T TENSOR REMARK 3 T11: 0.6510 T22: 0.4965 REMARK 3 T33: 0.4075 T12: 0.2290 REMARK 3 T13: -0.2267 T23: -0.1353 REMARK 3 L TENSOR REMARK 3 L11: 0.8714 L22: 1.2149 REMARK 3 L33: 0.8378 L12: 0.6051 REMARK 3 L13: -0.8521 L23: -0.5783 REMARK 3 S TENSOR REMARK 3 S11: 0.4452 S12: 0.1762 S13: -0.3019 REMARK 3 S21: -0.1130 S22: -0.0093 S23: 0.3255 REMARK 3 S31: 0.2580 S32: -0.0513 S33: 0.4434 REMARK 3 TLS GROUP : 13 REMARK 3 SELECTION: (CHAIN B AND RESID 12:15) REMARK 3 ORIGIN FOR THE GROUP (A): 27.3515 8.7437 -9.7201 REMARK 3 T TENSOR REMARK 3 T11: 0.6763 T22: 0.4917 REMARK 3 T33: 0.3993 T12: 0.2085 REMARK 3 T13: 0.0346 T23: 0.0600 REMARK 3 L TENSOR REMARK 3 L11: 0.0075 L22: 0.0273 REMARK 3 L33: 0.0239 L12: 0.0148 REMARK 3 L13: 0.0032 L23: -0.0028 REMARK 3 S TENSOR REMARK 3 S11: 0.3458 S12: 0.3006 S13: -0.0284 REMARK 3 S21: 0.2780 S22: -0.2966 S23: 0.1384 REMARK 3 S31: -0.4057 S32: 0.2197 S33: -0.0004 REMARK 3 TLS GROUP : 14 REMARK 3 SELECTION: (CHAIN C AND RESID 1:7) REMARK 3 ORIGIN FOR THE GROUP (A): 21.5924 5.8472 -8.4403 REMARK 3 T TENSOR REMARK 3 T11: 0.5034 T22: 0.4363 REMARK 3 T33: 0.3705 T12: 0.1552 REMARK 3 T13: -0.0597 T23: -0.0699 REMARK 3 L TENSOR REMARK 3 L11: 0.0781 L22: 0.0172 REMARK 3 L33: 0.0461 L12: -0.0179 REMARK 3 L13: 0.0071 L23: -0.0089 REMARK 3 S TENSOR REMARK 3 S11: 0.1706 S12: 0.3536 S13: 0.0226 REMARK 3 S21: 0.0610 S22: -0.0401 S23: 0.0464 REMARK 3 S31: 0.1723 S32: -0.2098 S33: -0.0000 REMARK 3 TLS GROUP : 15 REMARK 3 SELECTION: (CHAIN C AND RESID 8:11) REMARK 3 ORIGIN FOR THE GROUP (A): 13.8468 21.6942 -17.2384 REMARK 3 T TENSOR REMARK 3 T11: 0.9125 T22: 0.9284 REMARK 3 T33: 0.5205 T12: 0.9671 REMARK 3 T13: -0.1961 T23: 0.4665 REMARK 3 L TENSOR REMARK 3 L11: 0.0545 L22: 0.4064 REMARK 3 L33: 0.1311 L12: -0.1297 REMARK 3 L13: 0.0178 L23: -0.1724 REMARK 3 S TENSOR REMARK 3 S11: -0.2310 S12: 0.3629 S13: 0.4136 REMARK 3 S21: -0.2340 S22: -0.1323 S23: 0.0138 REMARK 3 S31: -0.1920 S32: 0.1081 S33: -0.4102 REMARK 3 TLS GROUP : 16 REMARK 3 SELECTION: (CHAIN C AND RESID 12:15) REMARK 3 ORIGIN FOR THE GROUP (A): 0.8798 27.9153 -11.3182 REMARK 3 T TENSOR REMARK 3 T11: 0.6997 T22: 0.4326 REMARK 3 T33: 0.4676 T12: 0.1393 REMARK 3 T13: -0.1708 T23: -0.0357 REMARK 3 L TENSOR REMARK 3 L11: 0.0278 L22: 0.0307 REMARK 3 L33: 0.0199 L12: 0.0252 REMARK 3 L13: -0.0163 L23: -0.0246 REMARK 3 S TENSOR REMARK 3 S11: 0.5024 S12: 0.1280 S13: -0.0762 REMARK 3 S21: 0.1135 S22: -0.4294 S23: 0.0042 REMARK 3 S31: 0.1348 S32: -0.1076 S33: -0.0000 REMARK 3 TLS GROUP : 17 REMARK 3 SELECTION: (CHAIN D AND RESID 1:10) REMARK 3 ORIGIN FOR THE GROUP (A): 15.4671 30.5294 28.1017 REMARK 3 T TENSOR REMARK 3 T11: 0.7544 T22: 0.4583 REMARK 3 T33: 0.4789 T12: 0.0573 REMARK 3 T13: -0.0064 T23: -0.0890 REMARK 3 L TENSOR REMARK 3 L11: 0.0098 L22: 0.0160 REMARK 3 L33: 0.0110 L12: -0.0098 REMARK 3 L13: 0.0086 L23: 0.0037 REMARK 3 S TENSOR REMARK 3 S11: 0.1096 S12: -0.0014 S13: 0.2076 REMARK 3 S21: 0.0490 S22: -0.0382 S23: -0.0425 REMARK 3 S31: -0.2602 S32: -0.1766 S33: -0.0000 REMARK 3 TLS GROUP : 18 REMARK 3 SELECTION: (CHAIN D AND RESID 11:15) REMARK 3 ORIGIN FOR THE GROUP (A): 12.8312 26.8837 17.8332 REMARK 3 T TENSOR REMARK 3 T11: 0.4094 T22: 0.3222 REMARK 3 T33: 0.2778 T12: 0.1050 REMARK 3 T13: -0.0350 T23: -0.0159 REMARK 3 L TENSOR REMARK 3 L11: 0.0069 L22: 0.0052 REMARK 3 L33: 0.0052 L12: -0.0046 REMARK 3 L13: 0.0034 L23: -0.0007 REMARK 3 S TENSOR REMARK 3 S11: 0.0555 S12: 0.0038 S13: 0.0025 REMARK 3 S21: -0.1912 S22: -0.1320 S23: 0.0888 REMARK 3 S31: -0.1667 S32: 0.0066 S33: 0.0002 REMARK 3 TLS GROUP : 19 REMARK 3 SELECTION: (CHAIN D AND RESID 16:21) REMARK 3 ORIGIN FOR THE GROUP (A): 11.9927 18.0322 18.9632 REMARK 3 T TENSOR REMARK 3 T11: 0.3138 T22: 0.3624 REMARK 3 T33: 0.2982 T12: 0.1107 REMARK 3 T13: 0.0112 T23: -0.0234 REMARK 3 L TENSOR REMARK 3 L11: 0.0162 L22: 0.0069 REMARK 3 L33: 0.0142 L12: -0.0055 REMARK 3 L13: -0.0048 L23: -0.0058 REMARK 3 S TENSOR REMARK 3 S11: 0.0408 S12: 0.0075 S13: -0.0395 REMARK 3 S21: -0.2512 S22: 0.0047 S23: -0.0062 REMARK 3 S31: 0.0620 S32: -0.2051 S33: 0.0003 REMARK 3 TLS GROUP : 20 REMARK 3 SELECTION: (CHAIN D AND RESID 22:25) REMARK 3 ORIGIN FOR THE GROUP (A): 10.1823 11.1436 19.2918 REMARK 3 T TENSOR REMARK 3 T11: 0.3785 T22: 0.3901 REMARK 3 T33: 0.4218 T12: 0.0555 REMARK 3 T13: -0.0129 T23: -0.0983 REMARK 3 L TENSOR REMARK 3 L11: 0.0059 L22: 0.0138 REMARK 3 L33: 0.0140 L12: 0.0096 REMARK 3 L13: -0.0020 L23: -0.0064 REMARK 3 S TENSOR REMARK 3 S11: 0.1877 S12: 0.0292 S13: -0.1216 REMARK 3 S21: 0.0572 S22: 0.0041 S23: 0.0809 REMARK 3 S31: 0.0974 S32: -0.0574 S33: 0.0004 REMARK 3 TLS GROUP : 21 REMARK 3 SELECTION: (CHAIN D AND RESID 26:29) REMARK 3 ORIGIN FOR THE GROUP (A): 20.2182 10.3899 24.9197 REMARK 3 T TENSOR REMARK 3 T11: 0.4379 T22: 0.3937 REMARK 3 T33: 0.3490 T12: 0.1070 REMARK 3 T13: 0.0246 T23: -0.0022 REMARK 3 L TENSOR REMARK 3 L11: 0.0831 L22: 0.0142 REMARK 3 L33: 0.0212 L12: -0.0015 REMARK 3 L13: -0.0208 L23: 0.0180 REMARK 3 S TENSOR REMARK 3 S11: 0.1499 S12: -0.1231 S13: 0.0896 REMARK 3 S21: -0.1614 S22: 0.0402 S23: 0.0936 REMARK 3 S31: 0.1230 S32: 0.0913 S33: 0.0010 REMARK 3 TLS GROUP : 22 REMARK 3 SELECTION: (CHAIN D AND RESID 30:34) REMARK 3 ORIGIN FOR THE GROUP (A): 24.2705 13.2343 20.0024 REMARK 3 T TENSOR REMARK 3 T11: 0.2922 T22: 0.5342 REMARK 3 T33: 0.3031 T12: 0.1447 REMARK 3 T13: 0.0554 T23: 0.0852 REMARK 3 L TENSOR REMARK 3 L11: 0.0035 L22: 0.0100 REMARK 3 L33: 0.0025 L12: -0.0022 REMARK 3 L13: 0.0014 L23: 0.0032 REMARK 3 S TENSOR REMARK 3 S11: -0.0277 S12: 0.0137 S13: -0.0558 REMARK 3 S21: -0.1041 S22: 0.0204 S23: 0.0184 REMARK 3 S31: 0.0113 S32: 0.0515 S33: 0.0001 REMARK 3 TLS GROUP : 23 REMARK 3 SELECTION: (CHAIN D AND RESID 35:39) REMARK 3 ORIGIN FOR THE GROUP (A): 23.8528 21.9391 18.9721 REMARK 3 T TENSOR REMARK 3 T11: 0.3249 T22: 0.4015 REMARK 3 T33: 0.3400 T12: 0.0321 REMARK 3 T13: -0.0164 T23: 0.0427 REMARK 3 L TENSOR REMARK 3 L11: 0.0217 L22: 0.0041 REMARK 3 L33: 0.0061 L12: -0.0049 REMARK 3 L13: 0.0010 L23: 0.0045 REMARK 3 S TENSOR REMARK 3 S11: -0.0994 S12: 0.0388 S13: -0.0827 REMARK 3 S21: -0.0711 S22: -0.0300 S23: 0.0170 REMARK 3 S31: -0.0521 S32: 0.0854 S33: -0.0000 REMARK 3 TLS GROUP : 24 REMARK 3 SELECTION: (CHAIN D AND RESID 40:43) REMARK 3 ORIGIN FOR THE GROUP (A): 23.7760 22.7466 25.0139 REMARK 3 T TENSOR REMARK 3 T11: 0.4244 T22: 0.5524 REMARK 3 T33: 0.3485 T12: -0.0940 REMARK 3 T13: 0.0450 T23: -0.0076 REMARK 3 L TENSOR REMARK 3 L11: 0.0216 L22: 0.0283 REMARK 3 L33: 0.0080 L12: 0.0205 REMARK 3 L13: -0.0006 L23: 0.0048 REMARK 3 S TENSOR REMARK 3 S11: 0.0148 S12: -0.1563 S13: -0.1903 REMARK 3 S21: -0.1860 S22: -0.0249 S23: -0.1465 REMARK 3 S31: -0.1874 S32: 0.1668 S33: 0.0006 REMARK 3 TLS GROUP : 25 REMARK 3 SELECTION: (CHAIN D AND RESID 44:53) REMARK 3 ORIGIN FOR THE GROUP (A): 15.8669 18.2883 29.6494 REMARK 3 T TENSOR REMARK 3 T11: 0.1887 T22: 0.3241 REMARK 3 T33: 0.2434 T12: 0.0764 REMARK 3 T13: -0.0079 T23: -0.0004 REMARK 3 L TENSOR REMARK 3 L11: 0.0204 L22: 0.0344 REMARK 3 L33: 0.0470 L12: 0.0082 REMARK 3 L13: -0.0322 L23: -0.0078 REMARK 3 S TENSOR REMARK 3 S11: -0.0804 S12: 0.0701 S13: 0.0715 REMARK 3 S21: -0.0122 S22: 0.0782 S23: 0.0961 REMARK 3 S31: 0.0436 S32: 0.0480 S33: -0.0001 REMARK 3 TLS GROUP : 26 REMARK 3 SELECTION: (CHAIN D AND RESID 54:57) REMARK 3 ORIGIN FOR THE GROUP (A): 6.6508 13.8808 29.6776 REMARK 3 T TENSOR REMARK 3 T11: 0.2670 T22: 0.4428 REMARK 3 T33: 0.4096 T12: 0.0283 REMARK 3 T13: 0.0379 T23: 0.0417 REMARK 3 L TENSOR REMARK 3 L11: 0.0039 L22: 0.0177 REMARK 3 L33: 0.0162 L12: -0.0047 REMARK 3 L13: 0.0013 L23: 0.0030 REMARK 3 S TENSOR REMARK 3 S11: -0.0681 S12: 0.0326 S13: 0.0720 REMARK 3 S21: 0.1725 S22: -0.0600 S23: 0.0935 REMARK 3 S31: 0.0444 S32: -0.0426 S33: -0.0003 REMARK 3 TLS GROUP : 27 REMARK 3 SELECTION: (CHAIN D AND RESID 58:61) REMARK 3 ORIGIN FOR THE GROUP (A): 0.3090 13.5322 30.4444 REMARK 3 T TENSOR REMARK 3 T11: 0.2811 T22: 0.8853 REMARK 3 T33: 0.5544 T12: -0.0787 REMARK 3 T13: 0.0978 T23: -0.1132 REMARK 3 L TENSOR REMARK 3 L11: 0.0079 L22: 0.0255 REMARK 3 L33: 0.0717 L12: -0.0136 REMARK 3 L13: 0.0225 L23: -0.0429 REMARK 3 S TENSOR REMARK 3 S11: 0.0095 S12: -0.0167 S13: 0.0171 REMARK 3 S21: 0.0032 S22: -0.0875 S23: 0.0065 REMARK 3 S31: 0.0197 S32: -0.0688 S33: -0.0045 REMARK 3 TLS GROUP : 28 REMARK 3 SELECTION: (CHAIN E AND RESID 1:7) REMARK 3 ORIGIN FOR THE GROUP (A): 24.6665 7.8999 37.3251 REMARK 3 T TENSOR REMARK 3 T11: 0.2989 T22: 0.4381 REMARK 3 T33: 0.3001 T12: 0.0655 REMARK 3 T13: -0.0416 T23: 0.0569 REMARK 3 L TENSOR REMARK 3 L11: 0.0348 L22: 0.0035 REMARK 3 L33: 0.0548 L12: 0.0196 REMARK 3 L13: -0.0001 L23: -0.0091 REMARK 3 S TENSOR REMARK 3 S11: -0.1844 S12: 0.2695 S13: -0.1718 REMARK 3 S21: 0.1518 S22: -0.0328 S23: 0.0639 REMARK 3 S31: -0.2720 S32: 0.0938 S33: 0.0004 REMARK 3 TLS GROUP : 29 REMARK 3 SELECTION: (CHAIN E AND RESID 8:11) REMARK 3 ORIGIN FOR THE GROUP (A): 9.2117 18.7811 42.4996 REMARK 3 T TENSOR REMARK 3 T11: 0.5880 T22: 0.6293 REMARK 3 T33: 0.5525 T12: 0.2516 REMARK 3 T13: 0.3491 T23: 0.0531 REMARK 3 L TENSOR REMARK 3 L11: 0.1267 L22: 0.3246 REMARK 3 L33: 0.1734 L12: -0.0158 REMARK 3 L13: 0.1335 L23: -0.1159 REMARK 3 S TENSOR REMARK 3 S11: -0.0810 S12: 0.0225 S13: -0.0295 REMARK 3 S21: 0.2234 S22: -0.0401 S23: 0.1128 REMARK 3 S31: -0.0680 S32: -0.5102 S33: -0.1873 REMARK 3 TLS GROUP : 30 REMARK 3 SELECTION: (CHAIN E AND RESID 12:15) REMARK 3 ORIGIN FOR THE GROUP (A): 8.7851 33.8808 36.2469 REMARK 3 T TENSOR REMARK 3 T11: 0.6369 T22: 0.6525 REMARK 3 T33: 0.5758 T12: 0.2462 REMARK 3 T13: 0.0071 T23: 0.0843 REMARK 3 L TENSOR REMARK 3 L11: 0.0313 L22: 0.0391 REMARK 3 L33: 0.0028 L12: 0.0170 REMARK 3 L13: -0.0083 L23: 0.0037 REMARK 3 S TENSOR REMARK 3 S11: 0.0949 S12: 0.3466 S13: 0.1460 REMARK 3 S21: 0.3483 S22: 0.0092 S23: 0.0268 REMARK 3 S31: -0.3392 S32: 0.2931 S33: 0.0004 REMARK 3 TLS GROUP : 31 REMARK 3 SELECTION: (CHAIN F AND RESID 1:4) REMARK 3 ORIGIN FOR THE GROUP (A): -1.1246 30.9666 36.5066 REMARK 3 T TENSOR REMARK 3 T11: 0.4750 T22: 0.4832 REMARK 3 T33: 0.9172 T12: 0.0682 REMARK 3 T13: 0.0918 T23: -0.1314 REMARK 3 L TENSOR REMARK 3 L11: 0.0357 L22: 0.0077 REMARK 3 L33: 0.0106 L12: -0.0114 REMARK 3 L13: 0.0096 L23: -0.0063 REMARK 3 S TENSOR REMARK 3 S11: 0.0726 S12: 0.0227 S13: -0.2242 REMARK 3 S21: 0.1985 S22: -0.1901 S23: 0.0066 REMARK 3 S31: 0.1907 S32: -0.2274 S33: -0.0004 REMARK 3 TLS GROUP : 32 REMARK 3 SELECTION: (CHAIN F AND RESID 5:8) REMARK 3 ORIGIN FOR THE GROUP (A): 13.4773 24.8650 34.5979 REMARK 3 T TENSOR REMARK 3 T11: 0.4235 T22: 0.4369 REMARK 3 T33: 0.3642 T12: 0.1583 REMARK 3 T13: -0.0221 T23: -0.0855 REMARK 3 L TENSOR REMARK 3 L11: 0.0278 L22: 0.0468 REMARK 3 L33: 0.0305 L12: 0.0187 REMARK 3 L13: -0.0292 L23: -0.0294 REMARK 3 S TENSOR REMARK 3 S11: -0.2376 S12: 0.1416 S13: 0.1012 REMARK 3 S21: 0.3150 S22: 0.1277 S23: 0.0693 REMARK 3 S31: -0.2533 S32: 0.0328 S33: -0.0001 REMARK 3 TLS GROUP : 33 REMARK 3 SELECTION: (CHAIN F AND RESID 9:15) REMARK 3 ORIGIN FOR THE GROUP (A): 19.4752 8.4746 41.4140 REMARK 3 T TENSOR REMARK 3 T11: 0.5864 T22: 0.5925 REMARK 3 T33: 0.5414 T12: 0.1234 REMARK 3 T13: -0.0436 T23: 0.0244 REMARK 3 L TENSOR REMARK 3 L11: 1.5212 L22: 1.4442 REMARK 3 L33: 0.7864 L12: -1.1208 REMARK 3 L13: -1.0421 L23: 0.9091 REMARK 3 S TENSOR REMARK 3 S11: -0.3936 S12: 0.2932 S13: -0.4005 REMARK 3 S21: 0.4314 S22: -0.1524 S23: 0.1507 REMARK 3 S31: -0.3070 S32: -0.3038 S33: -0.0906 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 5JLW COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-APR-16. REMARK 100 THE DEPOSITION ID IS D_1000220807. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 09-DEC-15 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.0 - 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : SEALED TUBE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : BRUKER D8 QUEST REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : MULTILAYER REMARK 200 OPTICS : HELIOS REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : BRUKER PHOTON 100 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : SAINT REMARK 200 DATA SCALING SOFTWARE : PROTEUM PLUS REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 48110 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.088 REMARK 200 RESOLUTION RANGE LOW (A) : 19.300 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.5 REMARK 200 DATA REDUNDANCY : 5.720 REMARK 200 R MERGE (I) : 0.07910 REMARK 200 R SYM (I) : 0.04990 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 11.9900 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.09 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.19 REMARK 200 COMPLETENESS FOR SHELL (%) : 92.1 REMARK 200 DATA REDUNDANCY IN SHELL : 4.28 REMARK 200 R MERGE FOR SHELL (I) : 0.50320 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 1.840 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 4XID REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 61.25 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.17 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20MM BIS-TRIS PROPANE, 10MM NICL2, 4 REMARK 280 -6% 2-METHYL-2,4-PENTANEDIOL, PH 7.0, VAPOR DIFFUSION, SITTING REMARK 280 DROP, TEMPERATURE 292K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 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 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 46.84800 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 46.84800 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 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 300 REMARK: THERE ARE TWO PROTEIN:DNA COMPLEXES IN THE A.U. 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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3500 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 8720 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -41.0 KCAL/MOL 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 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3340 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 8760 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -34.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: D, E, F REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 0 REMARK 465 ARG A 1 REMARK 465 LYS A 2 REMARK 465 ARG A 3 REMARK 465 MET D 0 REMARK 465 ARG D 1 REMARK 465 LYS D 2 REMARK 465 ARG D 3 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 57 CD CE NZ REMARK 470 LYS D 57 CD CE NZ REMARK 470 LYS D 58 NZ 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 HH TYR D 11 O HOH D 101 1.26 REMARK 500 HZ3 LYS A 55 O HOH A 202 1.52 REMARK 500 HE21 GLN D 6 O HOH D 106 1.53 REMARK 500 HH12 ARG A 43 OP2 DT C 7 1.54 REMARK 500 O HOH A 213 O HOH D 141 1.83 REMARK 500 OP2 DT F 3 O HOH F 201 1.86 REMARK 500 OH TYR D 11 O HOH D 101 1.87 REMARK 500 OE1 GLU D 42 O HOH D 102 1.87 REMARK 500 O HOH A 232 O HOH A 236 1.92 REMARK 500 O HOH B 217 O HOH C 124 1.94 REMARK 500 O HOH D 141 O HOH D 148 1.95 REMARK 500 O HOH A 242 O HOH A 247 1.96 REMARK 500 O HOH E 202 O HOH E 226 1.96 REMARK 500 OE1 GLU A 17 O HOH A 201 1.99 REMARK 500 O HOH D 141 O HOH D 151 2.01 REMARK 500 OE1 GLU D 17 O HOH D 103 2.03 REMARK 500 O HOH D 110 O HOH D 144 2.10 REMARK 500 O HOH A 223 O HOH B 220 2.10 REMARK 500 O HOH F 222 O HOH F 226 2.11 REMARK 500 OE1 GLU D 59 O HOH D 104 2.12 REMARK 500 O HOH A 234 O HOH D 145 2.13 REMARK 500 O HOH B 204 O HOH B 224 2.14 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 B 1 O3' DG B 1 C3' -0.050 REMARK 500 DG B 12 O3' DG B 12 C3' -0.044 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 DG B 14 O4' - C1' - N9 ANGL. DEV. = 2.2 DEGREES REMARK 500 DA E 5 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DA E 12 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DT F 5 O4' - C1' - N1 ANGL. DEV. = 2.7 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 NI A 101 NI REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 21 NE2 REMARK 620 2 HIS D 21 NE2 93.0 REMARK 620 3 HOH A 206 O 81.3 85.4 REMARK 620 4 ASN D 60 ND2 155.8 65.3 86.2 REMARK 620 5 HOH D 114 O 93.0 88.2 171.2 96.6 REMARK 620 N 1 2 3 4 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NI B 102 NI REMARK 620 N RES CSSEQI ATOM REMARK 620 1 DG B 12 N7 REMARK 620 2 HOH B 207 O 65.6 REMARK 620 N 1 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NI E 101 NI REMARK 620 N RES CSSEQI ATOM REMARK 620 1 DG E 2 N7 REMARK 620 2 HOH E 205 O 88.2 REMARK 620 3 HOH E 218 O 76.8 164.0 REMARK 620 N 1 2 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NI A 101 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NI B 101 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NI B 102 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NI B 103 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NI E 101 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NI E 102 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MPD F 101 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MPD F 102 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MPD F 103 REMARK 800 REMARK 800 SITE_IDENTIFIER: AD1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for Di-nucleotide DC E 7 and C7R E REMARK 800 8 REMARK 800 REMARK 800 SITE_IDENTIFIER: AD2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for Di-nucleotide C7R E 8 and DA E REMARK 800 9 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 5JLX RELATED DB: PDB DBREF 5JLW A 1 60 UNP P02833 ANTP_DROME 297 356 DBREF 5JLW B 0 14 PDB 5JLW 5JLW 0 14 DBREF 5JLW C 0 14 PDB 5JLW 5JLW 0 14 DBREF 5JLW D 1 60 UNP P02833 ANTP_DROME 297 356 DBREF 5JLW E 1 15 PDB 5JLW 5JLW 1 15 DBREF 5JLW F 1 15 PDB 5JLW 5JLW 1 15 SEQADV 5JLW MET A 0 UNP P02833 EXPRESSION TAG SEQADV 5JLW SER A 39 UNP P02833 CYS 335 ENGINEERED MUTATION SEQADV 5JLW MET D 0 UNP P02833 EXPRESSION TAG SEQADV 5JLW SER D 39 UNP P02833 CYS 335 ENGINEERED MUTATION SEQRES 1 A 61 MET ARG LYS ARG GLY ARG GLN THR TYR THR ARG TYR GLN SEQRES 2 A 61 THR LEU GLU LEU GLU LYS GLU PHE HIS PHE ASN ARG TYR SEQRES 3 A 61 LEU THR ARG ARG ARG ARG ILE GLU ILE ALA HIS ALA LEU SEQRES 4 A 61 SER LEU THR GLU ARG GLN ILE LYS ILE TRP PHE GLN ASN SEQRES 5 A 61 ARG ARG MET LYS TRP LYS LYS GLU ASN SEQRES 1 B 15 DA DG DA DA DA DG DC C7R DA DT DT DA DG SEQRES 2 B 15 DA DG SEQRES 1 C 15 DT DC DT DC DT DA DA DT DG DG DC DT DT SEQRES 2 C 15 DT DC SEQRES 1 D 61 MET ARG LYS ARG GLY ARG GLN THR TYR THR ARG TYR GLN SEQRES 2 D 61 THR LEU GLU LEU GLU LYS GLU PHE HIS PHE ASN ARG TYR SEQRES 3 D 61 LEU THR ARG ARG ARG ARG ILE GLU ILE ALA HIS ALA LEU SEQRES 4 D 61 SER LEU THR GLU ARG GLN ILE LYS ILE TRP PHE GLN ASN SEQRES 5 D 61 ARG ARG MET LYS TRP LYS LYS GLU ASN SEQRES 1 E 15 DA DG DA DA DA DG DC C7R DA DT DT DA DG SEQRES 2 E 15 DA DG SEQRES 1 F 15 DT DC DT DC DT DA DA DT DG DG DC DT DT SEQRES 2 F 15 DT DC HET C7R B 7 30 HET C7R E 8 30 HET NI A 101 1 HET NI B 101 1 HET NI B 102 1 HET NI B 103 1 HET NI E 101 1 HET NI E 102 1 HET MPD F 101 22 HET MPD F 102 22 HET MPD F 103 22 HETNAM C7R 2'-DEOXY-5'-O-THIOPHOSPHONOCYTIDINE HETNAM NI NICKEL (II) ION HETNAM MPD (4S)-2-METHYL-2,4-PENTANEDIOL HETSYN C7R 2'-DEOXY-5'-O-THIOPHOSPHONOCYTIDINE (THIOPHOSPHO HETSYN 2 C7R CONNECTION ISOFORM 1) FORMUL 2 C7R 2(C9 H14 N3 O6 P S) FORMUL 7 NI 6(NI 2+) FORMUL 13 MPD 3(C6 H14 O2) FORMUL 16 HOH *212(H2 O) HELIX 1 AA1 THR A 9 ASN A 23 1 15 HELIX 2 AA2 THR A 27 SER A 39 1 13 HELIX 3 AA3 THR A 41 LYS A 58 1 18 HELIX 4 AA4 THR D 9 ASN D 23 1 15 HELIX 5 AA5 THR D 27 SER D 39 1 13 HELIX 6 AA6 THR D 41 ASN D 60 1 20 LINK NE2 HIS A 21 NI NI A 101 1555 1555 2.15 LINK N7 DG B 1 NI NI B 101 1555 1555 2.54 LINK O3' DC B 6 P C7R B 7 1555 1555 1.60 LINK O3' C7R B 7 P DA B 8 1555 1555 1.61 LINK N7 DG B 12 NI NI B 102 1555 1555 2.67 LINK NE2 HIS D 21 NI NI A 101 1555 1555 2.17 LINK N7 DG E 2 NI NI E 101 1555 1555 2.35 LINK O3' DC E 7 P C7R E 8 1555 1555 1.58 LINK O3' C7R E 8 P DA E 9 1555 1555 1.60 LINK NI NI A 101 O HOH A 206 1555 1555 1.82 LINK NI NI B 102 O HOH B 207 1555 1555 2.08 LINK NI NI E 101 O HOH E 205 1555 1555 2.21 LINK NI NI E 101 O HOH E 218 1555 1555 2.20 LINK ND2 ASN D 60 NI NI A 101 1555 3555 2.40 LINK NI NI A 101 O HOH D 114 1555 3555 2.24 SITE 1 AC1 5 HIS A 21 HOH A 206 HIS D 21 ASN D 60 SITE 2 AC1 5 HOH D 114 SITE 1 AC2 2 DG B 1 HOH C 122 SITE 1 AC3 2 DG B 12 HOH B 207 SITE 1 AC4 3 DA B 3 DA B 4 DT C 13 SITE 1 AC5 3 DG E 2 HOH E 205 HOH E 218 SITE 1 AC6 1 DG E 13 SITE 1 AC7 2 DT F 13 MPD F 102 SITE 1 AC8 3 DT F 13 MPD F 101 MPD F 103 SITE 1 AC9 2 DT F 14 MPD F 102 SITE 1 AD1 8 TYR D 25 GLN D 50 ARG D 53 MET D 54 SITE 2 AD1 8 DG E 6 DA E 9 DG F 9 DG F 10 SITE 1 AD2 7 MET D 54 DC E 7 DT E 10 DA F 7 SITE 2 AD2 7 DT F 8 DG F 9 DG F 10 CRYST1 61.266 75.888 93.696 90.00 90.00 90.00 P 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 0.016322 0.000000 0.000000 0.00000 SCALE2 0.000000 0.013177 0.000000 0.00000 SCALE3 0.000000 0.000000 0.010673 0.00000 ATOM 1 N GLY A 4 28.998 17.633 -11.090 1.00 62.79 N ANISOU 1 N GLY A 4 7032 9586 7241 870 537 79 N ATOM 2 CA GLY A 4 29.135 17.776 -9.648 1.00 61.39 C ANISOU 2 CA GLY A 4 6954 9286 7087 855 501 40 C ATOM 3 C GLY A 4 27.947 17.216 -8.884 1.00 58.35 C ANISOU 3 C GLY A 4 6691 8822 6660 846 474 78 C ATOM 4 O GLY A 4 26.797 17.543 -9.185 1.00 58.83 O ANISOU 4 O GLY A 4 6759 8888 6706 824 547 182 O ATOM 5 HA2 GLY A 4 29.935 17.313 -9.353 1.00 73.67 H ATOM 6 HA3 GLY A 4 29.226 18.716 -9.426 1.00 73.67 H ATOM 7 N ARG A 5 28.216 16.358 -7.898 1.00 53.70 N ANISOU 7 N ARG A 5 6196 8157 6048 864 369 -6 N ATOM 8 CA ARG A 5 27.156 15.726 -7.116 1.00 48.52 C ANISOU 8 CA ARG A 5 5661 7423 5351 859 333 20 C ATOM 9 C ARG A 5 27.631 15.572 -5.683 1.00 46.09 C ANISOU 9 C ARG A 5 5451 7002 5060 859 263 -55 C ATOM 10 O ARG A 5 28.642 14.911 -5.426 1.00 44.07 O ANISOU 10 O ARG A 5 5201 6744 4801 889 170 -164 O ATOM 11 CB ARG A 5 26.757 14.366 -7.692 1.00 46.93 C ANISOU 11 CB ARG A 5 5479 7273 5079 893 256 -2 C ATOM 12 CG ARG A 5 25.693 13.634 -6.869 1.00 44.76 C ANISOU 12 CG ARG A 5 5330 6916 4759 890 211 19 C ATOM 13 CD ARG A 5 25.632 12.155 -7.210 1.00 42.76 C ANISOU 13 CD ARG A 5 5106 6701 4441 930 106 -39 C ATOM 14 NE ARG A 5 24.685 11.453 -6.338 1.00 41.48 N ANISOU 14 NE ARG A 5 5068 6454 4239 927 58 -25 N ATOM 15 CZ ARG A 5 23.445 11.103 -6.674 1.00 40.27 C ANISOU 15 CZ ARG A 5 4946 6312 4044 921 81 54 C ATOM 16 NH1 ARG A 5 22.953 11.361 -7.888 1.00 41.26 N ANISOU 16 NH1 ARG A 5 4988 6532 4158 916 151 130 N ATOM 17 NH2 ARG A 5 22.687 10.493 -5.790 1.00 38.92 N ANISOU 17 NH2 ARG A 5 4890 6057 3841 919 34 59 N ATOM 18 H ARG A 5 29.009 16.125 -7.662 1.00 64.43 H ATOM 19 HA ARG A 5 26.373 16.298 -7.118 1.00 58.22 H ATOM 20 HB2 ARG A 5 26.403 14.496 -8.585 1.00 56.32 H ATOM 21 HB3 ARG A 5 27.544 13.800 -7.729 1.00 56.32 H ATOM 22 HG2 ARG A 5 25.905 13.719 -5.926 1.00 53.71 H ATOM 23 HG3 ARG A 5 24.824 14.023 -7.054 1.00 53.71 H ATOM 24 HD2 ARG A 5 25.339 12.048 -8.128 1.00 51.31 H ATOM 25 HD3 ARG A 5 26.509 11.760 -7.088 1.00 51.31 H ATOM 26 HE ARG A 5 24.952 11.251 -5.546 1.00 49.78 H ATOM 27 HH11 ARG A 5 23.438 11.765 -8.472 1.00 49.52 H ATOM 28 HH12 ARG A 5 22.150 11.124 -8.085 1.00 49.52 H ATOM 29 HH21 ARG A 5 22.995 10.318 -5.006 1.00 46.70 H ATOM 30 HH22 ARG A 5 21.887 10.256 -6.000 1.00 46.70 H ATOM 31 N GLN A 6 26.895 16.185 -4.763 1.00 44.72 N ANISOU 31 N GLN A 6 5353 6734 4904 826 309 3 N ATOM 32 CA GLN A 6 27.175 16.093 -3.337 1.00 46.02 C ANISOU 32 CA GLN A 6 5620 6783 5084 822 251 -56 C ATOM 33 C GLN A 6 26.367 14.947 -2.732 1.00 45.11 C ANISOU 33 C GLN A 6 5620 6612 4908 836 172 -66 C ATOM 34 O GLN A 6 25.163 14.818 -2.993 1.00 47.46 O ANISOU 34 O GLN A 6 5945 6914 5173 824 211 20 O ATOM 35 CB GLN A 6 26.821 17.412 -2.647 1.00 45.49 C ANISOU 35 CB GLN A 6 5572 6643 5070 779 346 14 C ATOM 36 CG GLN A 6 27.006 17.387 -1.144 1.00 46.05 C ANISOU 36 CG GLN A 6 5753 6590 5156 772 294 -37 C ATOM 37 CD GLN A 6 26.791 18.746 -0.488 1.00 46.41 C ANISOU 37 CD GLN A 6 5809 6566 5258 730 388 25 C ATOM 38 OE1 GLN A 6 26.472 19.737 -1.152 1.00 44.29 O ANISOU 38 OE1 GLN A 6 5466 6342 5019 705 495 110 O ATOM 39 NE2 GLN A 6 26.947 18.786 0.838 1.00 48.07 N ANISOU 39 NE2 GLN A 6 6115 6667 5485 724 347 -17 N ATOM 40 H GLN A 6 26.211 16.673 -4.946 1.00 53.66 H ATOM 41 HA GLN A 6 28.118 15.914 -3.201 1.00 55.23 H ATOM 42 HB2 GLN A 6 27.389 18.112 -3.004 1.00 54.59 H ATOM 43 HB3 GLN A 6 25.891 17.619 -2.828 1.00 54.59 H ATOM 44 HG2 GLN A 6 26.368 16.766 -0.759 1.00 55.27 H ATOM 45 HG3 GLN A 6 27.910 17.099 -0.943 1.00 55.27 H ATOM 46 HE21 GLN A 6 27.157 18.071 1.269 1.00 57.69 H ATOM 47 HE22 GLN A 6 26.838 19.526 1.262 1.00 57.69 H ATOM 48 N THR A 7 27.027 14.116 -1.934 1.00 42.76 N ANISOU 48 N THR A 7 5388 6262 4597 862 62 -171 N ATOM 49 CA THR A 7 26.339 13.099 -1.148 1.00 38.21 C ANISOU 49 CA THR A 7 4931 5615 3971 873 -16 -188 C ATOM 50 C THR A 7 25.950 13.694 0.202 1.00 33.97 C ANISOU 50 C THR A 7 4492 4955 3461 844 5 -164 C ATOM 51 O THR A 7 26.782 14.265 0.905 1.00 33.85 O ANISOU 51 O THR A 7 4480 4889 3492 837 1 -214 O ATOM 52 CB THR A 7 27.218 11.864 -0.943 1.00 39.05 C ANISOU 52 CB THR A 7 5064 5725 4046 916 -148 -313 C ATOM 53 OG1 THR A 7 27.599 11.316 -2.219 1.00 40.64 O ANISOU 53 OG1 THR A 7 5174 6044 4223 943 -167 -335 O ATOM 54 CG2 THR A 7 26.457 10.792 -0.101 1.00 37.38 C ANISOU 54 CG2 THR A 7 4981 5437 3782 927 -229 -327 C ATOM 55 H THR A 7 27.881 14.120 -1.830 1.00 51.32 H ATOM 56 HA THR A 7 25.529 12.827 -1.608 1.00 45.85 H ATOM 57 HB THR A 7 28.016 12.119 -0.455 1.00 46.85 H ATOM 58 HG1 THR A 7 28.081 10.638 -2.108 1.00 48.77 H ATOM 59 HG21 THR A 7 27.018 10.012 0.026 1.00 44.85 H ATOM 60 HG22 THR A 7 26.223 11.158 0.767 1.00 44.85 H ATOM 61 HG23 THR A 7 25.645 10.526 -0.560 1.00 44.85 H ATOM 62 N TYR A 8 24.691 13.558 0.566 1.00 33.24 N ANISOU 62 N TYR A 8 4477 4813 3340 828 28 -89 N ATOM 63 CA TYR A 8 24.253 14.085 1.841 1.00 33.07 C ANISOU 63 CA TYR A 8 4550 4674 3340 801 48 -63 C ATOM 64 C TYR A 8 24.584 13.078 2.939 1.00 33.04 C ANISOU 64 C TYR A 8 4654 4590 3311 825 -73 -159 C ATOM 65 O TYR A 8 24.537 11.864 2.724 1.00 32.98 O ANISOU 65 O TYR A 8 4673 4607 3252 856 -159 -206 O ATOM 66 CB TYR A 8 22.761 14.397 1.797 1.00 32.66 C ANISOU 66 CB TYR A 8 4538 4602 3270 773 125 60 C ATOM 67 CG TYR A 8 22.356 15.437 0.754 1.00 33.26 C ANISOU 67 CG TYR A 8 4513 4753 3372 746 249 161 C ATOM 68 CD1 TYR A 8 23.285 16.291 0.175 1.00 34.55 C ANISOU 68 CD1 TYR A 8 4569 4973 3584 741 299 147 C ATOM 69 CD2 TYR A 8 21.038 15.557 0.355 1.00 33.73 C ANISOU 69 CD2 TYR A 8 4585 4826 3406 727 315 271 C ATOM 70 CE1 TYR A 8 22.896 17.243 -0.776 1.00 35.01 C ANISOU 70 CE1 TYR A 8 4536 5100 3667 717 414 242 C ATOM 71 CE2 TYR A 8 20.640 16.505 -0.588 1.00 33.01 C ANISOU 71 CE2 TYR A 8 4403 4801 3337 703 429 366 C ATOM 72 CZ TYR A 8 21.576 17.340 -1.151 1.00 33.19 C ANISOU 72 CZ TYR A 8 4321 4881 3409 698 477 350 C ATOM 73 OH TYR A 8 21.198 18.271 -2.093 1.00 32.66 O ANISOU 73 OH TYR A 8 4163 4881 3365 675 590 443 O ATOM 74 H TYR A 8 24.079 13.172 0.102 1.00 39.89 H ATOM 75 HA TYR A 8 24.730 14.908 2.029 1.00 39.68 H ATOM 76 HB2 TYR A 8 22.280 13.578 1.597 1.00 39.20 H ATOM 77 HB3 TYR A 8 22.489 14.731 2.666 1.00 39.20 H ATOM 78 HD1 TYR A 8 24.179 16.232 0.425 1.00 41.45 H ATOM 79 HD2 TYR A 8 20.398 14.998 0.732 1.00 40.48 H ATOM 80 HE1 TYR A 8 23.531 17.807 -1.156 1.00 42.01 H ATOM 81 HE2 TYR A 8 19.747 16.565 -0.842 1.00 39.61 H ATOM 82 HH TYR A 8 21.869 18.707 -2.351 1.00 39.19 H ATOM 83 N THR A 9 24.965 13.594 4.103 1.00 33.11 N ANISOU 83 N THR A 9 4720 4503 3357 811 -79 -191 N ATOM 84 CA THR A 9 25.315 12.744 5.226 1.00 33.10 C ANISOU 84 CA THR A 9 4822 4419 3337 832 -189 -281 C ATOM 85 C THR A 9 24.060 12.097 5.796 1.00 32.69 C ANISOU 85 C THR A 9 4880 4304 3236 829 -211 -233 C ATOM 86 O THR A 9 22.927 12.496 5.507 1.00 32.40 O ANISOU 86 O THR A 9 4848 4273 3191 805 -132 -126 O ATOM 87 CB THR A 9 26.008 13.550 6.323 1.00 33.28 C ANISOU 87 CB THR A 9 4877 4355 3414 816 -182 -320 C ATOM 88 OG1 THR A 9 25.124 14.608 6.736 1.00 33.07 O ANISOU 88 OG1 THR A 9 4877 4273 3414 775 -81 -218 O ATOM 89 CG2 THR A 9 27.310 14.143 5.807 1.00 33.71 C ANISOU 89 CG2 THR A 9 4825 4468 3517 821 -168 -375 C ATOM 90 H THR A 9 25.029 14.436 4.265 1.00 39.73 H ATOM 91 HA THR A 9 25.917 12.044 4.929 1.00 39.72 H ATOM 92 HB THR A 9 26.205 12.974 7.078 1.00 39.94 H ATOM 93 HG1 THR A 9 25.485 15.065 7.340 1.00 39.68 H ATOM 94 HG21 THR A 9 27.744 14.652 6.509 1.00 40.46 H ATOM 95 HG22 THR A 9 27.906 13.433 5.519 1.00 40.46 H ATOM 96 HG23 THR A 9 27.132 14.729 5.055 1.00 40.46 H ATOM 97 N ARG A 10 24.293 11.066 6.593 1.00 32.66 N ANISOU 97 N ARG A 10 4964 4244 3201 855 -321 -315 N ATOM 98 CA ARG A 10 23.254 10.482 7.436 1.00 32.29 C ANISOU 98 CA ARG A 10 5039 4115 3116 851 -353 -285 C ATOM 99 C ARG A 10 22.464 11.563 8.159 1.00 32.09 C ANISOU 99 C ARG A 10 5060 4010 3122 811 -262 -195 C ATOM 100 O ARG A 10 21.230 11.549 8.194 1.00 31.74 O ANISOU 100 O ARG A 10 5063 3945 3053 794 -220 -106 O ATOM 101 CB ARG A 10 23.922 9.566 8.466 1.00 32.38 C ANISOU 101 CB ARG A 10 5136 4056 3111 880 -475 -398 C ATOM 102 CG ARG A 10 23.207 8.321 8.790 1.00 35.95 C ANISOU 102 CG ARG A 10 5680 4479 3502 900 -555 -409 C ATOM 103 CD ARG A 10 24.128 7.414 9.671 1.00 39.98 C ANISOU 103 CD ARG A 10 6255 4934 4000 932 -681 -537 C ATOM 104 NE ARG A 10 24.820 6.400 8.877 1.00 43.53 N ANISOU 104 NE ARG A 10 6654 5468 4420 970 -762 -615 N ATOM 105 CZ ARG A 10 25.897 5.725 9.266 1.00 45.99 C ANISOU 105 CZ ARG A 10 6979 5767 4728 1001 -862 -732 C ATOM 106 NH1 ARG A 10 26.422 4.817 8.453 1.00 47.75 N ANISOU 106 NH1 ARG A 10 7153 6071 4921 1034 -928 -793 N ATOM 107 NH2 ARG A 10 26.452 5.943 10.454 1.00 46.15 N ANISOU 107 NH2 ARG A 10 7063 5695 4775 998 -898 -790 N ATOM 108 H ARG A 10 25.056 10.677 6.666 1.00 39.19 H ATOM 109 HA ARG A 10 22.646 9.955 6.895 1.00 38.75 H ATOM 110 HB2 ARG A 10 24.797 9.317 8.130 1.00 38.86 H ATOM 111 HB3 ARG A 10 24.025 10.062 9.293 1.00 38.86 H ATOM 112 HG2 ARG A 10 22.402 8.526 9.290 1.00 43.14 H ATOM 113 HG3 ARG A 10 22.992 7.845 7.972 1.00 43.14 H ATOM 114 HD2 ARG A 10 24.797 7.966 10.105 1.00 47.97 H ATOM 115 HD3 ARG A 10 23.587 6.960 10.336 1.00 47.97 H ATOM 116 HE ARG A 10 24.505 6.227 8.095 1.00 52.24 H ATOM 117 HH11 ARG A 10 26.069 4.674 7.682 1.00 57.31 H ATOM 118 HH12 ARG A 10 27.123 4.379 8.692 1.00 57.31 H ATOM 119 HH21 ARG A 10 26.114 6.527 10.986 1.00 55.38 H ATOM 120 HH22 ARG A 10 27.150 5.499 10.690 1.00 55.38 H ATOM 121 N TYR A 11 23.183 12.480 8.793 1.00 32.30 N ANISOU 121 N TYR A 11 5080 3990 3204 795 -234 -221 N ATOM 122 CA TYR A 11 22.547 13.505 9.595 1.00 32.14 C ANISOU 122 CA TYR A 11 5110 3886 3216 757 -156 -147 C ATOM 123 C TYR A 11 21.684 14.424 8.734 1.00 31.99 C ANISOU 123 C TYR A 11 5024 3920 3211 726 -30 -23 C ATOM 124 O TYR A 11 20.550 14.729 9.109 1.00 31.67 O ANISOU 124 O TYR A 11 5042 3829 3162 702 23 65 O ATOM 125 CB TYR A 11 23.618 14.276 10.351 1.00 32.45 C ANISOU 125 CB TYR A 11 5143 3873 3313 750 -156 -209 C ATOM 126 CG TYR A 11 23.068 15.415 11.151 1.00 32.32 C ANISOU 126 CG TYR A 11 5170 3774 3335 711 -72 -137 C ATOM 127 CD1 TYR A 11 22.328 15.199 12.315 1.00 32.05 C ANISOU 127 CD1 TYR A 11 5260 3634 3283 703 -95 -120 C ATOM 128 CD2 TYR A 11 23.262 16.715 10.723 1.00 32.55 C ANISOU 128 CD2 TYR A 11 5117 3833 3419 682 33 -83 C ATOM 129 CE1 TYR A 11 21.814 16.270 13.029 1.00 33.82 C ANISOU 129 CE1 TYR A 11 5522 3784 3544 668 -14 -52 C ATOM 130 CE2 TYR A 11 22.774 17.772 11.426 1.00 33.21 C ANISOU 130 CE2 TYR A 11 5237 3843 3539 647 111 -18 C ATOM 131 CZ TYR A 11 22.045 17.557 12.564 1.00 35.24 C ANISOU 131 CZ TYR A 11 5616 3997 3778 640 88 -1 C ATOM 132 OH TYR A 11 21.580 18.658 13.218 1.00 37.73 O ANISOU 132 OH TYR A 11 5962 4243 4132 605 171 66 O ATOM 133 H TYR A 11 24.041 12.528 8.773 1.00 38.77 H ATOM 134 HA TYR A 11 21.970 13.080 10.248 1.00 38.57 H ATOM 135 HB2 TYR A 11 24.068 13.672 10.962 1.00 38.94 H ATOM 136 HB3 TYR A 11 24.254 14.637 9.714 1.00 38.94 H ATOM 137 HD1 TYR A 11 22.178 14.331 12.613 1.00 38.46 H ATOM 138 HD2 TYR A 11 23.753 16.871 9.949 1.00 39.06 H ATOM 139 HE1 TYR A 11 21.326 16.128 13.808 1.00 40.58 H ATOM 140 HE2 TYR A 11 22.917 18.640 11.123 1.00 39.86 H ATOM 141 HH TYR A 11 21.806 19.354 12.805 1.00 45.28 H ATOM 142 N GLN A 12 22.177 14.837 7.560 1.00 32.21 N ANISOU 142 N GLN A 12 4930 4050 3258 727 17 -13 N ATOM 143 CA GLN A 12 21.392 15.747 6.726 1.00 32.08 C ANISOU 143 CA GLN A 12 4846 4085 3257 697 138 104 C ATOM 144 C GLN A 12 20.125 15.064 6.247 1.00 31.71 C ANISOU 144 C GLN A 12 4831 4065 3154 699 144 177 C ATOM 145 O GLN A 12 19.027 15.624 6.344 1.00 31.43 O ANISOU 145 O GLN A 12 4822 4001 3119 669 223 281 O ATOM 146 CB GLN A 12 22.216 16.244 5.540 1.00 32.40 C ANISOU 146 CB GLN A 12 4749 4234 3326 700 181 95 C ATOM 147 CG GLN A 12 23.359 17.147 5.943 1.00 32.75 C ANISOU 147 CG GLN A 12 4753 4255 3434 691 199 43 C ATOM 148 CD GLN A 12 24.341 17.393 4.821 1.00 33.10 C ANISOU 148 CD GLN A 12 4668 4406 3502 703 215 10 C ATOM 149 OE1 GLN A 12 24.691 16.481 4.076 1.00 33.19 O ANISOU 149 OE1 GLN A 12 4640 4492 3479 734 154 -39 O ATOM 150 NE2 GLN A 12 24.803 18.631 4.702 1.00 33.31 N ANISOU 150 NE2 GLN A 12 4626 4441 3589 678 297 36 N ATOM 151 H GLN A 12 22.940 14.611 7.234 1.00 38.65 H ATOM 152 HA GLN A 12 21.136 16.517 7.256 1.00 38.49 H ATOM 153 HB2 GLN A 12 22.590 15.480 5.075 1.00 38.88 H ATOM 154 HB3 GLN A 12 21.637 16.744 4.943 1.00 38.88 H ATOM 155 HG2 GLN A 12 23.000 18.005 6.220 1.00 39.30 H ATOM 156 HG3 GLN A 12 23.841 16.737 6.678 1.00 39.30 H ATOM 157 HE21 GLN A 12 24.542 19.242 5.248 1.00 39.97 H ATOM 158 HE22 GLN A 12 25.364 18.822 4.079 1.00 39.97 H ATOM 159 N THR A 13 20.260 13.819 5.771 1.00 26.09 N ANISOU 159 N THR A 13 3288 3406 3220 820 78 -171 N ATOM 160 CA THR A 13 19.108 13.080 5.261 1.00 26.09 C ANISOU 160 CA THR A 13 3280 3372 3261 830 25 -87 C ATOM 161 C THR A 13 18.091 12.822 6.361 1.00 26.32 C ANISOU 161 C THR A 13 3318 3387 3294 803 35 -12 C ATOM 162 O THR A 13 16.880 12.973 6.149 1.00 26.32 O ANISOU 162 O THR A 13 3310 3361 3328 800 64 65 O ATOM 163 CB THR A 13 19.589 11.772 4.619 1.00 27.40 C ANISOU 163 CB THR A 13 3446 3533 3431 857 -106 -104 C ATOM 164 OG1 THR A 13 20.310 12.087 3.419 1.00 27.03 O ANISOU 164 OG1 THR A 13 3388 3495 3389 884 -107 -161 O ATOM 165 CG2 THR A 13 18.410 10.842 4.280 1.00 29.89 C ANISOU 165 CG2 THR A 13 3757 3816 3786 865 -173 -15 C ATOM 166 H THR A 13 21.003 13.387 5.734 1.00 31.31 H ATOM 167 HA THR A 13 18.675 13.609 4.572 1.00 31.31 H ATOM 168 HB THR A 13 20.177 11.308 5.235 1.00 32.88 H ATOM 169 HG1 THR A 13 20.581 11.382 3.054 1.00 32.44 H ATOM 170 HG21 THR A 13 18.739 10.023 3.877 1.00 35.87 H ATOM 171 HG22 THR A 13 17.920 10.620 5.088 1.00 35.87 H ATOM 172 HG23 THR A 13 17.809 11.281 3.658 1.00 35.87 H ATOM 173 N LEU A 14 18.562 12.448 7.551 1.00 26.85 N ANISOU 173 N LEU A 14 3403 3471 3326 784 13 -31 N ATOM 174 CA LEU A 14 17.655 12.205 8.668 1.00 28.27 C ANISOU 174 CA LEU A 14 3593 3639 3507 757 23 37 C ATOM 175 C LEU A 14 16.915 13.483 9.096 1.00 27.36 C ANISOU 175 C LEU A 14 3475 3521 3399 733 152 69 C ATOM 176 O LEU A 14 15.709 13.446 9.354 1.00 27.91 O ANISOU 176 O LEU A 14 3543 3568 3495 721 172 151 O ATOM 177 CB LEU A 14 18.422 11.627 9.848 1.00 29.90 C ANISOU 177 CB LEU A 14 3820 3867 3672 741 -22 0 C ATOM 178 CG LEU A 14 17.625 11.166 11.072 1.00 32.29 C ANISOU 178 CG LEU A 14 4136 4161 3972 714 -32 65 C ATOM 179 CD1 LEU A 14 16.570 10.147 10.738 1.00 32.90 C ANISOU 179 CD1 LEU A 14 4209 4206 4085 723 -108 147 C ATOM 180 CD2 LEU A 14 18.573 10.551 12.084 1.00 33.71 C ANISOU 180 CD2 LEU A 14 4334 4364 4108 702 -86 17 C ATOM 181 H LEU A 14 19.393 12.329 7.734 1.00 32.22 H ATOM 182 HA LEU A 14 16.990 11.553 8.397 1.00 33.92 H ATOM 183 HB2 LEU A 14 18.921 10.858 9.530 1.00 35.87 H ATOM 184 HB3 LEU A 14 19.046 12.303 10.156 1.00 35.87 H ATOM 185 HG LEU A 14 17.193 11.932 11.483 1.00 38.75 H ATOM 186 HD11 LEU A 14 16.103 9.897 11.551 1.00 39.48 H ATOM 187 HD12 LEU A 14 15.946 10.535 10.104 1.00 39.48 H ATOM 188 HD13 LEU A 14 16.996 9.368 10.348 1.00 39.48 H ATOM 189 HD21 LEU A 14 18.064 10.261 12.857 1.00 40.45 H ATOM 190 HD22 LEU A 14 19.019 9.791 11.677 1.00 40.45 H ATOM 191 HD23 LEU A 14 19.227 11.216 12.349 1.00 40.45 H ATOM 192 N GLU A 15 17.625 14.611 9.208 1.00 26.69 N ANISOU 192 N GLU A 15 3389 3460 3291 725 241 7 N ATOM 193 CA GLU A 15 16.956 15.863 9.569 1.00 27.76 C ANISOU 193 CA GLU A 15 3521 3593 3433 704 366 35 C ATOM 194 C GLU A 15 15.886 16.244 8.546 1.00 26.56 C ANISOU 194 C GLU A 15 3350 3412 3328 717 401 96 C ATOM 195 O GLU A 15 14.789 16.676 8.925 1.00 26.64 O ANISOU 195 O GLU A 15 3358 3405 3357 699 462 163 O ATOM 196 CB GLU A 15 17.972 16.992 9.717 1.00 31.85 C ANISOU 196 CB GLU A 15 4041 4141 3920 697 450 -47 C ATOM 197 CG GLU A 15 18.830 16.913 11.015 1.00 41.05 C ANISOU 197 CG GLU A 15 5226 5334 5036 674 449 -96 C ATOM 198 CD GLU A 15 18.026 17.055 12.327 1.00 49.02 C ANISOU 198 CD GLU A 15 6248 6339 6040 640 494 -39 C ATOM 199 OE1 GLU A 15 17.409 16.069 12.776 1.00 51.97 O ANISOU 199 OE1 GLU A 15 6628 6696 6422 635 425 17 O ATOM 200 OE2 GLU A 15 18.012 18.160 12.921 1.00 51.98 O ANISOU 200 OE2 GLU A 15 6626 6725 6400 618 600 -52 O ATOM 201 H GLU A 15 18.474 14.677 9.084 1.00 32.02 H ATOM 202 HA GLU A 15 16.518 15.746 10.426 1.00 33.31 H ATOM 203 HB2 GLU A 15 18.579 16.966 8.961 1.00 38.22 H ATOM 204 HB3 GLU A 15 17.498 17.838 9.728 1.00 38.22 H ATOM 205 HG2 GLU A 15 19.280 16.054 11.037 1.00 49.26 H ATOM 206 HG3 GLU A 15 19.488 17.625 10.995 1.00 49.26 H ATOM 207 N LEU A 16 16.174 16.040 7.248 1.00 26.35 N ANISOU 207 N LEU A 16 3310 3380 3321 747 359 74 N ATOM 208 CA LEU A 16 15.215 16.355 6.197 1.00 26.20 C ANISOU 208 CA LEU A 16 3273 3335 3347 762 386 128 C ATOM 209 C LEU A 16 14.039 15.392 6.233 1.00 26.38 C ANISOU 209 C LEU A 16 3295 3327 3402 762 322 219 C ATOM 210 O LEU A 16 12.889 15.818 6.099 1.00 26.36 O ANISOU 210 O LEU A 16 3284 3303 3430 755 375 289 O ATOM 211 CB LEU A 16 15.898 16.325 4.824 1.00 25.96 C ANISOU 211 CB LEU A 16 3230 3308 3327 795 352 77 C ATOM 212 CG LEU A 16 16.902 17.444 4.521 1.00 25.82 C ANISOU 212 CG LEU A 16 3208 3316 3286 798 429 -7 C ATOM 213 CD1 LEU A 16 17.781 17.083 3.353 1.00 25.62 C ANISOU 213 CD1 LEU A 16 3174 3297 3263 830 366 -65 C ATOM 214 CD2 LEU A 16 16.224 18.699 4.184 1.00 25.72 C ANISOU 214 CD2 LEU A 16 3183 3295 3296 791 544 19 C ATOM 215 H LEU A 16 16.919 15.721 6.959 1.00 31.62 H ATOM 216 HA LEU A 16 14.873 17.251 6.341 1.00 31.44 H ATOM 217 HB2 LEU A 16 16.375 15.484 4.744 1.00 31.15 H ATOM 218 HB3 LEU A 16 15.209 16.367 4.143 1.00 31.15 H ATOM 219 HG LEU A 16 17.466 17.596 5.296 1.00 30.98 H ATOM 220 HD11 LEU A 16 18.402 17.809 3.188 1.00 30.74 H ATOM 221 HD12 LEU A 16 18.269 16.271 3.564 1.00 30.74 H ATOM 222 HD13 LEU A 16 17.223 16.940 2.572 1.00 30.74 H ATOM 223 HD21 LEU A 16 16.891 19.379 4.000 1.00 30.87 H ATOM 224 HD22 LEU A 16 15.670 18.557 3.401 1.00 30.87 H ATOM 225 HD23 LEU A 16 15.673 18.971 4.935 1.00 30.87 H ATOM 226 N GLU A 17 14.306 14.094 6.424 1.00 30.16 N ANISOU 226 N GLU A 17 4101 4131 3226 1548 -31 270 N ATOM 227 CA GLU A 17 13.222 13.119 6.547 1.00 31.59 C ANISOU 227 CA GLU A 17 4342 4304 3357 1488 -64 279 C ATOM 228 C GLU A 17 12.324 13.435 7.731 1.00 30.28 C ANISOU 228 C GLU A 17 4115 4145 3245 1432 -36 245 C ATOM 229 O GLU A 17 11.104 13.273 7.646 1.00 31.06 O ANISOU 229 O GLU A 17 4202 4238 3361 1376 -53 263 O ATOM 230 CB GLU A 17 13.770 11.698 6.706 1.00 33.79 C ANISOU 230 CB GLU A 17 4751 4577 3508 1498 -93 269 C ATOM 231 CG GLU A 17 14.128 11.034 5.415 1.00 38.53 C ANISOU 231 CG GLU A 17 5433 5166 4041 1528 -137 314 C ATOM 232 CD GLU A 17 12.904 10.669 4.545 1.00 42.72 C ANISOU 232 CD GLU A 17 5981 5684 4568 1482 -178 361 C ATOM 233 OE1 GLU A 17 13.104 10.519 3.324 1.00 42.83 O ANISOU 233 OE1 GLU A 17 6028 5688 4559 1508 -208 404 O ATOM 234 OE2 GLU A 17 11.765 10.497 5.065 1.00 44.96 O ANISOU 234 OE2 GLU A 17 6247 5965 4868 1421 -181 355 O ATOM 235 H GLU A 17 15.095 13.759 6.485 1.00 36.19 H ATOM 236 HA GLU A 17 12.680 13.145 5.743 1.00 37.91 H ATOM 237 HB2 GLU A 17 14.571 11.732 7.252 1.00 40.54 H ATOM 238 HB3 GLU A 17 13.098 11.151 7.143 1.00 40.54 H ATOM 239 HG2 GLU A 17 14.690 11.635 4.900 1.00 46.24 H ATOM 240 HG3 GLU A 17 14.611 10.215 5.607 1.00 46.24 H ATOM 241 N LYS A 18 12.911 13.848 8.853 1.00 30.12 N ANISOU 241 N LYS A 18 4058 4138 3249 1445 6 196 N ATOM 242 CA LYS A 18 12.112 14.206 10.021 1.00 30.20 C ANISOU 242 CA LYS A 18 4005 4155 3313 1394 36 161 C ATOM 243 C LYS A 18 11.244 15.424 9.750 1.00 30.30 C ANISOU 243 C LYS A 18 3900 4169 3444 1370 55 180 C ATOM 244 O LYS A 18 10.084 15.467 10.174 1.00 30.48 O ANISOU 244 O LYS A 18 3888 4191 3502 1311 56 177 O ATOM 245 CB LYS A 18 13.022 14.438 11.218 1.00 29.99 C ANISOU 245 CB LYS A 18 3964 4143 3288 1419 78 105 C ATOM 246 CG LYS A 18 13.644 13.140 11.751 1.00 29.92 C ANISOU 246 CG LYS A 18 4073 4133 3162 1428 60 80 C ATOM 247 CD LYS A 18 14.596 13.394 12.935 1.00 29.71 C ANISOU 247 CD LYS A 18 4030 4121 3138 1455 102 25 C ATOM 248 CE LYS A 18 14.959 12.108 13.641 1.00 30.65 C ANISOU 248 CE LYS A 18 4257 4240 3148 1449 87 -4 C ATOM 249 NZ LYS A 18 15.972 12.364 14.740 1.00 32.08 N ANISOU 249 NZ LYS A 18 4425 4434 3329 1480 127 -56 N ATOM 250 H LYS A 18 13.761 13.929 8.962 1.00 36.15 H ATOM 251 HA LYS A 18 11.524 13.465 10.235 1.00 36.24 H ATOM 252 HB2 LYS A 18 13.743 15.031 10.957 1.00 35.99 H ATOM 253 HB3 LYS A 18 12.505 14.838 11.935 1.00 35.99 H ATOM 254 HG2 LYS A 18 12.937 12.549 12.053 1.00 35.90 H ATOM 255 HG3 LYS A 18 14.152 12.716 11.041 1.00 35.90 H ATOM 256 HD2 LYS A 18 15.413 13.802 12.607 1.00 35.65 H ATOM 257 HD3 LYS A 18 14.162 13.981 13.574 1.00 35.65 H ATOM 258 HE2 LYS A 18 14.163 11.725 14.042 1.00 36.78 H ATOM 259 HE3 LYS A 18 15.348 11.489 13.004 1.00 36.78 H ATOM 260 HZ1 LYS A 18 16.177 11.599 15.148 1.00 38.49 H ATOM 261 HZ2 LYS A 18 16.713 12.715 14.395 1.00 38.49 H ATOM 262 HZ3 LYS A 18 15.635 12.930 15.339 1.00 38.49 H ATOM 263 N GLU A 19 11.781 16.414 9.036 1.00 30.20 N ANISOU 263 N GLU A 19 3822 4158 3494 1413 70 199 N ATOM 264 CA GLU A 19 10.978 17.544 8.597 1.00 30.30 C ANISOU 264 CA GLU A 19 3727 4171 3616 1393 83 223 C ATOM 265 C GLU A 19 9.835 17.098 7.689 1.00 30.55 C ANISOU 265 C GLU A 19 3783 4189 3636 1352 40 272 C ATOM 266 O GLU A 19 8.691 17.543 7.845 1.00 30.72 O ANISOU 266 O GLU A 19 3740 4209 3723 1301 46 279 O ATOM 267 CB GLU A 19 11.859 18.528 7.860 1.00 32.07 C ANISOU 267 CB GLU A 19 3895 4398 3892 1453 100 239 C ATOM 268 CG GLU A 19 11.168 19.855 7.615 1.00 35.87 C ANISOU 268 CG GLU A 19 4251 4881 4496 1437 124 255 C ATOM 269 CD GLU A 19 11.085 20.648 8.902 1.00 37.89 C ANISOU 269 CD GLU A 19 4421 5150 4824 1421 175 207 C ATOM 270 OE1 GLU A 19 10.252 21.564 9.001 1.00 39.79 O ANISOU 270 OE1 GLU A 19 4566 5393 5160 1389 196 212 O ATOM 271 OE2 GLU A 19 11.877 20.346 9.813 1.00 37.74 O ANISOU 271 OE2 GLU A 19 4435 5140 4765 1440 195 163 O ATOM 272 H GLU A 19 12.606 16.451 8.796 1.00 36.24 H ATOM 273 HA GLU A 19 10.600 17.990 9.371 1.00 36.36 H ATOM 274 HB2 GLU A 19 12.656 18.697 8.386 1.00 38.48 H ATOM 275 HB3 GLU A 19 12.102 18.152 6.999 1.00 38.48 H ATOM 276 HG2 GLU A 19 11.676 20.370 6.968 1.00 43.04 H ATOM 277 HG3 GLU A 19 10.268 19.697 7.291 1.00 43.04 H ATOM 278 N PHE A 20 10.136 16.214 6.727 1.00 30.57 N ANISOU 278 N PHE A 20 3880 4181 3556 1372 -4 305 N ATOM 279 CA PHE A 20 9.137 15.769 5.761 1.00 30.80 C ANISOU 279 CA PHE A 20 3937 4196 3569 1337 -47 354 C ATOM 280 C PHE A 20 7.987 15.051 6.454 1.00 31.52 C ANISOU 280 C PHE A 20 4056 4284 3635 1268 -60 343 C ATOM 281 O PHE A 20 6.846 15.088 5.979 1.00 31.21 O ANISOU 281 O PHE A 20 3995 4237 3626 1224 -81 374 O ATOM 282 CB PHE A 20 9.819 14.862 4.732 1.00 30.76 C ANISOU 282 CB PHE A 20 4038 4182 3469 1375 -90 385 C ATOM 283 CG PHE A 20 8.956 14.473 3.582 1.00 30.98 C ANISOU 283 CG PHE A 20 4094 4194 3480 1349 -135 439 C ATOM 284 CD1 PHE A 20 8.787 15.330 2.511 1.00 32.67 C ANISOU 284 CD1 PHE A 20 4246 4405 3763 1365 -139 481 C ATOM 285 CD2 PHE A 20 8.343 13.236 3.552 1.00 32.61 C ANISOU 285 CD2 PHE A 20 4395 4392 3603 1311 -174 449 C ATOM 286 CE1 PHE A 20 7.992 14.967 1.426 1.00 34.93 C ANISOU 286 CE1 PHE A 20 4559 4677 4033 1341 -181 532 C ATOM 287 CE2 PHE A 20 7.556 12.857 2.472 1.00 34.97 C ANISOU 287 CE2 PHE A 20 4723 4678 3886 1287 -217 500 C ATOM 288 CZ PHE A 20 7.384 13.723 1.403 1.00 35.34 C ANISOU 288 CZ PHE A 20 4706 4720 4001 1303 -221 541 C ATOM 289 H PHE A 20 10.912 15.861 6.618 1.00 36.69 H ATOM 290 HA PHE A 20 8.777 16.540 5.295 1.00 36.96 H ATOM 291 HB2 PHE A 20 10.593 15.325 4.376 1.00 36.92 H ATOM 292 HB3 PHE A 20 10.102 14.047 5.176 1.00 36.92 H ATOM 293 HD1 PHE A 20 9.199 16.164 2.520 1.00 39.20 H ATOM 294 HD2 PHE A 20 8.460 12.649 4.264 1.00 39.13 H ATOM 295 HE1 PHE A 20 7.882 15.553 0.712 1.00 41.91 H ATOM 296 HE2 PHE A 20 7.144 12.024 2.467 1.00 41.96 H ATOM 297 HZ PHE A 20 6.850 13.477 0.683 1.00 42.41 H ATOM 298 N HIS A 21 8.277 14.410 7.590 1.00 31.68 N ANISOU 298 N HIS A 21 4124 4311 3603 1259 -48 297 N ATOM 299 CA HIS A 21 7.267 13.713 8.377 1.00 32.97 C ANISOU 299 CA HIS A 21 4316 4473 3740 1195 -57 281 C ATOM 300 C HIS A 21 6.143 14.648 8.813 1.00 35.53 C ANISOU 300 C HIS A 21 4530 4800 4170 1146 -31 277 C ATOM 301 O HIS A 21 4.983 14.232 8.905 1.00 36.47 O ANISOU 301 O HIS A 21 4657 4913 4286 1088 -50 288 O ATOM 302 CB HIS A 21 7.971 13.084 9.581 1.00 33.20 C ANISOU 302 CB HIS A 21 4399 4510 3706 1203 -40 228 C ATOM 303 CG HIS A 21 7.064 12.402 10.561 1.00 34.29 C ANISOU 303 CG HIS A 21 4563 4647 3817 1141 -43 203 C ATOM 304 ND1 HIS A 21 6.847 11.039 10.556 1.00 33.47 N ANISOU 304 ND1 HIS A 21 4571 4536 3609 1120 -82 207 N ATOM 305 CD2 HIS A 21 6.359 12.891 11.609 1.00 33.81 C ANISOU 305 CD2 HIS A 21 4433 4595 3819 1098 -11 171 C ATOM 306 CE1 HIS A 21 6.035 10.721 11.549 1.00 32.94 C ANISOU 306 CE1 HIS A 21 4502 4471 3542 1065 -74 180 C ATOM 307 NE2 HIS A 21 5.728 11.828 12.208 1.00 33.77 N ANISOU 307 NE2 HIS A 21 4498 4586 3748 1051 -31 157 N ATOM 308 H HIS A 21 9.067 14.366 7.927 1.00 38.02 H ATOM 309 HA HIS A 21 6.880 13.001 7.843 1.00 39.57 H ATOM 310 HB2 HIS A 21 8.602 12.422 9.258 1.00 39.84 H ATOM 311 HB3 HIS A 21 8.446 13.781 10.059 1.00 39.84 H ATOM 312 HD1 HIS A 21 7.185 10.484 9.993 1.00 40.16 H ATOM 313 HD2 HIS A 21 6.313 13.781 11.875 1.00 40.57 H ATOM 314 HE1 HIS A 21 5.730 9.866 11.750 1.00 39.52 H ATOM 315 N PHE A 22 6.463 15.905 9.116 1.00 37.79 N ANISOU 315 N PHE A 22 4712 5097 4551 1167 13 260 N ATOM 316 CA PHE A 22 5.441 16.853 9.560 1.00 40.13 C ANISOU 316 CA PHE A 22 4899 5397 4952 1122 40 255 C ATOM 317 C PHE A 22 4.821 17.637 8.412 1.00 42.96 C ANISOU 317 C PHE A 22 5191 5748 5384 1118 29 305 C ATOM 318 O PHE A 22 3.620 17.932 8.446 1.00 42.09 O ANISOU 318 O PHE A 22 5029 5635 5329 1066 28 318 O ATOM 319 CB PHE A 22 6.021 17.872 10.550 1.00 37.67 C ANISOU 319 CB PHE A 22 4502 5100 4712 1143 97 209 C ATOM 320 CG PHE A 22 6.620 17.263 11.765 1.00 35.60 C ANISOU 320 CG PHE A 22 4290 4846 4391 1146 114 157 C ATOM 321 CD1 PHE A 22 5.839 16.961 12.869 1.00 35.42 C ANISOU 321 CD1 PHE A 22 4263 4826 4369 1091 126 125 C ATOM 322 CD2 PHE A 22 7.968 17.040 11.830 1.00 34.22 C ANISOU 322 CD2 PHE A 22 4163 4676 4164 1204 121 138 C ATOM 323 CE1 PHE A 22 6.415 16.412 14.000 1.00 35.18 C ANISOU 323 CE1 PHE A 22 4279 4804 4285 1095 142 76 C ATOM 324 CE2 PHE A 22 8.531 16.490 12.953 1.00 33.59 C ANISOU 324 CE2 PHE A 22 4128 4603 4030 1207 137 90 C ATOM 325 CZ PHE A 22 7.761 16.170 14.028 1.00 33.34 C ANISOU 325 CZ PHE A 22 4096 4575 3998 1153 147 59 C ATOM 326 H PHE A 22 7.257 16.232 9.072 1.00 45.35 H ATOM 327 HA PHE A 22 4.732 16.366 10.009 1.00 48.16 H ATOM 328 HB2 PHE A 22 6.715 18.381 10.102 1.00 45.21 H ATOM 329 HB3 PHE A 22 5.311 18.466 10.837 1.00 45.21 H ATOM 330 HD1 PHE A 22 4.922 17.115 12.844 1.00 42.51 H ATOM 331 HD2 PHE A 22 8.505 17.243 11.098 1.00 41.07 H ATOM 332 HE1 PHE A 22 5.887 16.196 14.734 1.00 42.22 H ATOM 333 HE2 PHE A 22 9.447 16.330 12.979 1.00 40.30 H ATOM 334 HZ PHE A 22 8.152 15.805 14.789 1.00 40.01 H ATOM 335 N ASN A 23 5.636 18.003 7.421 1.00 48.59 N ANISOU 335 N ASN A 23 5890 6466 6108 1204 -975 -485 N ATOM 336 CA ASN A 23 5.223 18.853 6.305 1.00 50.60 C ANISOU 336 CA ASN A 23 6111 6698 6417 1182 -972 -467 C ATOM 337 C ASN A 23 5.880 18.353 5.028 1.00 44.75 C ANISOU 337 C ASN A 23 5404 5916 5681 1137 -1035 -488 C ATOM 338 O ASN A 23 7.112 18.348 4.924 1.00 43.65 O ANISOU 338 O ASN A 23 5308 5761 5515 1149 -1053 -572 O ATOM 339 CB ASN A 23 5.623 20.317 6.536 1.00 56.04 C ANISOU 339 CB ASN A 23 6779 7391 7122 1228 -916 -533 C ATOM 340 CG ASN A 23 4.664 21.051 7.425 1.00 61.60 C ANISOU 340 CG ASN A 23 7433 8131 7843 1262 -852 -494 C ATOM 341 OD1 ASN A 23 3.450 21.068 7.170 1.00 64.97 O ANISOU 341 OD1 ASN A 23 7817 8565 8306 1238 -844 -408 O ATOM 342 ND2 ASN A 23 5.194 21.682 8.474 1.00 61.46 N ANISOU 342 ND2 ASN A 23 7418 8135 7799 1317 -804 -556 N ATOM 343 H ASN A 23 6.460 17.763 7.374 1.00 58.31 H ATOM 344 HA ASN A 23 4.260 18.808 6.198 1.00 60.72 H ATOM 345 HB2 ASN A 23 6.498 20.342 6.954 1.00 67.25 H ATOM 346 HB3 ASN A 23 5.651 20.775 5.682 1.00 67.25 H ATOM 347 HD21 ASN A 23 4.687 22.118 9.015 1.00 73.75 H ATOM 348 HD22 ASN A 23 6.043 21.653 8.610 1.00 73.75 H ATOM 349 N ARG A 24 5.063 17.972 4.049 1.00 42.51 N ANISOU 349 N ARG A 24 5102 5616 5433 1086 -1068 -413 N ATOM 350 CA ARG A 24 5.585 17.591 2.745 1.00 39.91 C ANISOU 350 CA ARG A 24 4800 5247 5115 1041 -1127 -427 C ATOM 351 C ARG A 24 5.961 18.800 1.890 1.00 34.19 C ANISOU 351 C ARG A 24 4062 4500 4429 1046 -1112 -475 C ATOM 352 O ARG A 24 6.661 18.636 0.885 1.00 32.53 O ANISOU 352 O ARG A 24 3880 4256 4223 1018 -1156 -510 O ATOM 353 CB ARG A 24 4.568 16.708 2.014 1.00 44.49 C ANISOU 353 CB ARG A 24 5366 5818 5719 983 -1168 -328 C ATOM 354 CG ARG A 24 4.384 15.311 2.634 1.00 50.21 C ANISOU 354 CG ARG A 24 6117 6558 6404 969 -1198 -286 C ATOM 355 CD ARG A 24 3.824 14.352 1.628 1.00 54.99 C ANISOU 355 CD ARG A 24 6726 7142 7028 906 -1256 -215 C ATOM 356 NE ARG A 24 2.762 14.979 0.844 1.00 59.51 N ANISOU 356 NE ARG A 24 7246 7708 7657 881 -1243 -150 N ATOM 357 CZ ARG A 24 1.515 15.181 1.259 1.00 61.33 C ANISOU 357 CZ ARG A 24 7428 7964 7911 884 -1209 -73 C ATOM 358 NH1 ARG A 24 1.136 14.807 2.476 1.00 61.15 N ANISOU 358 NH1 ARG A 24 7400 7975 7860 910 -1182 -48 N ATOM 359 NH2 ARG A 24 0.650 15.764 0.437 1.00 61.53 N ANISOU 359 NH2 ARG A 24 7409 7980 7989 859 -1202 -20 N ATOM 360 H ARG A 24 4.207 17.927 4.116 1.00 51.01 H ATOM 361 HA ARG A 24 6.388 17.064 2.877 1.00 47.89 H ATOM 362 HB2 ARG A 24 3.705 17.152 2.026 1.00 53.39 H ATOM 363 HB3 ARG A 24 4.862 16.588 1.098 1.00 53.39 H ATOM 364 HG2 ARG A 24 5.244 14.975 2.932 1.00 60.26 H ATOM 365 HG3 ARG A 24 3.766 15.368 3.380 1.00 60.26 H ATOM 366 HD2 ARG A 24 4.528 14.074 1.022 1.00 65.99 H ATOM 367 HD3 ARG A 24 3.451 13.584 2.089 1.00 65.99 H ATOM 368 HE ARG A 24 2.960 15.238 0.049 1.00 71.41 H ATOM 369 HH11 ARG A 24 1.699 14.429 3.005 1.00 73.38 H ATOM 370 HH12 ARG A 24 0.327 14.942 2.735 1.00 73.38 H ATOM 371 HH21 ARG A 24 0.899 16.005 -0.350 1.00 73.84 H ATOM 372 HH22 ARG A 24 -0.160 15.901 0.692 1.00 73.84 H ATOM 373 N TYR A 25 5.547 20.001 2.289 1.00 34.13 N ANISOU 373 N TYR A 25 4012 4510 4447 1081 -1051 -480 N ATOM 374 CA TYR A 25 5.917 21.240 1.617 1.00 35.29 C ANISOU 374 CA TYR A 25 4143 4638 4627 1093 -1030 -530 C ATOM 375 C TYR A 25 6.519 22.191 2.638 1.00 34.90 C ANISOU 375 C TYR A 25 4092 4609 4559 1155 -972 -605 C ATOM 376 O TYR A 25 6.168 22.152 3.816 1.00 34.57 O ANISOU 376 O TYR A 25 4038 4602 4496 1188 -935 -591 O ATOM 377 CB TYR A 25 4.698 21.929 0.940 1.00 37.00 C ANISOU 377 CB TYR A 25 4301 4853 4904 1071 -1010 -456 C ATOM 378 CG TYR A 25 4.094 21.098 -0.150 1.00 38.28 C ANISOU 378 CG TYR A 25 4463 4994 5090 1009 -1066 -383 C ATOM 379 CD1 TYR A 25 3.144 20.127 0.141 1.00 39.14 C ANISOU 379 CD1 TYR A 25 4560 5118 5193 983 -1081 -296 C ATOM 380 CD2 TYR A 25 4.492 21.260 -1.470 1.00 37.99 C ANISOU 380 CD2 TYR A 25 4437 4920 5079 974 -1103 -402 C ATOM 381 CE1 TYR A 25 2.604 19.339 -0.862 1.00 39.14 C ANISOU 381 CE1 TYR A 25 4560 5098 5214 925 -1133 -230 C ATOM 382 CE2 TYR A 25 3.954 20.488 -2.469 1.00 38.95 C ANISOU 382 CE2 TYR A 25 4558 5020 5220 917 -1155 -336 C ATOM 383 CZ TYR A 25 3.010 19.534 -2.158 1.00 38.06 C ANISOU 383 CZ TYR A 25 4434 4925 5103 893 -1169 -250 C ATOM 384 OH TYR A 25 2.476 18.772 -3.152 1.00 37.76 O ANISOU 384 OH TYR A 25 4396 4867 5085 836 -1220 -186 O ATOM 385 H TYR A 25 5.035 20.125 2.968 1.00 40.96 H ATOM 386 HA TYR A 25 6.583 21.054 0.938 1.00 42.35 H ATOM 387 HB2 TYR A 25 4.014 22.090 1.608 1.00 44.40 H ATOM 388 HB3 TYR A 25 4.987 22.769 0.551 1.00 44.40 H ATOM 389 HD1 TYR A 25 2.873 19.998 1.021 1.00 46.97 H ATOM 390 HD2 TYR A 25 5.130 21.903 -1.681 1.00 45.59 H ATOM 391 HE1 TYR A 25 1.963 18.696 -0.662 1.00 46.97 H ATOM 392 HE2 TYR A 25 4.223 20.609 -3.351 1.00 46.74 H ATOM 393 HH TYR A 25 2.807 18.992 -3.892 1.00 45.32 H ATOM 394 N LEU A 26 7.423 23.048 2.183 1.00 35.01 N ANISOU 394 N LEU A 26 4117 4603 4581 1172 -965 -685 N ATOM 395 CA LEU A 26 8.099 23.988 3.066 1.00 38.72 C ANISOU 395 CA LEU A 26 4589 5090 5033 1230 -912 -764 C ATOM 396 C LEU A 26 7.671 25.422 2.781 1.00 38.41 C ANISOU 396 C LEU A 26 4501 5050 5041 1249 -862 -767 C ATOM 397 O LEU A 26 7.512 25.819 1.621 1.00 37.49 O ANISOU 397 O LEU A 26 4371 4907 4966 1218 -879 -754 O ATOM 398 CB LEU A 26 9.620 23.878 2.925 1.00 41.00 C ANISOU 398 CB LEU A 26 4933 5358 5288 1242 -939 -865 C ATOM 399 CG LEU A 26 10.300 22.689 3.595 1.00 40.69 C ANISOU 399 CG LEU A 26 4945 5326 5190 1245 -971 -889 C ATOM 400 CD1 LEU A 26 11.796 22.952 3.626 1.00 40.96 C ANISOU 400 CD1 LEU A 26 5024 5345 5194 1271 -978 -1000 C ATOM 401 CD2 LEU A 26 9.763 22.425 5.001 1.00 40.85 C ANISOU 401 CD2 LEU A 26 4951 5388 5183 1278 -934 -859 C ATOM 402 H LEU A 26 7.665 23.106 1.360 1.00 42.01 H ATOM 403 HA LEU A 26 7.866 23.782 3.984 1.00 46.47 H ATOM 404 HB2 LEU A 26 9.832 23.832 1.980 1.00 49.20 H ATOM 405 HB3 LEU A 26 10.015 24.680 3.302 1.00 49.20 H ATOM 406 HG LEU A 26 10.146 21.894 3.060 1.00 48.83 H ATOM 407 HD11 LEU A 26 12.239 22.201 4.050 1.00 49.15 H ATOM 408 HD12 LEU A 26 12.116 23.056 2.716 1.00 49.15 H ATOM 409 HD13 LEU A 26 11.962 23.763 4.131 1.00 49.15 H ATOM 410 HD21 LEU A 26 10.227 21.662 5.378 1.00 49.02 H ATOM 411 HD22 LEU A 26 9.916 23.210 5.550 1.00 49.02 H ATOM 412 HD23 LEU A 26 8.812 22.240 4.946 1.00 49.02 H ATOM 413 N THR A 27 7.487 26.195 3.848 1.00 39.54 N ANISOU 413 N THR A 27 4620 5225 5180 1299 -800 -784 N ATOM 414 CA THR A 27 7.427 27.642 3.698 1.00 42.43 C ANISOU 414 CA THR A 27 4951 5590 5582 1326 -750 -814 C ATOM 415 C THR A 27 8.817 28.173 3.369 1.00 38.24 C ANISOU 415 C THR A 27 4456 5036 5038 1345 -756 -921 C ATOM 416 O THR A 27 9.834 27.541 3.668 1.00 36.72 O ANISOU 416 O THR A 27 4313 4839 4800 1353 -783 -979 O ATOM 417 CB THR A 27 6.907 28.312 4.981 1.00 47.95 C ANISOU 417 CB THR A 27 5616 6329 6276 1377 -681 -808 C ATOM 418 OG1 THR A 27 7.815 28.058 6.063 1.00 47.96 O ANISOU 418 OG1 THR A 27 5653 6346 6223 1417 -670 -875 O ATOM 419 CG2 THR A 27 5.503 27.786 5.353 1.00 49.54 C ANISOU 419 CG2 THR A 27 5779 6553 6490 1359 -673 -700 C ATOM 420 H THR A 27 7.395 25.911 4.655 1.00 47.45 H ATOM 421 HA THR A 27 6.829 27.869 2.968 1.00 50.92 H ATOM 422 HB THR A 27 6.843 29.269 4.837 1.00 57.55 H ATOM 423 HG1 THR A 27 7.534 28.423 6.765 1.00 57.55 H ATOM 424 HG21 THR A 27 5.191 28.218 6.163 1.00 59.45 H ATOM 425 HG22 THR A 27 4.878 27.973 4.635 1.00 59.45 H ATOM 426 HG23 THR A 27 5.537 26.828 5.500 1.00 59.45 H ATOM 427 N ARG A 28 8.863 29.348 2.748 1.00 40.08 N ANISOU 427 N ARG A 28 6049 4019 5159 595 -885 254 N ATOM 428 CA ARG A 28 10.157 29.952 2.448 1.00 42.79 C ANISOU 428 CA ARG A 28 6424 4343 5491 595 -854 214 C ATOM 429 C ARG A 28 10.963 30.215 3.719 1.00 38.62 C ANISOU 429 C ARG A 28 5898 3802 4973 612 -786 109 C ATOM 430 O ARG A 28 12.181 30.003 3.745 1.00 37.84 O ANISOU 430 O ARG A 28 5848 3715 4814 603 -774 47 O ATOM 431 CB ARG A 28 9.985 31.266 1.675 1.00 50.73 C ANISOU 431 CB ARG A 28 7395 5298 6581 607 -839 278 C ATOM 432 CG ARG A 28 11.340 31.923 1.407 1.00 58.82 C ANISOU 432 CG ARG A 28 8452 6302 7597 608 -804 235 C ATOM 433 CD ARG A 28 11.341 32.902 0.240 1.00 67.74 C ANISOU 433 CD ARG A 28 9569 7396 8774 608 -813 309 C ATOM 434 NE ARG A 28 12.708 33.144 -0.243 1.00 75.43 N ANISOU 434 NE ARG A 28 10590 8366 9705 599 -800 273 N ATOM 435 CZ ARG A 28 13.546 34.062 0.249 1.00 81.87 C ANISOU 435 CZ ARG A 28 11401 9146 10562 615 -737 216 C ATOM 436 NH1 ARG A 28 13.179 34.859 1.255 1.00 84.24 N ANISOU 436 NH1 ARG A 28 11649 9409 10949 643 -679 186 N ATOM 437 NH2 ARG A 28 14.765 34.186 -0.266 1.00 82.41 N ANISOU 437 NH2 ARG A 28 11514 9214 10583 604 -731 187 N ATOM 438 H ARG A 28 8.179 29.805 2.495 1.00 48.09 H ATOM 439 HA ARG A 28 10.667 29.343 1.892 1.00 51.35 H ATOM 440 HB2 ARG A 28 9.559 31.084 0.823 1.00 60.87 H ATOM 441 HB3 ARG A 28 9.446 31.879 2.199 1.00 60.87 H ATOM 442 HG2 ARG A 28 11.612 32.410 2.200 1.00 70.59 H ATOM 443 HG3 ARG A 28 11.989 31.230 1.210 1.00 70.59 H ATOM 444 HD2 ARG A 28 10.820 32.534 -0.491 1.00 81.29 H ATOM 445 HD3 ARG A 28 10.965 33.749 0.529 1.00 81.29 H ATOM 446 HE ARG A 28 12.990 32.656 -0.892 1.00 90.52 H ATOM 447 HH11 ARG A 28 12.393 34.787 1.597 1.00101.09 H ATOM 448 HH12 ARG A 28 13.729 35.446 1.561 1.00101.09 H ATOM 449 HH21 ARG A 28 15.012 33.678 -0.914 1.00 98.89 H ATOM 450 HH22 ARG A 28 15.306 34.777 0.047 1.00 98.89 H ATOM 451 N ARG A 29 10.310 30.724 4.766 1.00 38.44 N ANISOU 451 N ARG A 29 5822 3755 5028 636 -741 88 N ATOM 452 CA ARG A 29 11.016 30.990 6.006 1.00 38.16 C ANISOU 452 CA ARG A 29 5786 3708 5006 653 -676 -11 C ATOM 453 C ARG A 29 11.655 29.717 6.563 1.00 37.51 C ANISOU 453 C ARG A 29 5756 3676 4821 636 -690 -84 C ATOM 454 O ARG A 29 12.806 29.736 7.013 1.00 37.14 O ANISOU 454 O ARG A 29 5742 3630 4740 637 -655 -164 O ATOM 455 CB ARG A 29 10.056 31.613 7.020 1.00 39.71 C ANISOU 455 CB ARG A 29 5914 3874 5299 680 -632 -15 C ATOM 456 CG ARG A 29 10.710 31.995 8.330 1.00 43.83 C ANISOU 456 CG ARG A 29 6429 4379 5846 700 -561 -114 C ATOM 457 CD ARG A 29 9.772 32.820 9.226 1.00 47.71 C ANISOU 457 CD ARG A 29 6849 4834 6444 729 -515 -111 C ATOM 458 NE ARG A 29 9.232 34.000 8.548 1.00 49.34 N ANISOU 458 NE ARG A 29 7010 4993 6743 743 -507 -37 N ATOM 459 CZ ARG A 29 8.186 34.707 8.987 1.00 51.35 C ANISOU 459 CZ ARG A 29 7200 5216 7094 765 -483 -5 C ATOM 460 NH1 ARG A 29 7.549 34.350 10.104 1.00 53.02 N ANISOU 460 NH1 ARG A 29 7383 5439 7322 776 -464 -40 N ATOM 461 NH2 ARG A 29 7.765 35.768 8.305 1.00 49.92 N ANISOU 461 NH2 ARG A 29 6982 4993 6992 776 -478 62 N ATOM 462 H ARG A 29 9.473 30.919 4.779 1.00 46.13 H ATOM 463 HA ARG A 29 11.725 31.630 5.834 1.00 45.79 H ATOM 464 HB2 ARG A 29 9.673 32.417 6.634 1.00 47.65 H ATOM 465 HB3 ARG A 29 9.352 30.975 7.215 1.00 47.65 H ATOM 466 HG2 ARG A 29 10.955 31.189 8.811 1.00 52.60 H ATOM 467 HG3 ARG A 29 11.500 32.528 8.148 1.00 52.60 H ATOM 468 HD2 ARG A 29 9.026 32.263 9.499 1.00 57.25 H ATOM 469 HD3 ARG A 29 10.264 33.121 10.006 1.00 57.25 H ATOM 470 HE ARG A 29 9.612 34.255 7.820 1.00 59.20 H ATOM 471 HH11 ARG A 29 7.815 33.665 10.551 1.00 63.62 H ATOM 472 HH12 ARG A 29 6.875 34.808 10.381 1.00 63.62 H ATOM 473 HH21 ARG A 29 8.168 36.003 7.583 1.00 59.90 H ATOM 474 HH22 ARG A 29 7.090 36.220 8.587 1.00 59.90 H ATOM 475 N ARG A 30 10.932 28.602 6.530 1.00 37.37 N ANISOU 475 N ARG A 30 5747 3700 4752 621 -742 -59 N ATOM 476 CA ARG A 30 11.462 27.345 7.062 1.00 36.76 C ANISOU 476 CA ARG A 30 5719 3673 4576 605 -759 -125 C ATOM 477 C ARG A 30 12.573 26.789 6.171 1.00 36.40 C ANISOU 477 C ARG A 30 5742 3654 4436 580 -793 -136 C ATOM 478 O ARG A 30 13.580 26.265 6.669 1.00 35.90 O ANISOU 478 O ARG A 30 5722 3612 4307 573 -778 -216 O ATOM 479 CB ARG A 30 10.325 26.331 7.210 1.00 36.74 C ANISOU 479 CB ARG A 30 5705 3707 4548 595 -807 -89 C ATOM 480 CG ARG A 30 10.724 24.956 7.775 1.00 36.13 C ANISOU 480 CG ARG A 30 5676 3683 4371 578 -830 -152 C ATOM 481 CD ARG A 30 11.385 25.102 9.140 1.00 35.84 C ANISOU 481 CD ARG A 30 5637 3637 4341 594 -765 -256 C ATOM 482 NE ARG A 30 11.634 23.821 9.782 1.00 36.75 N ANISOU 482 NE ARG A 30 5791 3802 4369 580 -784 -315 N ATOM 483 CZ ARG A 30 12.484 23.653 10.795 1.00 38.26 C ANISOU 483 CZ ARG A 30 6003 3999 4534 585 -741 -412 C ATOM 484 NH1 ARG A 30 13.175 24.695 11.263 1.00 38.44 N ANISOU 484 NH1 ARG A 30 6012 3982 4611 605 -676 -460 N ATOM 485 NH2 ARG A 30 12.657 22.445 11.339 1.00 38.61 N ANISOU 485 NH2 ARG A 30 6083 4089 4498 571 -762 -461 N ATOM 486 H ARG A 30 10.136 28.544 6.208 1.00 44.84 H ATOM 487 HA ARG A 30 11.836 27.507 7.943 1.00 44.12 H ATOM 488 HB2 ARG A 30 9.656 26.706 7.804 1.00 44.09 H ATOM 489 HB3 ARG A 30 9.932 26.182 6.335 1.00 44.09 H ATOM 490 HG2 ARG A 30 9.932 24.406 7.876 1.00 43.36 H ATOM 491 HG3 ARG A 30 11.356 24.532 7.173 1.00 43.36 H ATOM 492 HD2 ARG A 30 12.236 25.555 9.033 1.00 43.00 H ATOM 493 HD3 ARG A 30 10.803 25.620 9.719 1.00 43.00 H ATOM 494 HE ARG A 30 11.139 23.155 9.557 1.00 44.10 H ATOM 495 HH11 ARG A 30 13.066 25.474 10.916 1.00 46.13 H ATOM 496 HH12 ARG A 30 13.726 24.588 11.915 1.00 46.13 H ATOM 497 HH21 ARG A 30 12.216 21.771 11.038 1.00 46.33 H ATOM 498 HH22 ARG A 30 13.211 22.342 11.989 1.00 46.33 H ATOM 499 N ARG A 31 12.408 26.896 4.851 1.00 36.66 N ANISOU 499 N ARG A 31 5784 3686 4459 566 -840 -55 N ATOM 500 CA ARG A 31 13.470 26.494 3.933 1.00 36.37 C ANISOU 500 CA ARG A 31 5809 3670 4339 543 -870 -60 C ATOM 501 C ARG A 31 14.772 27.222 4.240 1.00 36.20 C ANISOU 501 C ARG A 31 5806 3622 4325 552 -813 -132 C ATOM 502 O ARG A 31 15.850 26.621 4.217 1.00 35.72 O ANISOU 502 O ARG A 31 5801 3589 4182 538 -818 -189 O ATOM 503 CB ARG A 31 13.046 26.764 2.496 1.00 36.77 C ANISOU 503 CB ARG A 31 5857 3713 4399 531 -919 41 C ATOM 504 CG ARG A 31 13.844 25.978 1.450 1.00 38.11 C ANISOU 504 CG ARG A 31 6093 3920 4467 502 -972 51 C ATOM 505 CD ARG A 31 13.323 26.293 0.035 1.00 42.13 C ANISOU 505 CD ARG A 31 6594 4420 4992 491 -1020 156 C ATOM 506 NE ARG A 31 13.583 27.691 -0.334 1.00 45.73 N ANISOU 506 NE ARG A 31 7023 4823 5528 507 -980 178 N ATOM 507 CZ ARG A 31 12.991 28.332 -1.345 1.00 49.51 C ANISOU 507 CZ ARG A 31 7476 5278 6056 507 -1003 269 C ATOM 508 NH1 ARG A 31 12.084 27.717 -2.098 1.00 50.87 N ANISOU 508 NH1 ARG A 31 7647 5475 6206 492 -1066 347 N ATOM 509 NH2 ARG A 31 13.307 29.596 -1.619 1.00 50.78 N ANISOU 509 NH2 ARG A 31 7615 5392 6288 522 -963 282 N ATOM 510 H ARG A 31 11.699 27.195 4.467 1.00 43.99 H ATOM 511 HA ARG A 31 13.628 25.541 4.028 1.00 43.64 H ATOM 512 HB2 ARG A 31 12.112 26.524 2.396 1.00 44.12 H ATOM 513 HB3 ARG A 31 13.164 27.708 2.308 1.00 44.12 H ATOM 514 HG2 ARG A 31 14.779 26.232 1.498 1.00 45.73 H ATOM 515 HG3 ARG A 31 13.742 25.027 1.612 1.00 45.73 H ATOM 516 HD2 ARG A 31 13.771 25.721 -0.606 1.00 50.55 H ATOM 517 HD3 ARG A 31 12.365 26.145 0.006 1.00 50.55 H ATOM 518 HE ARG A 31 14.158 28.127 0.134 1.00 54.87 H ATOM 519 HH11 ARG A 31 11.875 26.898 -1.937 1.00 61.04 H ATOM 520 HH12 ARG A 31 11.707 28.137 -2.747 1.00 61.04 H ATOM 521 HH21 ARG A 31 13.889 30.008 -1.137 1.00 60.94 H ATOM 522 HH22 ARG A 31 12.917 30.006 -2.266 1.00 60.94 H ATOM 523 N ILE A 32 14.690 28.517 4.551 1.00 36.58 N ANISOU 523 N ILE A 32 5808 3619 4471 577 -757 -132 N ATOM 524 CA ILE A 32 15.903 29.259 4.859 1.00 36.44 C ANISOU 524 CA ILE A 32 5806 3574 4465 588 -701 -199 C ATOM 525 C ILE A 32 16.558 28.720 6.121 1.00 35.92 C ANISOU 525 C ILE A 32 5761 3527 4359 592 -664 -305 C ATOM 526 O ILE A 32 17.781 28.601 6.185 1.00 35.54 O ANISOU 526 O ILE A 32 5758 3487 4259 585 -647 -369 O ATOM 527 CB ILE A 32 15.598 30.762 4.964 1.00 36.97 C ANISOU 527 CB ILE A 32 5816 3581 4651 614 -649 -175 C ATOM 528 CG1 ILE A 32 15.297 31.297 3.558 1.00 37.42 C ANISOU 528 CG1 ILE A 32 5866 3620 4731 606 -686 -78 C ATOM 529 CG2 ILE A 32 16.775 31.518 5.592 1.00 36.80 C ANISOU 529 CG2 ILE A 32 5804 3531 4649 629 -581 -258 C ATOM 530 CD1 ILE A 32 14.780 32.711 3.530 1.00 38.09 C ANISOU 530 CD1 ILE A 32 5892 3648 4934 631 -645 -37 C ATOM 531 H ILE A 32 13.963 28.975 4.589 1.00 43.90 H ATOM 532 HA ILE A 32 16.531 29.138 4.130 1.00 43.72 H ATOM 533 HB ILE A 32 14.814 30.885 5.521 1.00 44.37 H ATOM 534 HG12 ILE A 32 16.114 31.272 3.034 1.00 44.90 H ATOM 535 HG13 ILE A 32 14.627 30.730 3.146 1.00 44.90 H ATOM 536 HG21 ILE A 32 16.553 32.461 5.644 1.00 44.16 H ATOM 537 HG22 ILE A 32 16.937 31.166 6.481 1.00 44.16 H ATOM 538 HG23 ILE A 32 17.562 31.393 5.038 1.00 44.16 H ATOM 539 HD11 ILE A 32 14.616 32.969 2.609 1.00 45.71 H ATOM 540 HD12 ILE A 32 13.954 32.755 4.037 1.00 45.71 H ATOM 541 HD13 ILE A 32 15.443 33.298 3.925 1.00 45.71 H ATOM 542 N GLU A 33 15.763 28.388 7.145 1.00 29.59 N ANISOU 542 N GLU A 33 2983 3997 4263 480 88 -69 N ATOM 543 CA GLU A 33 16.329 27.859 8.384 1.00 32.27 C ANISOU 543 CA GLU A 33 3324 4378 4560 459 68 -79 C ATOM 544 C GLU A 33 17.014 26.524 8.147 1.00 30.53 C ANISOU 544 C GLU A 33 3133 4156 4311 470 21 -47 C ATOM 545 O GLU A 33 18.112 26.283 8.647 1.00 31.01 O ANISOU 545 O GLU A 33 3196 4234 4353 468 6 -59 O ATOM 546 CB GLU A 33 15.243 27.671 9.454 1.00 38.46 C ANISOU 546 CB GLU A 33 4102 5195 5315 429 71 -78 C ATOM 547 CG GLU A 33 14.613 28.913 10.023 1.00 44.42 C ANISOU 547 CG GLU A 33 4828 5963 6089 412 115 -113 C ATOM 548 CD GLU A 33 13.414 28.583 10.937 1.00 49.73 C ANISOU 548 CD GLU A 33 5498 6664 6733 384 115 -104 C ATOM 549 OE1 GLU A 33 12.954 27.424 10.959 1.00 49.25 O ANISOU 549 OE1 GLU A 33 5460 6608 6643 380 82 -68 O ATOM 550 OE2 GLU A 33 12.924 29.488 11.632 1.00 53.76 O ANISOU 550 OE2 GLU A 33 5984 7193 7251 366 148 -134 O ATOM 551 H GLU A 33 14.906 28.459 7.145 1.00 35.51 H ATOM 552 HA GLU A 33 16.988 28.483 8.727 1.00 38.72 H ATOM 553 HB2 GLU A 33 14.528 27.142 9.067 1.00 46.15 H ATOM 554 HB3 GLU A 33 15.633 27.184 10.197 1.00 46.15 H ATOM 555 HG2 GLU A 33 15.272 29.392 10.550 1.00 53.31 H ATOM 556 HG3 GLU A 33 14.295 29.472 9.297 1.00 53.31 H ATOM 557 N ILE A 34 16.339 25.611 7.453 1.00 29.96 N ANISOU 557 N ILE A 34 3085 4065 4233 478 -3 -5 N ATOM 558 CA ILE A 34 16.906 24.284 7.219 1.00 30.02 C ANISOU 558 CA ILE A 34 3122 4072 4214 487 -48 28 C ATOM 559 C ILE A 34 18.193 24.378 6.409 1.00 28.93 C ANISOU 559 C ILE A 34 2989 3909 4095 514 -56 23 C ATOM 560 O ILE A 34 19.197 23.742 6.741 1.00 27.93 O ANISOU 560 O ILE A 34 2872 3795 3944 516 -83 25 O ATOM 561 CB ILE A 34 15.866 23.380 6.537 1.00 30.95 C ANISOU 561 CB ILE A 34 3262 4170 4326 493 -69 74 C ATOM 562 CG1 ILE A 34 14.737 23.124 7.530 1.00 35.69 C ANISOU 562 CG1 ILE A 34 3859 4802 4898 463 -68 79 C ATOM 563 CG2 ILE A 34 16.507 22.049 6.084 1.00 30.38 C ANISOU 563 CG2 ILE A 34 3221 4090 4232 507 -116 109 C ATOM 564 CD1 ILE A 34 13.490 22.521 6.906 1.00 39.33 C ANISOU 564 CD1 ILE A 34 4338 5246 5362 466 -78 118 C ATOM 565 H ILE A 34 15.560 25.731 7.109 1.00 35.95 H ATOM 566 HA ILE A 34 17.126 23.886 8.076 1.00 36.03 H ATOM 567 HB ILE A 34 15.507 23.839 5.761 1.00 37.13 H ATOM 568 HG12 ILE A 34 15.054 22.510 8.211 1.00 42.82 H ATOM 569 HG13 ILE A 34 14.485 23.966 7.940 1.00 42.82 H ATOM 570 HG21 ILE A 34 15.830 21.502 5.658 1.00 36.46 H ATOM 571 HG22 ILE A 34 17.221 22.241 5.456 1.00 36.46 H ATOM 572 HG23 ILE A 34 16.864 21.591 6.861 1.00 36.46 H ATOM 573 HD11 ILE A 34 12.823 22.389 7.598 1.00 47.20 H ATOM 574 HD12 ILE A 34 13.151 23.128 6.230 1.00 47.20 H ATOM 575 HD13 ILE A 34 13.720 21.670 6.502 1.00 47.20 H ATOM 576 N ALA A 35 18.194 25.178 5.338 1.00 28.04 N ANISOU 576 N ALA A 35 2868 3759 4026 536 -32 17 N ATOM 577 CA ALA A 35 19.426 25.360 4.572 1.00 27.58 C ANISOU 577 CA ALA A 35 2813 3678 3989 561 -36 9 C ATOM 578 C ALA A 35 20.581 25.775 5.481 1.00 28.20 C ANISOU 578 C ALA A 35 2876 3783 4054 552 -31 -27 C ATOM 579 O ALA A 35 21.675 25.190 5.439 1.00 29.28 O ANISOU 579 O ALA A 35 3025 3922 4177 562 -58 -23 O ATOM 580 CB ALA A 35 19.208 26.402 3.473 1.00 27.42 C ANISOU 580 CB ALA A 35 2780 3619 4019 581 -3 -1 C ATOM 581 H ALA A 35 17.514 25.614 5.042 1.00 33.65 H ATOM 582 HA ALA A 35 19.662 24.521 4.148 1.00 33.10 H ATOM 583 HB1 ALA A 35 20.032 26.512 2.975 1.00 32.90 H ATOM 584 HB2 ALA A 35 18.502 26.094 2.883 1.00 32.90 H ATOM 585 HB3 ALA A 35 18.954 27.244 3.883 1.00 32.90 H ATOM 586 N HIS A 36 20.351 26.774 6.336 1.00 28.03 N ANISOU 586 N HIS A 36 2827 3784 4038 533 2 -64 N ATOM 587 CA HIS A 36 21.431 27.231 7.199 1.00 30.78 C ANISOU 587 CA HIS A 36 3160 4158 4376 524 9 -101 C ATOM 588 C HIS A 36 21.831 26.155 8.205 1.00 30.18 C ANISOU 588 C HIS A 36 3098 4119 4250 507 -27 -90 C ATOM 589 O HIS A 36 23.024 25.921 8.420 1.00 31.14 O ANISOU 589 O HIS A 36 3223 4249 4359 513 -43 -100 O ATOM 590 CB HIS A 36 21.029 28.519 7.920 1.00 41.54 C ANISOU 590 CB HIS A 36 4491 5538 5755 506 52 -142 C ATOM 591 CG HIS A 36 22.077 29.020 8.872 1.00 54.30 C ANISOU 591 CG HIS A 36 6089 7183 7360 495 61 -180 C ATOM 592 ND1 HIS A 36 22.069 28.723 10.221 1.00 59.64 N ANISOU 592 ND1 HIS A 36 6761 7903 7997 468 53 -192 N ATOM 593 CD2 HIS A 36 23.189 29.768 8.660 1.00 58.52 C ANISOU 593 CD2 HIS A 36 6611 7709 7917 508 75 -210 C ATOM 594 CE1 HIS A 36 23.120 29.279 10.800 1.00 61.90 C ANISOU 594 CE1 HIS A 36 7031 8206 8282 464 63 -227 C ATOM 595 NE2 HIS A 36 23.812 29.923 9.875 1.00 61.54 N ANISOU 595 NE2 HIS A 36 6980 8129 8273 488 77 -238 N ATOM 596 H HIS A 36 19.604 27.188 6.432 1.00 33.63 H ATOM 597 HA HIS A 36 22.206 27.427 6.651 1.00 36.93 H ATOM 598 HB2 HIS A 36 20.870 29.212 7.260 1.00 49.85 H ATOM 599 HB3 HIS A 36 20.219 28.355 8.429 1.00 49.85 H ATOM 600 HD2 HIS A 36 23.469 30.121 7.847 1.00 70.23 H ATOM 601 HE1 HIS A 36 23.332 29.231 11.704 1.00 74.28 H ATOM 602 HE2 HIS A 36 24.538 30.363 10.011 1.00 73.85 H ATOM 603 N ALA A 37 20.855 25.463 8.805 1.00 29.26 N ANISOU 603 N ALA A 37 2990 4023 4104 488 -40 -69 N ATOM 604 CA ALA A 37 21.179 24.478 9.837 1.00 29.39 C ANISOU 604 CA ALA A 37 3018 4076 4072 470 -73 -60 C ATOM 605 C ALA A 37 21.976 23.313 9.266 1.00 29.38 C ANISOU 605 C ALA A 37 3046 4062 4055 488 -115 -29 C ATOM 606 O ALA A 37 22.873 22.798 9.939 1.00 29.84 O ANISOU 606 O ALA A 37 3109 4144 4084 482 -137 -34 O ATOM 607 CB ALA A 37 19.899 23.972 10.513 1.00 28.64 C ANISOU 607 CB ALA A 37 2928 4003 3951 446 -78 -42 C ATOM 608 H ALA A 37 20.015 25.545 8.636 1.00 35.11 H ATOM 609 HA ALA A 37 21.724 24.906 10.516 1.00 35.27 H ATOM 610 HB1 ALA A 37 20.138 23.321 11.192 1.00 34.37 H ATOM 611 HB2 ALA A 37 19.440 24.723 10.921 1.00 34.37 H ATOM 612 HB3 ALA A 37 19.331 23.559 9.845 1.00 34.37 H ATOM 613 N LEU A 38 21.718 22.932 8.012 1.00 33.45 N ANISOU 613 N LEU A 38 4016 4947 3745 1305 239 758 N ATOM 614 CA LEU A 38 22.354 21.771 7.399 1.00 32.56 C ANISOU 614 CA LEU A 38 3900 4870 3601 1323 329 790 C ATOM 615 C LEU A 38 23.521 22.128 6.480 1.00 34.98 C ANISOU 615 C LEU A 38 4215 5181 3893 1298 373 872 C ATOM 616 O LEU A 38 24.179 21.215 5.963 1.00 37.13 O ANISOU 616 O LEU A 38 4482 5484 4141 1310 450 906 O ATOM 617 CB LEU A 38 21.315 20.966 6.601 1.00 31.49 C ANISOU 617 CB LEU A 38 3818 4728 3418 1363 344 743 C ATOM 618 CG LEU A 38 20.076 20.461 7.353 1.00 30.72 C ANISOU 618 CG LEU A 38 3719 4627 3327 1393 308 658 C ATOM 619 CD1 LEU A 38 19.264 19.493 6.508 1.00 30.57 C ANISOU 619 CD1 LEU A 38 3748 4609 3259 1433 340 621 C ATOM 620 CD2 LEU A 38 20.472 19.807 8.654 1.00 30.35 C ANISOU 620 CD2 LEU A 38 3600 4614 3315 1396 331 645 C ATOM 621 H LEU A 38 21.168 23.338 7.490 1.00 40.14 H ATOM 622 HA LEU A 38 22.697 21.197 8.102 1.00 39.07 H ATOM 623 HB2 LEU A 38 20.997 21.524 5.874 1.00 37.79 H ATOM 624 HB3 LEU A 38 21.759 20.186 6.232 1.00 37.79 H ATOM 625 HG LEU A 38 19.508 21.219 7.564 1.00 36.87 H ATOM 626 HD11 LEU A 38 18.493 19.199 7.019 1.00 36.69 H ATOM 627 HD12 LEU A 38 18.973 19.946 5.701 1.00 36.69 H ATOM 628 HD13 LEU A 38 19.819 18.731 6.280 1.00 36.69 H ATOM 629 HD21 LEU A 38 19.673 19.498 9.108 1.00 36.41 H ATOM 630 HD22 LEU A 38 21.056 19.056 8.464 1.00 36.41 H ATOM 631 HD23 LEU A 38 20.936 20.456 9.205 1.00 36.41 H ATOM 632 N SER A 39 23.799 23.417 6.265 1.00 34.34 N ANISOU 632 N SER A 39 4149 5072 3827 1264 326 906 N ATOM 633 CA SER A 39 24.848 23.847 5.336 1.00 35.54 C ANISOU 633 CA SER A 39 4315 5224 3965 1239 362 984 C ATOM 634 C SER A 39 24.546 23.417 3.899 1.00 34.38 C ANISOU 634 C SER A 39 4233 5069 3762 1260 397 992 C ATOM 635 O SER A 39 25.420 22.942 3.169 1.00 35.13 O ANISOU 635 O SER A 39 4329 5185 3833 1259 466 1046 O ATOM 636 CB SER A 39 26.210 23.324 5.781 1.00 37.71 C ANISOU 636 CB SER A 39 4529 5542 4259 1226 429 1038 C ATOM 637 OG SER A 39 26.431 23.704 7.123 1.00 38.93 O ANISOU 637 OG SER A 39 4624 5703 4465 1208 394 1027 O ATOM 638 H SER A 39 23.390 24.069 6.650 1.00 41.21 H ATOM 639 HA SER A 39 24.890 24.816 5.347 1.00 42.65 H ATOM 640 HB2 SER A 39 26.220 22.357 5.714 1.00 45.26 H ATOM 641 HB3 SER A 39 26.901 23.709 5.219 1.00 45.26 H ATOM 642 HG SER A 39 27.179 23.423 7.382 1.00 46.72 H ATOM 643 N LEU A 40 23.299 23.603 3.483 1.00 33.69 N ANISOU 643 N LEU A 40 4199 4949 3651 1280 349 939 N ATOM 644 CA LEU A 40 22.885 23.360 2.111 1.00 33.96 C ANISOU 644 CA LEU A 40 4300 4970 3634 1298 370 942 C ATOM 645 C LEU A 40 22.320 24.660 1.551 1.00 34.12 C ANISOU 645 C LEU A 40 4373 4942 3649 1280 298 940 C ATOM 646 O LEU A 40 21.978 25.577 2.291 1.00 34.11 O ANISOU 646 O LEU A 40 4359 4918 3683 1262 228 918 O ATOM 647 CB LEU A 40 21.854 22.214 2.041 1.00 33.17 C ANISOU 647 CB LEU A 40 4220 4879 3505 1343 387 876 C ATOM 648 CG LEU A 40 22.428 20.865 2.511 1.00 32.97 C ANISOU 648 CG LEU A 40 4145 4902 3479 1362 465 880 C ATOM 649 CD1 LEU A 40 21.358 19.839 2.782 1.00 32.29 C ANISOU 649 CD1 LEU A 40 4066 4824 3377 1403 468 807 C ATOM 650 CD2 LEU A 40 23.442 20.325 1.486 1.00 33.68 C ANISOU 650 CD2 LEU A 40 4245 5016 3538 1361 547 947 C ATOM 651 H LEU A 40 22.661 23.875 3.991 1.00 40.42 H ATOM 652 HA LEU A 40 23.658 23.109 1.581 1.00 40.75 H ATOM 653 HB2 LEU A 40 21.099 22.433 2.609 1.00 39.80 H ATOM 654 HB3 LEU A 40 21.559 22.110 1.122 1.00 39.80 H ATOM 655 HG LEU A 40 22.907 21.010 3.342 1.00 39.56 H ATOM 656 HD11 LEU A 40 21.779 19.015 3.073 1.00 38.74 H ATOM 657 HD12 LEU A 40 20.770 20.174 3.477 1.00 38.74 H ATOM 658 HD13 LEU A 40 20.855 19.685 1.967 1.00 38.74 H ATOM 659 HD21 LEU A 40 23.790 19.477 1.802 1.00 40.42 H ATOM 660 HD22 LEU A 40 22.995 20.203 0.634 1.00 40.42 H ATOM 661 HD23 LEU A 40 24.166 20.965 1.391 1.00 40.42 H ATOM 662 N THR A 41 22.255 24.765 0.238 1.00 35.78 N ANISOU 662 N THR A 41 4642 5137 3817 1285 314 964 N ATOM 663 CA THR A 41 21.591 25.929 -0.322 1.00 36.84 C ANISOU 663 CA THR A 41 4830 5224 3944 1272 244 955 C ATOM 664 C THR A 41 20.076 25.745 -0.266 1.00 36.66 C ANISOU 664 C THR A 41 4844 5179 3906 1303 195 874 C ATOM 665 O THR A 41 19.554 24.625 -0.194 1.00 33.68 O ANISOU 665 O THR A 41 4466 4821 3510 1338 227 832 O ATOM 666 CB THR A 41 22.024 26.160 -1.767 1.00 38.45 C ANISOU 666 CB THR A 41 5085 5417 4107 1265 276 1010 C ATOM 667 OG1 THR A 41 21.419 25.164 -2.599 1.00 39.46 O ANISOU 667 OG1 THR A 41 5254 5551 4186 1302 316 983 O ATOM 668 CG2 THR A 41 23.548 26.092 -1.899 1.00 38.06 C ANISOU 668 CG2 THR A 41 4999 5396 4067 1240 340 1090 C ATOM 669 H THR A 41 22.572 24.204 -0.332 1.00 42.94 H ATOM 670 HA THR A 41 21.825 26.714 0.198 1.00 44.21 H ATOM 671 HB THR A 41 21.731 27.039 -2.053 1.00 46.14 H ATOM 672 HG1 THR A 41 21.648 25.280 -3.399 1.00 47.35 H ATOM 673 HG21 THR A 41 23.807 26.241 -2.822 1.00 45.68 H ATOM 674 HG22 THR A 41 23.959 26.772 -1.342 1.00 45.68 H ATOM 675 HG23 THR A 41 23.866 25.220 -1.619 1.00 45.68 H ATOM 676 N GLU A 42 19.365 26.869 -0.319 1.00 37.81 N ANISOU 676 N GLU A 42 5022 5282 4060 1290 115 852 N ATOM 677 CA GLU A 42 17.913 26.808 -0.411 1.00 40.04 C ANISOU 677 CA GLU A 42 5348 5539 4327 1318 65 778 C ATOM 678 C GLU A 42 17.475 25.981 -1.603 1.00 37.54 C ANISOU 678 C GLU A 42 5085 5224 3953 1350 109 769 C ATOM 679 O GLU A 42 16.473 25.261 -1.527 1.00 35.15 O ANISOU 679 O GLU A 42 4798 4922 3633 1384 104 706 O ATOM 680 CB GLU A 42 17.319 28.206 -0.523 1.00 43.97 C ANISOU 680 CB GLU A 42 5882 5989 4836 1298 -22 767 C ATOM 681 CG GLU A 42 17.399 29.005 0.729 1.00 50.86 C ANISOU 681 CG GLU A 42 6707 6854 5764 1272 -79 755 C ATOM 682 CD GLU A 42 16.366 30.100 0.734 1.00 59.89 C ANISOU 682 CD GLU A 42 7890 7951 6915 1266 -170 715 C ATOM 683 OE1 GLU A 42 15.157 29.776 0.873 1.00 63.07 O ANISOU 683 OE1 GLU A 42 8316 8340 7306 1294 -203 646 O ATOM 684 OE2 GLU A 42 16.760 31.277 0.566 1.00 62.95 O ANISOU 684 OE2 GLU A 42 8287 8314 7318 1233 -207 753 O ATOM 685 H GLU A 42 19.693 27.663 -0.304 1.00 45.37 H ATOM 686 HA GLU A 42 17.560 26.393 0.392 1.00 48.05 H ATOM 687 HB2 GLU A 42 17.795 28.692 -1.214 1.00 52.77 H ATOM 688 HB3 GLU A 42 16.382 28.128 -0.763 1.00 52.77 H ATOM 689 HG2 GLU A 42 17.236 28.427 1.491 1.00 61.03 H ATOM 690 HG3 GLU A 42 18.277 29.412 0.795 1.00 61.03 H ATOM 691 N ARG A 43 18.202 26.088 -2.717 1.00 38.13 N ANISOU 691 N ARG A 43 5188 5300 3999 1340 152 830 N ATOM 692 CA ARG A 43 17.828 25.357 -3.928 1.00 39.50 C ANISOU 692 CA ARG A 43 5416 5474 4117 1368 194 826 C ATOM 693 C ARG A 43 17.971 23.850 -3.731 1.00 38.46 C ANISOU 693 C ARG A 43 5256 5385 3971 1399 267 811 C ATOM 694 O ARG A 43 17.117 23.073 -4.172 1.00 35.86 O ANISOU 694 O ARG A 43 4960 5056 3608 1434 279 765 O ATOM 695 CB ARG A 43 18.676 25.839 -5.102 1.00 43.77 C ANISOU 695 CB ARG A 43 5989 6009 4633 1348 224 900 C ATOM 696 CG ARG A 43 18.512 25.019 -6.359 1.00 50.84 C ANISOU 696 CG ARG A 43 6933 6911 5472 1375 280 906 C ATOM 697 CD ARG A 43 18.901 25.809 -7.606 1.00 59.40 C ANISOU 697 CD ARG A 43 8069 7971 6529 1356 280 961 C ATOM 698 NE ARG A 43 18.556 25.091 -8.838 1.00 66.67 N ANISOU 698 NE ARG A 43 9044 8894 7394 1384 323 959 N ATOM 699 CZ ARG A 43 19.354 24.216 -9.450 1.00 74.04 C ANISOU 699 CZ ARG A 43 9973 9859 8302 1392 406 1002 C ATOM 700 NH1 ARG A 43 20.563 23.943 -8.956 1.00 75.91 N ANISOU 700 NH1 ARG A 43 10153 10128 8562 1374 456 1051 N ATOM 701 NH2 ARG A 43 18.940 23.606 -10.559 1.00 76.71 N ANISOU 701 NH2 ARG A 43 10363 10195 8589 1418 439 995 N ATOM 702 H ARG A 43 18.908 26.572 -2.797 1.00 45.75 H ATOM 703 HA ARG A 43 16.899 25.544 -4.134 1.00 47.40 H ATOM 704 HB2 ARG A 43 18.427 26.753 -5.312 1.00 52.53 H ATOM 705 HB3 ARG A 43 19.611 25.805 -4.846 1.00 52.53 H ATOM 706 HG2 ARG A 43 19.084 24.236 -6.306 1.00 61.00 H ATOM 707 HG3 ARG A 43 17.584 24.750 -6.447 1.00 61.00 H ATOM 708 HD2 ARG A 43 18.428 26.656 -7.607 1.00 71.28 H ATOM 709 HD3 ARG A 43 19.859 25.961 -7.602 1.00 71.28 H ATOM 710 HE ARG A 43 17.786 25.245 -9.190 1.00 80.01 H ATOM 711 HH11 ARG A 43 20.833 24.332 -8.238 1.00 91.09 H ATOM 712 HH12 ARG A 43 21.074 23.378 -9.357 1.00 91.09 H ATOM 713 HH21 ARG A 43 18.162 23.781 -10.882 1.00 92.05 H ATOM 714 HH22 ARG A 43 19.454 23.045 -10.959 1.00 92.05 H ATOM 715 N GLN A 44 19.028 23.419 -3.045 1.00 30.09 N ANISOU 715 N GLN A 44 4485 3868 3081 659 -221 512 N ATOM 716 CA GLN A 44 19.171 22.000 -2.725 1.00 30.83 C ANISOU 716 CA GLN A 44 4502 3994 3218 641 -241 491 C ATOM 717 C GLN A 44 18.026 21.521 -1.838 1.00 29.33 C ANISOU 717 C GLN A 44 4225 3804 3115 651 -276 481 C ATOM 718 O GLN A 44 17.447 20.455 -2.080 1.00 27.89 O ANISOU 718 O GLN A 44 3994 3633 2971 673 -334 461 O ATOM 719 CB GLN A 44 20.516 21.755 -2.046 1.00 30.85 C ANISOU 719 CB GLN A 44 4490 4025 3207 577 -171 494 C ATOM 720 CG GLN A 44 21.707 21.939 -2.972 1.00 32.37 C ANISOU 720 CG GLN A 44 4758 4224 3317 564 -141 499 C ATOM 721 CD GLN A 44 23.008 21.761 -2.225 1.00 35.04 C ANISOU 721 CD GLN A 44 5080 4590 3643 500 -69 503 C ATOM 722 OE1 GLN A 44 23.334 22.557 -1.350 1.00 36.39 O ANISOU 722 OE1 GLN A 44 5253 4756 3817 468 -12 519 O ATOM 723 NE2 GLN A 44 23.731 20.681 -2.521 1.00 36.16 N ANISOU 723 NE2 GLN A 44 5202 4762 3776 482 -73 487 N ATOM 724 H GLN A 44 19.667 23.918 -2.758 1.00 36.11 H ATOM 725 HA GLN A 44 19.150 21.486 -3.547 1.00 36.99 H ATOM 726 HB2 GLN A 44 20.613 22.378 -1.309 1.00 37.02 H ATOM 727 HB3 GLN A 44 20.537 20.844 -1.713 1.00 37.02 H ATOM 728 HG2 GLN A 44 21.669 21.278 -3.680 1.00 38.84 H ATOM 729 HG3 GLN A 44 21.688 22.834 -3.345 1.00 38.84 H ATOM 730 HE21 GLN A 44 23.450 20.124 -3.113 1.00 43.39 H ATOM 731 HE22 GLN A 44 24.479 20.540 -2.119 1.00 43.39 H ATOM 732 N ILE A 45 17.666 22.312 -0.826 1.00 27.91 N ANISOU 732 N ILE A 45 4027 3611 2967 637 -244 495 N ATOM 733 CA ILE A 45 16.552 21.949 0.045 1.00 28.33 C ANISOU 733 CA ILE A 45 4000 3662 3102 648 -276 487 C ATOM 734 C ILE A 45 15.268 21.864 -0.768 1.00 29.11 C ANISOU 734 C ILE A 45 4106 3739 3216 712 -356 478 C ATOM 735 O ILE A 45 14.462 20.942 -0.608 1.00 28.06 O ANISOU 735 O ILE A 45 3907 3614 3141 730 -408 460 O ATOM 736 CB ILE A 45 16.414 22.967 1.204 1.00 27.56 C ANISOU 736 CB ILE A 45 3892 3550 3028 623 -225 505 C ATOM 737 CG1 ILE A 45 17.686 23.069 2.054 1.00 28.36 C ANISOU 737 CG1 ILE A 45 3986 3674 3116 558 -145 514 C ATOM 738 CG2 ILE A 45 15.240 22.601 2.120 1.00 25.92 C ANISOU 738 CG2 ILE A 45 3601 3341 2907 634 -259 497 C ATOM 739 CD1 ILE A 45 18.082 21.773 2.750 1.00 29.24 C ANISOU 739 CD1 ILE A 45 4015 3822 3274 521 -140 498 C ATOM 740 H ILE A 45 18.047 23.057 -0.625 1.00 33.49 H ATOM 741 HA ILE A 45 16.722 21.076 0.431 1.00 33.99 H ATOM 742 HB ILE A 45 16.237 23.840 0.819 1.00 33.07 H ATOM 743 HG12 ILE A 45 18.422 23.333 1.481 1.00 34.03 H ATOM 744 HG13 ILE A 45 17.548 23.741 2.740 1.00 34.03 H ATOM 745 HG21 ILE A 45 15.181 23.256 2.833 1.00 31.10 H ATOM 746 HG22 ILE A 45 14.421 22.602 1.600 1.00 31.10 H ATOM 747 HG23 ILE A 45 15.395 21.719 2.493 1.00 31.10 H ATOM 748 HD11 ILE A 45 18.891 21.925 3.262 1.00 35.09 H ATOM 749 HD12 ILE A 45 17.362 21.499 3.340 1.00 35.09 H ATOM 750 HD13 ILE A 45 18.238 21.090 2.079 1.00 35.09 H ATOM 751 N LYS A 46 15.061 22.832 -1.650 1.00 30.63 N ANISOU 751 N LYS A 46 4379 3903 3357 748 -366 490 N ATOM 752 CA LYS A 46 13.903 22.808 -2.530 1.00 33.42 C ANISOU 752 CA LYS A 46 4747 4235 3717 810 -440 482 C ATOM 753 C LYS A 46 13.888 21.551 -3.396 1.00 31.46 C ANISOU 753 C LYS A 46 4481 4005 3467 831 -495 459 C ATOM 754 O LYS A 46 12.844 20.903 -3.545 1.00 31.22 O ANISOU 754 O LYS A 46 4407 3973 3484 866 -560 444 O ATOM 755 CB LYS A 46 13.904 24.079 -3.389 1.00 38.53 C ANISOU 755 CB LYS A 46 5492 4850 4298 840 -434 500 C ATOM 756 CG LYS A 46 12.734 24.210 -4.337 1.00 46.99 C ANISOU 756 CG LYS A 46 6588 5896 5369 906 -507 494 C ATOM 757 CD LYS A 46 12.822 25.525 -5.141 1.00 55.24 C ANISOU 757 CD LYS A 46 7733 6911 6346 931 -494 514 C ATOM 758 CE LYS A 46 13.265 25.286 -6.569 1.00 61.12 C ANISOU 758 CE LYS A 46 8542 7656 7025 956 -520 508 C ATOM 759 NZ LYS A 46 12.103 24.917 -7.440 1.00 65.03 N ANISOU 759 NZ LYS A 46 9036 8137 7536 1018 -603 495 N ATOM 760 H LYS A 46 15.575 23.513 -1.759 1.00 36.76 H ATOM 761 HA LYS A 46 13.097 22.810 -1.992 1.00 40.11 H ATOM 762 HB2 LYS A 46 13.890 24.849 -2.799 1.00 46.24 H ATOM 763 HB3 LYS A 46 14.715 24.091 -3.921 1.00 46.24 H ATOM 764 HG2 LYS A 46 12.741 23.468 -4.963 1.00 56.38 H ATOM 765 HG3 LYS A 46 11.907 24.216 -3.830 1.00 56.38 H ATOM 766 HD2 LYS A 46 11.948 25.946 -5.162 1.00 66.29 H ATOM 767 HD3 LYS A 46 13.467 26.115 -4.719 1.00 66.29 H ATOM 768 HE2 LYS A 46 13.666 26.096 -6.921 1.00 73.35 H ATOM 769 HE3 LYS A 46 13.905 24.557 -6.589 1.00 73.35 H ATOM 770 HZ1 LYS A 46 12.380 24.780 -8.274 1.00 78.04 H ATOM 771 HZ2 LYS A 46 11.719 24.173 -7.136 1.00 78.04 H ATOM 772 HZ3 LYS A 46 11.502 25.574 -7.438 1.00 78.04 H ATOM 773 N ILE A 47 15.035 21.181 -3.969 1.00 30.40 N ANISOU 773 N ILE A 47 4381 3890 3281 808 -471 457 N ATOM 774 CA ILE A 47 15.083 19.993 -4.819 1.00 29.88 C ANISOU 774 CA ILE A 47 4302 3842 3210 826 -522 436 C ATOM 775 C ILE A 47 14.942 18.702 -3.992 1.00 28.31 C ANISOU 775 C ILE A 47 4003 3673 3081 802 -536 417 C ATOM 776 O ILE A 47 14.299 17.735 -4.433 1.00 27.09 O ANISOU 776 O ILE A 47 3812 3525 2956 832 -598 397 O ATOM 777 CB ILE A 47 16.368 20.031 -5.670 1.00 31.93 C ANISOU 777 CB ILE A 47 4629 4112 3390 809 -490 439 C ATOM 778 CG1 ILE A 47 16.303 21.215 -6.654 1.00 35.90 C ANISOU 778 CG1 ILE A 47 5229 4584 3826 843 -491 455 C ATOM 779 CG2 ILE A 47 16.551 18.738 -6.460 1.00 31.77 C ANISOU 779 CG2 ILE A 47 4591 4116 3366 820 -535 417 C ATOM 780 CD1 ILE A 47 17.650 21.584 -7.240 1.00 37.75 C ANISOU 780 CD1 ILE A 47 5536 4825 3981 817 -441 465 C ATOM 781 H ILE A 47 15.785 21.593 -3.883 1.00 36.48 H ATOM 782 HA ILE A 47 14.331 20.026 -5.431 1.00 35.86 H ATOM 783 HB ILE A 47 17.131 20.151 -5.083 1.00 38.31 H ATOM 784 HG12 ILE A 47 15.713 20.982 -7.388 1.00 43.08 H ATOM 785 HG13 ILE A 47 15.958 21.992 -6.188 1.00 43.08 H ATOM 786 HG21 ILE A 47 17.367 18.799 -6.981 1.00 38.13 H ATOM 787 HG22 ILE A 47 16.609 17.995 -5.839 1.00 38.13 H ATOM 788 HG23 ILE A 47 15.790 18.618 -7.049 1.00 38.13 H ATOM 789 HD11 ILE A 47 17.536 22.332 -7.847 1.00 45.30 H ATOM 790 HD12 ILE A 47 18.250 21.830 -6.519 1.00 45.30 H ATOM 791 HD13 ILE A 47 18.005 20.819 -7.720 1.00 45.30 H ATOM 792 N TRP A 48 15.484 18.665 -2.777 1.00 27.10 N ANISOU 792 N TRP A 48 3803 3536 2957 750 -479 422 N ATOM 793 CA TRP A 48 15.326 17.464 -1.957 1.00 27.02 C ANISOU 793 CA TRP A 48 3698 3553 3015 728 -492 405 C ATOM 794 C TRP A 48 13.846 17.184 -1.693 1.00 27.37 C ANISOU 794 C TRP A 48 3687 3585 3129 767 -554 394 C ATOM 795 O TRP A 48 13.377 16.047 -1.841 1.00 25.86 O ANISOU 795 O TRP A 48 3442 3408 2977 782 -605 374 O ATOM 796 CB TRP A 48 16.105 17.601 -0.634 1.00 24.59 C ANISOU 796 CB TRP A 48 3352 3262 2727 666 -419 414 C ATOM 797 CG TRP A 48 16.082 16.288 0.152 1.00 24.15 C ANISOU 797 CG TRP A 48 3201 3237 2736 640 -429 396 C ATOM 798 CD1 TRP A 48 17.031 15.328 0.143 1.00 23.85 C ANISOU 798 CD1 TRP A 48 3140 3231 2689 606 -412 384 C ATOM 799 CD2 TRP A 48 15.044 15.816 1.022 1.00 23.98 C ANISOU 799 CD2 TRP A 48 3097 3217 2797 647 -460 386 C ATOM 800 NE1 TRP A 48 16.660 14.290 0.956 1.00 23.50 N ANISOU 800 NE1 TRP A 48 3006 3208 2716 592 -430 369 N ATOM 801 CE2 TRP A 48 15.439 14.562 1.499 1.00 23.58 C ANISOU 801 CE2 TRP A 48 2977 3199 2783 616 -460 370 C ATOM 802 CE3 TRP A 48 13.831 16.342 1.458 1.00 25.28 C ANISOU 802 CE3 TRP A 48 3239 3358 3007 675 -486 391 C ATOM 803 CZ2 TRP A 48 14.660 13.815 2.380 1.00 23.84 C ANISOU 803 CZ2 TRP A 48 2920 3242 2896 613 -486 357 C ATOM 804 CZ3 TRP A 48 13.056 15.597 2.326 1.00 25.14 C ANISOU 804 CZ3 TRP A 48 3132 3350 3069 673 -513 378 C ATOM 805 CH2 TRP A 48 13.472 14.351 2.775 1.00 24.30 C ANISOU 805 CH2 TRP A 48 2959 3277 2997 642 -512 362 C ATOM 806 H TRP A 48 15.935 19.300 -2.412 1.00 32.52 H ATOM 807 HA TRP A 48 15.690 16.705 -2.440 1.00 32.42 H ATOM 808 HB2 TRP A 48 17.029 17.826 -0.827 1.00 29.50 H ATOM 809 HB3 TRP A 48 15.696 18.291 -0.089 1.00 29.50 H ATOM 810 HD1 TRP A 48 17.819 15.363 -0.349 1.00 28.62 H ATOM 811 HE1 TRP A 48 17.115 13.572 1.086 1.00 28.20 H ATOM 812 HE3 TRP A 48 13.535 17.168 1.148 1.00 30.33 H ATOM 813 HZ2 TRP A 48 14.945 12.987 2.693 1.00 28.61 H ATOM 814 HZ3 TRP A 48 12.238 15.935 2.611 1.00 30.16 H ATOM 815 HH2 TRP A 48 12.934 13.878 3.369 1.00 29.16 H ATOM 816 N PHE A 49 13.090 18.223 -1.308 1.00 26.22 N ANISOU 816 N PHE A 49 3553 3410 2997 784 -551 409 N ATOM 817 CA PHE A 49 11.664 18.054 -1.050 1.00 27.76 C ANISOU 817 CA PHE A 49 3699 3592 3256 822 -608 400 C ATOM 818 C PHE A 49 10.897 17.667 -2.320 1.00 29.83 C ANISOU 818 C PHE A 49 3986 3843 3506 882 -685 387 C ATOM 819 O PHE A 49 9.962 16.859 -2.267 1.00 29.43 O ANISOU 819 O PHE A 49 3876 3795 3509 907 -743 370 O ATOM 820 CB PHE A 49 11.090 19.329 -0.416 1.00 27.51 C ANISOU 820 CB PHE A 49 3683 3532 3236 828 -584 420 C ATOM 821 CG PHE A 49 11.169 19.311 1.072 1.00 27.37 C ANISOU 821 CG PHE A 49 3598 3526 3274 783 -539 424 C ATOM 822 CD1 PHE A 49 12.349 19.620 1.701 1.00 26.79 C ANISOU 822 CD1 PHE A 49 3535 3467 3176 729 -464 437 C ATOM 823 CD2 PHE A 49 10.088 18.891 1.840 1.00 28.03 C ANISOU 823 CD2 PHE A 49 3605 3610 3437 795 -574 415 C ATOM 824 CE1 PHE A 49 12.457 19.550 3.076 1.00 26.31 C ANISOU 824 CE1 PHE A 49 3410 3418 3167 686 -423 440 C ATOM 825 CE2 PHE A 49 10.185 18.842 3.220 1.00 28.39 C ANISOU 825 CE2 PHE A 49 3587 3666 3533 752 -532 419 C ATOM 826 CZ PHE A 49 11.373 19.177 3.831 1.00 27.03 C ANISOU 826 CZ PHE A 49 3428 3509 3335 698 -457 431 C ATOM 827 H PHE A 49 13.380 19.024 -1.192 1.00 31.46 H ATOM 828 HA PHE A 49 11.551 17.333 -0.410 1.00 33.31 H ATOM 829 HB2 PHE A 49 11.592 20.095 -0.734 1.00 33.01 H ATOM 830 HB3 PHE A 49 10.157 19.415 -0.666 1.00 33.01 H ATOM 831 HD1 PHE A 49 13.085 19.877 1.195 1.00 32.14 H ATOM 832 HD2 PHE A 49 9.285 18.671 1.426 1.00 33.64 H ATOM 833 HE1 PHE A 49 13.255 19.785 3.492 1.00 31.57 H ATOM 834 HE2 PHE A 49 9.455 18.579 3.731 1.00 34.06 H ATOM 835 HZ PHE A 49 11.444 19.140 4.757 1.00 32.44 H ATOM 836 N GLN A 50 11.270 18.222 -3.464 1.00 30.91 N ANISOU 836 N GLN A 50 4208 3966 3571 904 -688 394 N ATOM 837 CA GLN A 50 10.618 17.820 -4.705 1.00 34.97 C ANISOU 837 CA GLN A 50 4747 4470 4069 959 -760 381 C ATOM 838 C GLN A 50 10.869 16.343 -4.999 1.00 35.99 C ANISOU 838 C GLN A 50 4829 4630 4216 953 -793 357 C ATOM 839 O GLN A 50 9.929 15.576 -5.247 1.00 36.56 O ANISOU 839 O GLN A 50 4858 4703 4331 988 -858 339 O ATOM 840 CB GLN A 50 11.103 18.696 -5.862 1.00 40.58 C ANISOU 840 CB GLN A 50 5561 5162 4695 980 -751 394 C ATOM 841 CG GLN A 50 10.273 18.559 -7.120 1.00 47.63 C ANISOU 841 CG GLN A 50 6487 6039 5571 1043 -825 384 C ATOM 842 CD GLN A 50 8.804 18.902 -6.897 1.00 53.26 C ANISOU 842 CD GLN A 50 7175 6728 6335 1086 -873 383 C ATOM 843 OE1 GLN A 50 8.468 20.053 -6.615 1.00 56.84 O ANISOU 843 OE1 GLN A 50 7660 7156 6781 1094 -852 401 O ATOM 844 NE2 GLN A 50 7.925 17.901 -7.002 1.00 52.66 N ANISOU 844 NE2 GLN A 50 7039 6660 6311 1113 -938 362 N ATOM 845 H GLN A 50 11.884 18.818 -3.551 1.00 37.09 H ATOM 846 HA GLN A 50 9.661 17.949 -4.614 1.00 41.96 H ATOM 847 HB2 GLN A 50 11.071 19.625 -5.586 1.00 48.69 H ATOM 848 HB3 GLN A 50 12.015 18.448 -6.080 1.00 48.69 H ATOM 849 HG2 GLN A 50 10.623 19.160 -7.796 1.00 57.15 H ATOM 850 HG3 GLN A 50 10.323 17.642 -7.434 1.00 57.15 H ATOM 851 HE21 GLN A 50 8.198 17.107 -7.187 1.00 63.20 H ATOM 852 HE22 GLN A 50 7.086 18.050 -6.883 1.00 63.20 H ATOM 853 N ASN A 51 12.135 15.921 -4.970 1.00 36.31 N ANISOU 853 N ASN A 51 4876 4696 4225 910 -749 356 N ATOM 854 CA ASN A 51 12.437 14.496 -5.146 1.00 34.44 C ANISOU 854 CA ASN A 51 4590 4490 4007 900 -775 334 C ATOM 855 C ASN A 51 11.728 13.655 -4.100 1.00 32.82 C ANISOU 855 C ASN A 51 4284 4298 3888 889 -795 321 C ATOM 856 O ASN A 51 11.223 12.569 -4.405 1.00 33.21 O ANISOU 856 O ASN A 51 4288 4360 3972 910 -851 300 O ATOM 857 CB ASN A 51 13.945 14.242 -5.098 1.00 32.02 C ANISOU 857 CB ASN A 51 4301 4208 3656 849 -715 337 C ATOM 858 CG ASN A 51 14.663 14.809 -6.309 1.00 33.00 C ANISOU 858 CG ASN A 51 4522 4323 3694 862 -705 346 C ATOM 859 OD1 ASN A 51 14.105 14.838 -7.405 1.00 34.65 O ANISOU 859 OD1 ASN A 51 4771 4517 3879 912 -759 341 O ATOM 860 ND2 ASN A 51 15.882 15.288 -6.115 1.00 31.98 N ANISOU 860 ND2 ASN A 51 4431 4202 3517 819 -637 360 N ATOM 861 H ASN A 51 12.823 16.424 -4.852 1.00 43.58 H ATOM 862 HA ASN A 51 12.117 14.215 -6.018 1.00 41.33 H ATOM 863 HB2 ASN A 51 14.313 14.662 -4.305 1.00 38.42 H ATOM 864 HB3 ASN A 51 14.105 13.285 -5.073 1.00 38.42 H ATOM 865 HD21 ASN A 51 16.324 15.619 -6.775 1.00 38.37 H ATOM 866 HD22 ASN A 51 16.232 15.267 -5.330 1.00 38.37 H ATOM 867 N ARG A 52 11.641 14.152 -2.863 1.00 35.63 N ANISOU 867 N ARG A 52 5237 3550 4749 146 -1654 -115 N ATOM 868 CA ARG A 52 11.062 13.327 -1.810 1.00 33.12 C ANISOU 868 CA ARG A 52 4963 3160 4462 88 -1683 -103 C ATOM 869 C ARG A 52 9.563 13.164 -2.011 1.00 32.92 C ANISOU 869 C ARG A 52 4897 3154 4459 75 -1667 -60 C ATOM 870 O ARG A 52 9.004 12.090 -1.742 1.00 32.70 O ANISOU 870 O ARG A 52 4875 3092 4457 43 -1728 -72 O ATOM 871 CB ARG A 52 11.373 13.922 -0.431 1.00 33.05 C ANISOU 871 CB ARG A 52 5026 3082 4450 49 -1622 -70 C ATOM 872 CG ARG A 52 10.813 13.116 0.729 1.00 33.43 C ANISOU 872 CG ARG A 52 5123 3052 4528 -12 -1648 -56 C ATOM 873 CD ARG A 52 11.485 11.731 0.769 1.00 33.27 C ANISOU 873 CD ARG A 52 5125 2996 4520 -24 -1760 -123 C ATOM 874 NE ARG A 52 11.018 10.844 1.834 1.00 32.79 N ANISOU 874 NE ARG A 52 5112 2860 4488 -82 -1795 -117 N ATOM 875 CZ ARG A 52 9.953 10.043 1.762 1.00 34.51 C ANISOU 875 CZ ARG A 52 5307 3072 4732 -104 -1831 -108 C ATOM 876 NH1 ARG A 52 9.165 10.042 0.684 1.00 33.67 N ANISOU 876 NH1 ARG A 52 5131 3034 4629 -74 -1834 -100 N ATOM 877 NH2 ARG A 52 9.659 9.255 2.800 1.00 35.22 N ANISOU 877 NH2 ARG A 52 5446 3089 4847 -157 -1863 -105 N ATOM 878 H ARG A 52 11.901 14.935 -2.618 1.00 42.75 H ATOM 879 HA ARG A 52 11.463 12.445 -1.848 1.00 39.75 H ATOM 880 HB2 ARG A 52 12.335 13.970 -0.321 1.00 39.66 H ATOM 881 HB3 ARG A 52 10.992 14.813 -0.382 1.00 39.66 H ATOM 882 HG2 ARG A 52 10.999 13.574 1.564 1.00 40.12 H ATOM 883 HG3 ARG A 52 9.859 12.994 0.611 1.00 40.12 H ATOM 884 HD2 ARG A 52 11.321 11.284 -0.076 1.00 39.92 H ATOM 885 HD3 ARG A 52 12.440 11.855 0.890 1.00 39.92 H ATOM 886 HE ARG A 52 11.466 10.838 2.568 1.00 39.35 H ATOM 887 HH11 ARG A 52 9.356 10.543 0.011 1.00 40.41 H ATOM 888 HH12 ARG A 52 8.477 9.527 0.655 1.00 40.41 H ATOM 889 HH21 ARG A 52 10.157 9.263 3.501 1.00 42.27 H ATOM 890 HH22 ARG A 52 8.962 8.751 2.773 1.00 42.27 H ATOM 891 N ARG A 53 8.893 14.234 -2.449 1.00 34.24 N ANISOU 891 N ARG A 53 5023 3372 4615 98 -1585 -10 N ATOM 892 CA ARG A 53 7.470 14.165 -2.757 1.00 34.67 C ANISOU 892 CA ARG A 53 5032 3452 4687 91 -1566 30 C ATOM 893 C ARG A 53 7.194 13.229 -3.923 1.00 36.90 C ANISOU 893 C ARG A 53 5256 3785 4979 118 -1648 -12 C ATOM 894 O ARG A 53 6.197 12.507 -3.911 1.00 38.35 O ANISOU 894 O ARG A 53 5422 3960 5189 95 -1679 -1 O ATOM 895 CB ARG A 53 6.918 15.555 -3.079 1.00 32.55 C ANISOU 895 CB ARG A 53 4731 3234 4403 117 -1461 89 C ATOM 896 CG ARG A 53 6.766 16.474 -1.862 1.00 31.44 C ANISOU 896 CG ARG A 53 4642 3044 4260 82 -1371 146 C ATOM 897 CD ARG A 53 5.892 17.670 -2.220 1.00 31.32 C ANISOU 897 CD ARG A 53 4586 3080 4236 102 -1274 208 C ATOM 898 NE ARG A 53 6.545 18.566 -3.176 1.00 31.14 N ANISOU 898 NE ARG A 53 4526 3124 4180 159 -1240 198 N ATOM 899 CZ ARG A 53 7.330 19.587 -2.840 1.00 30.82 C ANISOU 899 CZ ARG A 53 4515 3079 4116 170 -1176 211 C ATOM 900 NH1 ARG A 53 7.563 19.860 -1.576 1.00 30.66 N ANISOU 900 NH1 ARG A 53 4559 2990 4098 129 -1139 235 N ATOM 901 NH2 ARG A 53 7.861 20.372 -3.779 1.00 31.83 N ANISOU 901 NH2 ARG A 53 4605 3273 4217 223 -1147 202 N ATOM 902 H ARG A 53 9.243 15.010 -2.574 1.00 41.09 H ATOM 903 HA ARG A 53 6.996 13.826 -1.981 1.00 41.60 H ATOM 904 HB2 ARG A 53 7.519 15.991 -3.704 1.00 39.06 H ATOM 905 HB3 ARG A 53 6.042 15.455 -3.484 1.00 39.06 H ATOM 906 HG2 ARG A 53 6.343 15.987 -1.138 1.00 37.73 H ATOM 907 HG3 ARG A 53 7.639 16.799 -1.590 1.00 37.73 H ATOM 908 HD2 ARG A 53 5.067 17.353 -2.619 1.00 37.59 H ATOM 909 HD3 ARG A 53 5.700 18.176 -1.415 1.00 37.59 H ATOM 910 HE ARG A 53 6.413 18.423 -4.013 1.00 37.36 H ATOM 911 HH11 ARG A 53 7.218 19.369 -0.960 1.00 36.79 H ATOM 912 HH12 ARG A 53 8.069 20.523 -1.366 1.00 36.79 H ATOM 913 HH21 ARG A 53 7.718 20.206 -4.610 1.00 38.20 H ATOM 914 HH22 ARG A 53 8.371 21.027 -3.553 1.00 38.20 H ATOM 915 N MET A 54 8.027 13.276 -4.966 1.00 39.66 N ANISOU 915 N MET A 54 5572 4189 5307 168 -1680 -57 N ATOM 916 CA MET A 54 7.875 12.349 -6.082 1.00 43.82 C ANISOU 916 CA MET A 54 6045 4762 5841 195 -1763 -102 C ATOM 917 C MET A 54 8.053 10.906 -5.626 1.00 42.81 C ANISOU 917 C MET A 54 5949 4577 5738 160 -1862 -147 C ATOM 918 O MET A 54 7.351 10.011 -6.100 1.00 42.61 O ANISOU 918 O MET A 54 5891 4567 5733 156 -1920 -161 O ATOM 919 CB MET A 54 8.870 12.694 -7.193 1.00 49.42 C ANISOU 919 CB MET A 54 6720 5535 6522 254 -1778 -145 C ATOM 920 CG MET A 54 8.659 14.077 -7.843 1.00 55.96 C ANISOU 920 CG MET A 54 7507 6430 7327 296 -1687 -104 C ATOM 921 SD MET A 54 6.995 14.364 -8.510 1.00 62.86 S ANISOU 921 SD MET A 54 8311 7359 8214 305 -1644 -50 S ATOM 922 CE MET A 54 6.085 14.993 -7.093 1.00 63.75 C ANISOU 922 CE MET A 54 8471 7410 8341 249 -1556 27 C ATOM 923 H MET A 54 8.680 13.829 -5.049 1.00 47.59 H ATOM 924 HA MET A 54 6.982 12.450 -6.447 1.00 52.58 H ATOM 925 HB2 MET A 54 9.766 12.678 -6.821 1.00 59.30 H ATOM 926 HB3 MET A 54 8.795 12.027 -7.893 1.00 59.30 H ATOM 927 HG2 MET A 54 8.828 14.761 -7.176 1.00 67.16 H ATOM 928 HG3 MET A 54 9.288 14.173 -8.574 1.00 67.16 H ATOM 929 HE1 MET A 54 5.171 15.177 -7.361 1.00 76.50 H ATOM 930 HE2 MET A 54 6.096 14.325 -6.389 1.00 76.50 H ATOM 931 HE3 MET A 54 6.509 15.808 -6.782 1.00 76.50 H ATOM 932 N LYS A 55 8.971 10.660 -4.692 1.00 43.67 N ANISOU 932 N LYS A 55 6125 4621 5845 133 -1882 -170 N ATOM 933 CA LYS A 55 9.091 9.324 -4.114 1.00 45.88 C ANISOU 933 CA LYS A 55 6442 4840 6149 93 -1969 -207 C ATOM 934 C LYS A 55 7.921 9.015 -3.194 1.00 41.42 C ANISOU 934 C LYS A 55 5899 4225 5613 40 -1951 -161 C ATOM 935 O LYS A 55 7.511 7.852 -3.083 1.00 43.07 O ANISOU 935 O LYS A 55 6110 4407 5847 14 -2023 -183 O ATOM 936 CB LYS A 55 10.412 9.194 -3.357 1.00 52.49 C ANISOU 936 CB LYS A 55 7346 5623 6976 80 -1992 -243 C ATOM 937 CG LYS A 55 10.583 7.914 -2.563 1.00 58.52 C ANISOU 937 CG LYS A 55 8158 6314 7763 34 -2073 -276 C ATOM 938 CD LYS A 55 11.836 7.994 -1.714 1.00 63.72 C ANISOU 938 CD LYS A 55 8885 6917 8410 20 -2078 -302 C ATOM 939 CE LYS A 55 12.357 6.621 -1.328 1.00 68.77 C ANISOU 939 CE LYS A 55 9561 7503 9066 -8 -2180 -357 C ATOM 940 NZ LYS A 55 13.656 6.699 -0.598 1.00 70.61 N ANISOU 940 NZ LYS A 55 9857 7687 9285 -17 -2189 -386 N ATOM 941 H LYS A 55 9.527 11.239 -4.381 1.00 52.40 H ATOM 942 HA LYS A 55 9.090 8.670 -4.830 1.00 55.05 H ATOM 943 HB2 LYS A 55 11.139 9.238 -3.998 1.00 62.99 H ATOM 944 HB3 LYS A 55 10.484 9.934 -2.735 1.00 62.99 H ATOM 945 HG2 LYS A 55 9.821 7.792 -1.976 1.00 70.23 H ATOM 946 HG3 LYS A 55 10.669 7.164 -3.170 1.00 70.23 H ATOM 947 HD2 LYS A 55 12.531 8.450 -2.215 1.00 76.47 H ATOM 948 HD3 LYS A 55 11.638 8.482 -0.900 1.00 76.47 H ATOM 949 HE2 LYS A 55 11.711 6.187 -0.749 1.00 82.52 H ATOM 950 HE3 LYS A 55 12.493 6.094 -2.131 1.00 82.52 H ATOM 951 HZ1 LYS A 55 13.935 5.881 -0.385 1.00 84.74 H ATOM 952 HZ2 LYS A 55 14.269 7.090 -1.111 1.00 84.74 H ATOM 953 HZ3 LYS A 55 13.557 7.174 0.148 1.00 84.74 H ATOM 954 N TRP A 56 7.368 10.024 -2.532 1.00 63.50 N ANISOU 954 N TRP A 56 7749 6679 9699 -1198 -472 377 N ATOM 955 CA TRP A 56 6.197 9.783 -1.705 1.00 63.69 C ANISOU 955 CA TRP A 56 7761 6744 9694 -1200 -463 375 C ATOM 956 C TRP A 56 5.006 9.371 -2.565 1.00 63.84 C ANISOU 956 C TRP A 56 7762 6798 9694 -1240 -440 347 C ATOM 957 O TRP A 56 4.220 8.501 -2.174 1.00 64.05 O ANISOU 957 O TRP A 56 7784 6840 9713 -1263 -410 345 O ATOM 958 CB TRP A 56 5.875 11.031 -0.882 1.00 63.58 C ANISOU 958 CB TRP A 56 7742 6765 9652 -1155 -508 379 C ATOM 959 CG TRP A 56 4.760 10.832 0.082 1.00 63.77 C ANISOU 959 CG TRP A 56 7754 6827 9647 -1152 -501 380 C ATOM 960 CD1 TRP A 56 4.843 10.279 1.325 1.00 65.04 C ANISOU 960 CD1 TRP A 56 7923 6977 9811 -1140 -490 402 C ATOM 961 CD2 TRP A 56 3.383 11.179 -0.112 1.00 65.51 C ANISOU 961 CD2 TRP A 56 7955 7105 9832 -1162 -506 358 C ATOM 962 NE1 TRP A 56 3.603 10.255 1.917 1.00 66.06 N ANISOU 962 NE1 TRP A 56 8038 7152 9908 -1142 -486 395 N ATOM 963 CE2 TRP A 56 2.689 10.803 1.055 1.00 65.83 C ANISOU 963 CE2 TRP A 56 7992 7167 9856 -1155 -496 368 C ATOM 964 CE3 TRP A 56 2.668 11.768 -1.163 1.00 66.41 C ANISOU 964 CE3 TRP A 56 8052 7254 9925 -1176 -517 331 C ATOM 965 CZ2 TRP A 56 1.318 10.997 1.205 1.00 66.50 C ANISOU 965 CZ2 TRP A 56 8057 7305 9904 -1161 -498 352 C ATOM 966 CZ3 TRP A 56 1.302 11.960 -1.014 1.00 66.30 C ANISOU 966 CZ3 TRP A 56 8020 7294 9876 -1182 -519 314 C ATOM 967 CH2 TRP A 56 0.643 11.573 0.161 1.00 66.90 C ANISOU 967 CH2 TRP A 56 8093 7390 9936 -1175 -509 325 C ATOM 968 H TRP A 56 7.644 10.838 -2.543 1.00 76.20 H ATOM 969 HA TRP A 56 6.387 9.058 -1.089 1.00 76.42 H ATOM 970 HB2 TRP A 56 6.663 11.285 -0.377 1.00 76.30 H ATOM 971 HB3 TRP A 56 5.623 11.748 -1.485 1.00 76.30 H ATOM 972 HD1 TRP A 56 5.625 9.960 1.714 1.00 78.05 H ATOM 973 HE1 TRP A 56 3.430 9.949 2.702 1.00 79.27 H ATOM 974 HE3 TRP A 56 3.100 12.022 -1.947 1.00 79.69 H ATOM 975 HZ2 TRP A 56 0.877 10.744 1.984 1.00 79.80 H ATOM 976 HZ3 TRP A 56 0.816 12.350 -1.705 1.00 79.56 H ATOM 977 HH2 TRP A 56 -0.273 11.717 0.237 1.00 80.28 H ATOM 978 N LYS A 57 4.863 9.975 -3.750 1.00 63.72 N ANISOU 978 N LYS A 57 7740 6798 9674 -1251 -453 325 N ATOM 979 CA LYS A 57 3.739 9.632 -4.619 1.00 64.19 C ANISOU 979 CA LYS A 57 7781 6892 9715 -1289 -433 298 C ATOM 980 C LYS A 57 3.808 8.175 -5.064 1.00 68.66 C ANISOU 980 C LYS A 57 8352 7429 10305 -1334 -382 297 C ATOM 981 O LYS A 57 2.787 7.480 -5.086 1.00 69.02 O ANISOU 981 O LYS A 57 8387 7501 10336 -1363 -355 285 O ATOM 982 CB LYS A 57 3.705 10.561 -5.832 1.00 63.69 C ANISOU 982 CB LYS A 57 7710 6844 9644 -1291 -458 276 C ATOM 983 CG LYS A 57 3.275 11.979 -5.506 1.00 63.55 C ANISOU 983 CG LYS A 57 7683 6868 9596 -1253 -505 271 C ATOM 984 H LYS A 57 5.394 10.574 -4.066 1.00 76.47 H ATOM 985 HA LYS A 57 2.913 9.755 -4.126 1.00 77.02 H ATOM 986 HB2 LYS A 57 4.593 10.601 -6.220 1.00 76.43 H ATOM 987 HB3 LYS A 57 3.079 10.203 -6.481 1.00 76.43 H ATOM 988 N LYS A 58 5.004 7.692 -5.408 1.00 70.04 N ANISOU 988 N LYS A 58 8545 7552 10517 -1341 -369 308 N ATOM 989 CA LYS A 58 5.198 6.317 -5.855 1.00 73.51 C ANISOU 989 CA LYS A 58 8990 7959 10981 -1382 -322 308 C ATOM 990 C LYS A 58 5.071 5.292 -4.738 1.00 76.09 C ANISOU 990 C LYS A 58 9323 8275 11314 -1387 -293 327 C ATOM 991 O LYS A 58 5.318 4.109 -4.990 1.00 79.16 O ANISOU 991 O LYS A 58 9719 8633 11725 -1419 -253 330 O ATOM 992 CB LYS A 58 6.571 6.172 -6.509 1.00 72.99 C ANISOU 992 CB LYS A 58 8941 7839 10953 -1385 -319 316 C ATOM 993 CG LYS A 58 6.621 6.639 -7.950 1.00 72.72 C ANISOU 993 CG LYS A 58 8900 7809 10920 -1402 -327 293 C ATOM 994 CD LYS A 58 8.022 7.098 -8.338 1.00 73.11 C ANISOU 994 CD LYS A 58 8966 7815 10999 -1383 -346 304 C ATOM 995 CE LYS A 58 8.080 7.490 -9.803 1.00 73.40 C ANISOU 995 CE LYS A 58 8997 7854 11038 -1403 -352 281 C ATOM 996 NZ LYS A 58 8.772 8.803 -10.005 1.00 73.75 N ANISOU 996 NZ LYS A 58 9045 7895 11082 -1366 -397 283 N ATOM 997 H LYS A 58 5.730 8.153 -5.390 1.00 84.05 H ATOM 998 HA LYS A 58 4.527 6.110 -6.524 1.00 88.21 H ATOM 999 HB2 LYS A 58 7.213 6.696 -6.006 1.00 87.59 H ATOM 1000 HB3 LYS A 58 6.827 5.236 -6.492 1.00 87.59 H ATOM 1001 HG2 LYS A 58 6.368 5.906 -8.533 1.00 87.26 H ATOM 1002 HG3 LYS A 58 6.013 7.386 -8.066 1.00 87.26 H ATOM 1003 HD2 LYS A 58 8.267 7.871 -7.805 1.00 87.74 H ATOM 1004 HD3 LYS A 58 8.650 6.374 -8.190 1.00 87.74 H ATOM 1005 HE2 LYS A 58 8.569 6.811 -10.295 1.00 88.08 H ATOM 1006 HE3 LYS A 58 7.177 7.567 -10.148 1.00 88.08 H ATOM 1007 HZ1 LYS A 58 8.791 9.006 -10.871 1.00 88.50 H ATOM 1008 HZ2 LYS A 58 8.339 9.445 -9.567 1.00 88.50 H ATOM 1009 HZ3 LYS A 58 9.607 8.757 -9.700 1.00 88.50 H ATOM 1010 N GLU A 59 4.712 5.697 -3.519 1.00 81.00 N ANISOU 1010 N GLU A 59 9943 8918 11915 -1356 -311 340 N ATOM 1011 CA GLU A 59 4.589 4.750 -2.416 1.00 84.55 C ANISOU 1011 CA GLU A 59 10398 9357 12369 -1358 -285 358 C ATOM 1012 C GLU A 59 3.350 5.028 -1.570 1.00 91.02 C ANISOU 1012 C GLU A 59 11202 10228 13151 -1347 -293 354 C ATOM 1013 O GLU A 59 3.294 4.595 -0.414 1.00 89.83 O ANISOU 1013 O GLU A 59 11058 10075 13001 -1336 -285 372 O ATOM 1014 CB GLU A 59 5.852 4.793 -1.541 1.00 84.00 C ANISOU 1014 CB GLU A 59 10348 9243 12325 -1326 -296 388 C ATOM 1015 CG GLU A 59 7.159 4.647 -2.340 1.00 83.47 C ANISOU 1015 CG GLU A 59 10296 9124 12295 -1332 -293 393 C ATOM 1016 CD GLU A 59 8.415 4.898 -1.516 1.00 82.90 C ANISOU 1016 CD GLU A 59 10243 9010 12246 -1296 -311 422 C ATOM 1017 OE1 GLU A 59 8.301 5.229 -0.313 1.00 83.10 O ANISOU 1017 OE1 GLU A 59 10269 9047 12258 -1265 -327 438 O ATOM 1018 OE2 GLU A 59 9.524 4.773 -2.083 1.00 82.00 O ANISOU 1018 OE2 GLU A 59 10142 8852 12162 -1299 -308 428 O ATOM 1019 H GLU A 59 4.535 6.512 -3.308 1.00 97.20 H ATOM 1020 HA GLU A 59 4.507 3.854 -2.779 1.00101.46 H ATOM 1021 HB2 GLU A 59 5.881 5.643 -1.075 1.00100.80 H ATOM 1022 HB3 GLU A 59 5.813 4.067 -0.899 1.00100.80 H ATOM 1023 HG2 GLU A 59 7.211 3.744 -2.692 1.00100.16 H ATOM 1024 HG3 GLU A 59 7.151 5.284 -3.071 1.00100.16 H ATOM 1025 N ASN A 60 2.359 5.724 -2.126 1.00 98.25 N ANISOU 1025 N ASN A 60 12100 11193 14037 -1352 -310 330 N ATOM 1026 CA ASN A 60 1.190 6.218 -1.390 1.00106.18 C ANISOU 1026 CA ASN A 60 13090 12250 15004 -1336 -325 325 C ATOM 1027 C ASN A 60 1.570 6.944 -0.091 1.00109.73 C ANISOU 1027 C ASN A 60 13546 12699 15446 -1288 -357 348 C ATOM 1028 O ASN A 60 0.705 7.500 0.591 1.00110.89 O ANISOU 1028 O ASN A 60 13682 12889 15562 -1269 -375 345 O ATOM 1029 CB ASN A 60 0.220 5.074 -1.082 1.00109.48 C ANISOU 1029 CB ASN A 60 13500 12685 15413 -1369 -284 321 C ATOM 1030 CG ASN A 60 -1.124 5.572 -0.552 1.00111.66 C ANISOU 1030 CG ASN A 60 13758 13020 15648 -1360 -298 310 C ATOM 1031 OD1 ASN A 60 -1.809 6.360 -1.209 1.00111.99 O ANISOU 1031 OD1 ASN A 60 13785 13100 15666 -1361 -318 289 O ATOM 1032 ND2 ASN A 60 -1.506 5.107 0.634 1.00112.25 N ANISOU 1032 ND2 ASN A 60 13833 13102 15714 -1352 -287 325 N ATOM 1033 OXT ASN A 60 2.735 7.013 0.313 1.00110.82 O ANISOU 1033 OXT ASN A 60 13702 12797 15610 -1266 -366 369 O ATOM 1034 H ASN A 60 2.340 5.931 -2.960 1.00117.90 H ATOM 1035 HA ASN A 60 0.721 6.855 -1.951 1.00127.42 H ATOM 1036 HB2 ASN A 60 0.055 4.572 -1.896 1.00131.38 H ATOM 1037 HB3 ASN A 60 0.614 4.497 -0.409 1.00131.38 H ATOM 1038 HD21 ASN A 60 -2.255 5.358 0.974 1.00134.70 H ATOM 1039 HD22 ASN A 60 -1.005 4.554 1.062 1.00134.70 H TER 1040 ASN A 60 ATOM 1041 O5' DA B 0 0.130 39.345 -18.040 1.00 57.36 O ANISOU 1041 O5' DA B 0 7444 6855 7496 1809 -788 794 O ATOM 1042 C5' DA B 0 0.237 40.781 -18.064 1.00 56.70 C ANISOU 1042 C5' DA B 0 7416 6761 7367 1717 -847 907 C ATOM 1043 C4' DA B 0 1.315 41.240 -17.110 1.00 55.65 C ANISOU 1043 C4' DA B 0 7357 6603 7184 1598 -895 1053 C ATOM 1044 O4' DA B 0 0.874 41.019 -15.739 1.00 52.78 O ANISOU 1044 O4' DA B 0 7133 6039 6881 1540 -857 1001 O ATOM 1045 C3' DA B 0 2.647 40.488 -17.239 1.00 55.65 C ANISOU 1045 C3' DA B 0 7266 6750 7129 1615 -918 1131 C ATOM 1046 O3' DA B 0 3.736 41.390 -17.111 1.00 58.44 O ANISOU 1046 O3' DA B 0 7631 7171 7401 1518 -992 1305 O ATOM 1047 C2' DA B 0 2.579 39.489 -16.096 1.00 52.91 C ANISOU 1047 C2' DA B 0 6990 6274 6838 1608 -867 1060 C ATOM 1048 C1' DA B 0 1.872 40.308 -15.038 1.00 50.10 C ANISOU 1048 C1' DA B 0 6798 5716 6522 1511 -861 1054 C ATOM 1049 N9 DA B 0 1.224 39.553 -13.962 1.00 45.11 N ANISOU 1049 N9 DA B 0 6262 4909 5969 1509 -798 942 N ATOM 1050 C8 DA B 0 1.492 39.639 -12.630 1.00 43.00 C ANISOU 1050 C8 DA B 0 6120 4504 5714 1412 -799 983 C ATOM 1051 N7 DA B 0 0.726 38.876 -11.881 1.00 40.91 N ANISOU 1051 N7 DA B 0 5924 4093 5528 1434 -734 857 N ATOM 1052 C5 DA B 0 -0.118 38.266 -12.791 1.00 40.86 C ANISOU 1052 C5 DA B 0 5831 4129 5563 1554 -688 723 C ATOM 1053 C6 DA B 0 -1.177 37.361 -12.634 1.00 39.87 C ANISOU 1053 C6 DA B 0 5720 3905 5523 1631 -612 554 C ATOM 1054 N6 DA B 0 -1.567 36.885 -11.449 1.00 39.70 N ANISOU 1054 N6 DA B 0 5809 3714 5560 1595 -568 488 N ATOM 1055 N1 DA B 0 -1.822 36.956 -13.742 1.00 39.67 N ANISOU 1055 N1 DA B 0 5591 3961 5520 1744 -583 454 N ATOM 1056 C2 DA B 0 -1.429 37.434 -14.924 1.00 40.60 C ANISOU 1056 C2 DA B 0 5600 4249 5579 1778 -627 521 C ATOM 1057 N3 DA B 0 -0.456 38.298 -15.196 1.00 41.88 N ANISOU 1057 N3 DA B 0 5737 4516 5658 1714 -699 678 N ATOM 1058 C4 DA B 0 0.168 38.676 -14.075 1.00 42.52 C ANISOU 1058 C4 DA B 0 5923 4513 5720 1602 -726 774 C ATOM 1059 H5' DA B 0 -0.612 41.170 -17.801 1.00 68.04 H ATOM 1060 H5'' DA B 0 0.458 41.071 -18.963 1.00 68.04 H ATOM 1061 H4' DA B 0 1.473 42.188 -17.243 1.00 66.78 H ATOM 1062 H3' DA B 0 2.690 40.023 -18.090 1.00 66.78 H ATOM 1063 H2' DA B 0 2.055 38.712 -16.343 1.00 63.49 H ATOM 1064 H2'' DA B 0 3.468 39.235 -15.802 1.00 63.49 H ATOM 1065 H1' DA B 0 2.499 40.939 -14.651 1.00 60.12 H ATOM 1066 H8 DA B 0 2.172 40.170 -12.283 1.00 51.60 H ATOM 1067 H61 DA B 0 -2.221 36.330 -11.402 1.00 47.64 H ATOM 1068 H62 DA B 0 -1.163 37.135 -10.731 1.00 47.64 H ATOM 1069 H2 DA B 0 -1.907 37.125 -15.660 1.00 48.72 H ATOM 1070 HO5' DA B 0 -0.044 38.948 -17.320 1.00 68.83 H ATOM 1071 P DG B 1 5.174 41.051 -17.744 1.00 63.27 P ANISOU 1071 P DG B 1 8116 7994 7931 1537 -1039 1420 P ATOM 1072 OP1 DG B 1 5.829 42.358 -17.970 1.00 66.15 O ANISOU 1072 OP1 DG B 1 8492 8425 8219 1450 -1115 1578 O ATOM 1073 OP2 DG B 1 5.062 40.019 -18.803 1.00 63.96 O ANISOU 1073 OP2 DG B 1 8059 8214 8028 1670 -1005 1328 O ATOM 1074 O5' DG B 1 5.951 40.345 -16.552 1.00 62.94 O ANISOU 1074 O5' DG B 1 8132 7888 7893 1485 -1031 1454 O ATOM 1075 C5' DG B 1 6.116 41.022 -15.331 1.00 60.58 C ANISOU 1075 C5' DG B 1 7976 7447 7595 1362 -1052 1527 C ATOM 1076 C4' DG B 1 6.629 40.074 -14.280 1.00 57.48 C ANISOU 1076 C4' DG B 1 7628 6987 7224 1341 -1027 1518 C ATOM 1077 O4' DG B 1 5.532 39.264 -13.783 1.00 54.74 O ANISOU 1077 O4' DG B 1 7335 6495 6970 1392 -950 1354 O ATOM 1078 C3' DG B 1 7.672 39.061 -14.769 1.00 58.72 C ANISOU 1078 C3' DG B 1 7656 7312 7345 1405 -1033 1546 C ATOM 1079 O3' DG B 1 8.542 38.793 -13.746 1.00 60.58 O ANISOU 1079 O3' DG B 1 7948 7504 7564 1332 -1048 1620 O ATOM 1080 C2' DG B 1 6.822 37.848 -15.088 1.00 56.44 C ANISOU 1080 C2' DG B 1 7314 7003 7128 1525 -958 1372 C ATOM 1081 C1' DG B 1 5.897 37.898 -13.894 1.00 53.76 C ANISOU 1081 C1' DG B 1 7128 6437 6862 1474 -915 1292 C ATOM 1082 N9 DG B 1 4.693 37.101 -13.987 1.00 48.76 N ANISOU 1082 N9 DG B 1 6494 5720 6313 1564 -840 1115 N ATOM 1083 C8 DG B 1 4.096 36.600 -15.115 1.00 47.75 C ANISOU 1083 C8 DG B 1 6255 5681 6205 1683 -809 1012 C ATOM 1084 N7 DG B 1 3.008 35.930 -14.863 1.00 45.76 N ANISOU 1084 N7 DG B 1 6038 5312 6035 1740 -740 858 N ATOM 1085 C5 DG B 1 2.875 36.005 -13.479 1.00 43.32 C ANISOU 1085 C5 DG B 1 5874 4824 5762 1652 -726 859 C ATOM 1086 C6 DG B 1 1.884 35.469 -12.627 1.00 39.14 C ANISOU 1086 C6 DG B 1 5441 4112 5318 1660 -661 727 C ATOM 1087 O6 DG B 1 0.882 34.813 -12.939 1.00 37.58 O ANISOU 1087 O6 DG B 1 5221 3873 5186 1749 -601 579 O ATOM 1088 N1 DG B 1 2.137 35.777 -11.289 1.00 38.11 N ANISOU 1088 N1 DG B 1 5447 3839 5195 1548 -670 783 N ATOM 1089 C2 DG B 1 3.214 36.521 -10.844 1.00 39.89 C ANISOU 1089 C2 DG B 1 5710 4096 5352 1443 -735 947 C ATOM 1090 N2 DG B 1 3.310 36.715 -9.520 1.00 40.42 N ANISOU 1090 N2 DG B 1 5913 4009 5436 1343 -734 979 N ATOM 1091 N3 DG B 1 4.134 37.037 -11.643 1.00 40.81 N ANISOU 1091 N3 DG B 1 5736 4382 5388 1435 -796 1070 N ATOM 1092 C4 DG B 1 3.905 36.728 -12.935 1.00 44.02 C ANISOU 1092 C4 DG B 1 6010 4928 5788 1543 -787 1017 C ATOM 1093 H5' DG B 1 5.263 41.385 -15.047 1.00 72.70 H ATOM 1094 H5'' DG B 1 6.751 41.746 -15.448 1.00 72.70 H ATOM 1095 H4' DG B 1 7.003 40.585 -13.546 1.00 68.98 H ATOM 1096 H3' DG B 1 8.136 39.385 -15.556 1.00 70.47 H ATOM 1097 H2' DG B 1 6.336 37.965 -15.919 1.00 67.73 H ATOM 1098 H2'' DG B 1 7.352 37.035 -15.092 1.00 67.73 H ATOM 1099 H1' DG B 1 6.389 37.637 -13.101 1.00 64.51 H ATOM 1100 H8 DG B 1 4.435 36.724 -15.972 1.00 57.30 H ATOM 1101 H1 DG B 1 1.578 35.492 -10.701 1.00 45.74 H ATOM 1102 H21 DG B 1 3.966 37.171 -9.198 1.00 48.51 H ATOM 1103 H22 DG B 1 2.717 36.385 -8.992 1.00 48.51 H ATOM 1104 P DA B 2 10.122 38.744 -13.957 1.00 62.04 P ANISOU 1104 P DA B 2 8053 7856 7663 1303 -1108 1772 P ATOM 1105 OP1 DA B 2 10.604 40.135 -14.141 1.00 63.41 O ANISOU 1105 OP1 DA B 2 8251 8075 7767 1213 -1179 1918 O ATOM 1106 OP2 DA B 2 10.386 37.688 -14.971 1.00 63.22 O ANISOU 1106 OP2 DA B 2 8047 8167 7806 1425 -1087 1715 O ATOM 1107 O5' DA B 2 10.617 38.215 -12.525 1.00 57.18 O ANISOU 1107 O5' DA B 2 7538 7119 7069 1232 -1097 1794 O ATOM 1108 C5' DA B 2 10.053 38.790 -11.355 1.00 52.42 C ANISOU 1108 C5' DA B 2 7096 6316 6504 1138 -1087 1788 C ATOM 1109 C4' DA B 2 9.819 37.761 -10.259 1.00 47.43 C ANISOU 1109 C4' DA B 2 6537 5546 5937 1139 -1032 1699 C ATOM 1110 O4' DA B 2 8.571 37.045 -10.475 1.00 44.21 O ANISOU 1110 O4' DA B 2 6123 5064 5611 1234 -959 1522 O ATOM 1111 C3' DA B 2 10.894 36.697 -10.120 1.00 48.33 C ANISOU 1111 C3' DA B 2 6580 5753 6030 1166 -1035 1732 C ATOM 1112 O3' DA B 2 11.220 36.599 -8.754 1.00 53.18 O ANISOU 1112 O3' DA B 2 7315 6233 6660 1076 -1034 1768 O ATOM 1113 C2' DA B 2 10.244 35.429 -10.695 1.00 44.86 C ANISOU 1113 C2' DA B 2 6053 5344 5649 1301 -968 1572 C ATOM 1114 C1' DA B 2 8.783 35.646 -10.376 1.00 43.14 C ANISOU 1114 C1' DA B 2 5929 4955 5506 1308 -917 1445 C ATOM 1115 N9 DA B 2 7.824 35.017 -11.281 1.00 41.77 N ANISOU 1115 N9 DA B 2 5674 4815 5381 1433 -864 1298 N ATOM 1116 C8 DA B 2 7.843 35.019 -12.653 1.00 42.14 C ANISOU 1116 C8 DA B 2 5584 5029 5397 1519 -875 1290 C ATOM 1117 N7 DA B 2 6.792 34.448 -13.199 1.00 41.62 N ANISOU 1117 N7 DA B 2 5478 4944 5391 1620 -818 1140 N ATOM 1118 C5 DA B 2 6.015 34.071 -12.107 1.00 40.13 C ANISOU 1118 C5 DA B 2 5410 4561 5278 1596 -766 1044 C ATOM 1119 C6 DA B 2 4.769 33.406 -11.996 1.00 37.33 C ANISOU 1119 C6 DA B 2 5083 4092 5009 1666 -693 874 C ATOM 1120 N6 DA B 2 4.044 32.991 -13.048 1.00 37.01 N ANISOU 1120 N6 DA B 2 4947 4121 4996 1779 -658 764 N ATOM 1121 N1 DA B 2 4.290 33.187 -10.758 1.00 36.72 N ANISOU 1121 N1 DA B 2 5136 3827 4989 1614 -656 819 N ATOM 1122 C2 DA B 2 5.002 33.593 -9.707 1.00 36.79 C ANISOU 1122 C2 DA B 2 5242 3766 4972 1501 -690 927 C ATOM 1123 N3 DA B 2 6.175 34.225 -9.679 1.00 38.22 N ANISOU 1123 N3 DA B 2 5410 4039 5075 1426 -759 1089 N ATOM 1124 C4 DA B 2 6.632 34.436 -10.923 1.00 40.39 C ANISOU 1124 C4 DA B 2 5553 4500 5293 1480 -794 1140 C ATOM 1125 H5' DA B 2 9.205 39.201 -11.585 1.00 62.90 H ATOM 1126 H5'' DA B 2 10.653 39.474 -11.020 1.00 62.90 H ATOM 1127 H4' DA B 2 9.754 38.233 -9.414 1.00 56.91 H ATOM 1128 H3' DA B 2 11.677 36.940 -10.639 1.00 57.99 H ATOM 1129 H2' DA B 2 10.383 35.375 -11.654 1.00 53.83 H ATOM 1130 H2'' DA B 2 10.581 34.636 -10.249 1.00 53.83 H ATOM 1131 H1' DA B 2 8.605 35.357 -9.467 1.00 51.77 H ATOM 1132 H8 DA B 2 8.539 35.384 -13.151 1.00 50.57 H ATOM 1133 H61 DA B 2 3.291 32.595 -12.922 1.00 44.42 H ATOM 1134 H62 DA B 2 4.333 33.121 -13.848 1.00 44.42 H ATOM 1135 H2 DA B 2 4.620 33.423 -8.876 1.00 44.15 H ATOM 1136 P DA B 3 12.269 35.523 -8.205 1.00 57.79 P ANISOU 1136 P DA B 3 7867 6856 7232 1078 -1033 1801 P ATOM 1137 OP1 DA B 3 12.996 36.237 -7.132 1.00 61.00 O ANISOU 1137 OP1 DA B 3 8386 7188 7604 943 -1080 1932 O ATOM 1138 OP2 DA B 3 12.977 34.876 -9.330 1.00 59.73 O ANISOU 1138 OP2 DA B 3 7947 7310 7438 1170 -1046 1816 O ATOM 1139 O5' DA B 3 11.338 34.426 -7.532 1.00 55.03 O ANISOU 1139 O5' DA B 3 7572 6359 6977 1129 -953 1635 O ATOM 1140 C5' DA B 3 10.300 34.845 -6.687 1.00 51.14 C ANISOU 1140 C5' DA B 3 7221 5668 6543 1077 -921 1568 C ATOM 1141 C4' DA B 3 9.493 33.674 -6.214 1.00 46.95 C ANISOU 1141 C4' DA B 3 6716 5025 6097 1142 -845 1408 C ATOM 1142 O4' DA B 3 8.611 33.210 -7.272 1.00 43.85 O ANISOU 1142 O4' DA B 3 6231 4689 5741 1265 -801 1279 O ATOM 1143 C3' DA B 3 10.319 32.465 -5.785 1.00 47.96 C ANISOU 1143 C3' DA B 3 6806 5190 6228 1166 -833 1409 C ATOM 1144 O3' DA B 3 9.761 31.986 -4.598 1.00 50.11 O ANISOU 1144 O3' DA B 3 7197 5276 6566 1133 -786 1329 O ATOM 1145 C2' DA B 3 10.192 31.492 -6.971 1.00 45.96 C ANISOU 1145 C2' DA B 3 6397 5082 5985 1307 -802 1318 C ATOM 1146 C1' DA B 3 8.804 31.826 -7.513 1.00 42.71 C ANISOU 1146 C1' DA B 3 5996 4609 5622 1361 -762 1198 C ATOM 1147 N9 DA B 3 8.608 31.615 -8.935 1.00 39.72 N ANISOU 1147 N9 DA B 3 5473 4388 5230 1472 -757 1152 N ATOM 1148 C8 DA B 3 9.423 32.020 -9.948 1.00 40.53 C ANISOU 1148 C8 DA B 3 5462 4679 5258 1489 -810 1254 C ATOM 1149 N7 DA B 3 8.949 31.757 -11.145 1.00 40.30 N ANISOU 1149 N7 DA B 3 5320 4757 5236 1596 -791 1179 N ATOM 1150 C5 DA B 3 7.724 31.158 -10.895 1.00 39.38 C ANISOU 1150 C5 DA B 3 5247 4510 5204 1652 -720 1017 C ATOM 1151 C6 DA B 3 6.732 30.621 -11.751 1.00 40.17 C ANISOU 1151 C6 DA B 3 5276 4633 5352 1768 -668 873 C ATOM 1152 N6 DA B 3 6.829 30.635 -13.084 1.00 41.50 N ANISOU 1152 N6 DA B 3 5309 4971 5487 1849 -682 873 N ATOM 1153 N1 DA B 3 5.627 30.081 -11.178 1.00 38.81 N ANISOU 1153 N1 DA B 3 5179 4303 5265 1796 -602 729 N ATOM 1154 C2 DA B 3 5.535 30.072 -9.841 1.00 38.23 C ANISOU 1154 C2 DA B 3 5241 4060 5225 1713 -588 730 C ATOM 1155 N3 DA B 3 6.407 30.539 -8.933 1.00 38.55 N ANISOU 1155 N3 DA B 3 5360 4062 5226 1600 -632 857 N ATOM 1156 C4 DA B 3 7.492 31.073 -9.539 1.00 38.79 C ANISOU 1156 C4 DA B 3 5313 4252 5172 1576 -698 998 C ATOM 1157 H5' DA B 3 9.722 35.456 -7.170 1.00 61.37 H ATOM 1158 H5'' DA B 3 10.678 35.303 -5.920 1.00 61.37 H ATOM 1159 H4' DA B 3 8.951 33.958 -5.462 1.00 56.33 H ATOM 1160 H3' DA B 3 11.245 32.718 -5.650 1.00 57.56 H ATOM 1161 H2' DA B 3 10.875 31.669 -7.638 1.00 55.16 H ATOM 1162 H2'' DA B 3 10.232 30.571 -6.669 1.00 55.16 H ATOM 1163 H1' DA B 3 8.138 31.321 -7.020 1.00 51.25 H ATOM 1164 H8 DA B 3 10.238 32.445 -9.806 1.00 48.63 H ATOM 1165 H61 DA B 3 6.197 30.305 -13.565 1.00 49.80 H ATOM 1166 H62 DA B 3 7.524 30.975 -13.461 1.00 49.80 H ATOM 1167 H2 DA B 3 4.758 29.696 -9.495 1.00 45.88 H ATOM 1168 P DA B 4 10.360 30.740 -3.809 1.00 54.12 P ANISOU 1168 P DA B 4 7710 5758 7097 1141 -762 1307 P ATOM 1169 OP1 DA B 4 9.942 31.024 -2.417 1.00 54.00 O ANISOU 1169 OP1 DA B 4 7863 5534 7122 1043 -745 1297 O ATOM 1170 OP2 DA B 4 11.781 30.520 -4.182 1.00 54.95 O ANISOU 1170 OP2 DA B 4 7714 6034 7129 1140 -814 1431 O ATOM 1171 O5' DA B 4 9.489 29.510 -4.367 1.00 53.17 O ANISOU 1171 O5' DA B 4 7512 5644 7045 1279 -689 1129 O ATOM 1172 C5' DA B 4 8.094 29.468 -4.085 1.00 48.12 C ANISOU 1172 C5' DA B 4 6951 4851 6483 1301 -629 989 C ATOM 1173 C4' DA B 4 7.447 28.277 -4.735 1.00 42.59 C ANISOU 1173 C4' DA B 4 6159 4188 5837 1436 -567 835 C ATOM 1174 O4' DA B 4 7.384 28.495 -6.171 1.00 40.51 O ANISOU 1174 O4' DA B 4 5762 4089 5541 1519 -581 832 O ATOM 1175 C3' DA B 4 8.188 26.938 -4.519 1.00 39.80 C ANISOU 1175 C3' DA B 4 5742 3890 5490 1484 -550 817 C ATOM 1176 O3' DA B 4 7.319 26.015 -3.883 1.00 37.99 O ANISOU 1176 O3' DA B 4 5570 3520 5344 1523 -480 670 O ATOM 1177 C2' DA B 4 8.584 26.491 -5.919 1.00 39.97 C ANISOU 1177 C2' DA B 4 5589 4121 5477 1594 -560 813 C ATOM 1178 C1' DA B 4 7.614 27.276 -6.812 1.00 39.91 C ANISOU 1178 C1' DA B 4 5561 4126 5476 1631 -553 764 C ATOM 1179 N9 DA B 4 8.109 27.538 -8.135 1.00 38.68 N ANISOU 1179 N9 DA B 4 5266 4170 5261 1687 -591 821 N ATOM 1180 C8 DA B 4 9.309 28.084 -8.482 1.00 38.22 C ANISOU 1180 C8 DA B 4 5151 4251 5119 1643 -659 976 C ATOM 1181 N7 DA B 4 9.480 28.192 -9.781 1.00 39.07 N ANISOU 1181 N7 DA B 4 5127 4529 5187 1715 -678 989 N ATOM 1182 C5 DA B 4 8.293 27.685 -10.316 1.00 40.07 C ANISOU 1182 C5 DA B 4 5223 4624 5378 1815 -617 831 C ATOM 1183 C6 DA B 4 7.831 27.519 -11.638 1.00 38.81 C ANISOU 1183 C6 DA B 4 4941 4585 5218 1923 -602 763 C ATOM 1184 N6 DA B 4 8.541 27.864 -12.704 1.00 39.58 N ANISOU 1184 N6 DA B 4 4921 4870 5247 1950 -649 848 N ATOM 1185 N1 DA B 4 6.605 26.974 -11.817 1.00 36.90 N ANISOU 1185 N1 DA B 4 4703 4265 5050 2003 -536 601 N ATOM 1186 C2 DA B 4 5.892 26.621 -10.742 1.00 36.47 C ANISOU 1186 C2 DA B 4 4768 4024 5066 1976 -489 514 C ATOM 1187 N3 DA B 4 6.217 26.730 -9.456 1.00 37.75 N ANISOU 1187 N3 DA B 4 5051 4057 5235 1876 -497 564 N ATOM 1188 C4 DA B 4 7.445 27.273 -9.313 1.00 39.71 C ANISOU 1188 C4 DA B 4 5292 4389 5408 1799 -563 726 C ATOM 1189 H5' DA B 4 7.677 30.278 -4.418 1.00 57.75 H ATOM 1190 H5'' DA B 4 7.964 29.416 -3.125 1.00 57.75 H ATOM 1191 H4' DA B 4 6.544 28.190 -4.394 1.00 51.11 H ATOM 1192 H3' DA B 4 8.980 27.079 -3.977 1.00 47.76 H ATOM 1193 H2' DA B 4 9.503 26.738 -6.111 1.00 47.97 H ATOM 1194 H2'' DA B 4 8.453 25.536 -6.026 1.00 47.97 H ATOM 1195 H1' DA B 4 6.778 26.789 -6.877 1.00 47.89 H ATOM 1196 H8 DA B 4 9.947 28.349 -7.860 1.00 45.86 H ATOM 1197 H61 DA B 4 8.221 27.740 -13.493 1.00 47.50 H ATOM 1198 H62 DA B 4 9.322 28.211 -12.607 1.00 47.50 H ATOM 1199 H2 DA B 4 5.055 26.255 -10.917 1.00 43.76 H ATOM 1200 P DG B 5 7.744 24.478 -3.607 1.00 38.17 P ANISOU 1200 P DG B 5 6192 4547 3762 1170 87 -574 P ATOM 1201 OP1 DG B 5 7.118 24.156 -2.324 1.00 38.62 O ANISOU 1201 OP1 DG B 5 6283 4507 3883 997 144 -491 O ATOM 1202 OP2 DG B 5 9.188 24.332 -3.872 1.00 38.34 O ANISOU 1202 OP2 DG B 5 6265 4675 3628 1216 -12 -706 O ATOM 1203 O5' DG B 5 6.960 23.651 -4.739 1.00 38.53 O ANISOU 1203 O5' DG B 5 6137 4567 3934 1318 -166 -543 O ATOM 1204 C5' DG B 5 5.535 23.886 -4.927 1.00 39.11 C ANISOU 1204 C5' DG B 5 6123 4566 4171 1327 -93 -410 C ATOM 1205 C4' DG B 5 5.044 23.271 -6.217 1.00 39.45 C ANISOU 1205 C4' DG B 5 6076 4627 4287 1476 -332 -404 C ATOM 1206 O4' DG B 5 5.648 23.975 -7.325 1.00 39.06 O ANISOU 1206 O4' DG B 5 6016 4679 4147 1615 -291 -471 O ATOM 1207 C3' DG B 5 5.407 21.795 -6.390 1.00 39.59 C ANISOU 1207 C3' DG B 5 6114 4633 4297 1496 -667 -481 C ATOM 1208 O3' DG B 5 4.250 20.982 -6.380 1.00 42.05 O ANISOU 1208 O3' DG B 5 6359 4859 4760 1470 -814 -391 O ATOM 1209 C2' DG B 5 6.132 21.716 -7.733 1.00 39.87 C ANISOU 1209 C2' DG B 5 6144 4762 4244 1657 -807 -589 C ATOM 1210 C1' DG B 5 5.887 23.067 -8.371 1.00 39.20 C ANISOU 1210 C1' DG B 5 6013 4734 4147 1730 -580 -545 C ATOM 1211 N9 DG B 5 7.022 23.547 -9.132 1.00 38.76 N ANISOU 1211 N9 DG B 5 5998 4781 3948 1837 -558 -664 N ATOM 1212 C8 DG B 5 8.176 24.108 -8.633 1.00 37.93 C ANISOU 1212 C8 DG B 5 5972 4727 3711 1801 -412 -748 C ATOM 1213 N7 DG B 5 9.022 24.455 -9.560 1.00 37.55 N ANISOU 1213 N7 DG B 5 5940 4767 3558 1921 -423 -845 N ATOM 1214 C5 DG B 5 8.381 24.108 -10.753 1.00 38.05 C ANISOU 1214 C5 DG B 5 5937 4839 3680 2041 -584 -824 C ATOM 1215 C6 DG B 5 8.802 24.260 -12.094 1.00 39.01 C ANISOU 1215 C6 DG B 5 6050 5039 3733 2192 -660 -897 C ATOM 1216 O6 DG B 5 9.870 24.728 -12.520 1.00 39.95 O ANISOU 1216 O6 DG B 5 6217 5232 3729 2263 -598 -1000 O ATOM 1217 N1 DG B 5 7.861 23.779 -12.986 1.00 39.90 N ANISOU 1217 N1 DG B 5 6093 5140 3927 2256 -830 -842 N ATOM 1218 C2 DG B 5 6.656 23.224 -12.642 1.00 41.44 C ANISOU 1218 C2 DG B 5 6225 5258 4263 2185 -917 -727 C ATOM 1219 N2 DG B 5 5.879 22.820 -13.663 1.00 44.35 N ANISOU 1219 N2 DG B 5 6526 5639 4686 2252 -1090 -687 N ATOM 1220 N3 DG B 5 6.237 23.082 -11.397 1.00 40.35 N ANISOU 1220 N3 DG B 5 6089 5040 4203 2052 -841 -657 N ATOM 1221 C4 DG B 5 7.155 23.543 -10.505 1.00 39.48 C ANISOU 1221 C4 DG B 5 6056 4939 4005 1986 -674 -713 C ATOM 1222 H5' DG B 5 5.371 24.841 -4.947 1.00 46.93 H ATOM 1223 H5'' DG B 5 5.049 23.496 -4.184 1.00 46.93 H ATOM 1224 H4' DG B 5 4.080 23.369 -6.267 1.00 47.34 H ATOM 1225 H3' DG B 5 6.006 21.520 -5.679 1.00 47.51 H ATOM 1226 H2' DG B 5 7.081 21.572 -7.598 1.00 47.85 H ATOM 1227 H2'' DG B 5 5.755 21.010 -8.281 1.00 47.85 H ATOM 1228 H1' DG B 5 5.106 23.020 -8.944 1.00 47.04 H ATOM 1229 H8 DG B 5 8.337 24.222 -7.724 1.00 45.51 H ATOM 1230 H1 DG B 5 8.050 23.824 -13.824 1.00 47.88 H ATOM 1231 H21 DG B 5 5.109 22.470 -13.506 1.00 53.22 H ATOM 1232 H22 DG B 5 6.151 22.913 -14.474 1.00 53.22 H ATOM 1233 P DC B 6 4.402 19.373 -6.278 1.00 44.51 P ANISOU 1233 P DC B 6 6697 5119 5096 1453 -1131 -447 P ATOM 1234 OP1 DC B 6 3.217 18.904 -5.521 1.00 46.92 O ANISOU 1234 OP1 DC B 6 6961 5312 5554 1344 -1140 -327 O ATOM 1235 OP2 DC B 6 5.759 18.976 -5.844 1.00 41.70 O ANISOU 1235 OP2 DC B 6 6437 4798 4608 1437 -1191 -562 O ATOM 1236 O5' DC B 6 4.346 18.895 -7.775 1.00 45.13 O ANISOU 1236 O5' DC B 6 6728 5245 5175 1600 -1350 -505 O ATOM 1237 C5' DC B 6 3.385 19.436 -8.650 1.00 45.37 C ANISOU 1237 C5' DC B 6 6660 5298 5280 1664 -1317 -421 C ATOM 1238 C4' DC B 6 3.633 18.930 -10.042 1.00 46.09 C ANISOU 1238 C4' DC B 6 6740 5450 5321 1791 -1538 -508 C ATOM 1239 O4' DC B 6 4.716 19.695 -10.664 1.00 44.76 O ANISOU 1239 O4' DC B 6 6616 5382 5007 1892 -1445 -606 O ATOM 1240 C3' DC B 6 4.064 17.466 -10.100 1.00 51.93 C ANISOU 1240 C3' DC B 6 7538 6142 6050 1785 -1811 -608 C ATOM 1241 O3' DC B 6 3.309 16.779 -11.110 1.00 59.09 O ANISOU 1241 O3' DC B 6 8391 7042 7017 1828 -2024 -600 O ATOM 1242 C2' DC B 6 5.569 17.550 -10.408 1.00 49.53 C ANISOU 1242 C2' DC B 6 7323 5908 5588 1865 -1814 -757 C ATOM 1243 C1' DC B 6 5.645 18.808 -11.253 1.00 46.70 C ANISOU 1243 C1' DC B 6 6929 5649 5165 1959 -1654 -750 C ATOM 1244 N1 DC B 6 6.973 19.475 -11.269 1.00 45.50 N ANISOU 1244 N1 DC B 6 6846 5573 4868 2013 -1526 -851 N ATOM 1245 C2 DC B 6 7.598 19.759 -12.490 1.00 44.44 C ANISOU 1245 C2 DC B 6 6726 5523 4635 2146 -1562 -944 C ATOM 1246 O2 DC B 6 7.049 19.427 -13.543 1.00 46.68 O ANISOU 1246 O2 DC B 6 6973 5820 4942 2213 -1707 -943 O ATOM 1247 N3 DC B 6 8.794 20.399 -12.480 1.00 41.54 N ANISOU 1247 N3 DC B 6 6415 5224 4143 2192 -1435 -1031 N ATOM 1248 C4 DC B 6 9.353 20.747 -11.335 1.00 40.43 C ANISOU 1248 C4 DC B 6 6313 5078 3970 2102 -1287 -1028 C ATOM 1249 N4 DC B 6 10.512 21.382 -11.389 1.00 39.60 N ANISOU 1249 N4 DC B 6 6256 5048 3742 2142 -1169 -1113 N ATOM 1250 C5 DC B 6 8.742 20.472 -10.076 1.00 42.38 C ANISOU 1250 C5 DC B 6 6554 5244 4304 1958 -1250 -935 C ATOM 1251 C6 DC B 6 7.559 19.848 -10.089 1.00 45.25 C ANISOU 1251 C6 DC B 6 6863 5533 4798 1923 -1367 -849 C ATOM 1252 H5' DC B 6 3.449 20.404 -8.642 1.00 54.44 H ATOM 1253 H5'' DC B 6 2.498 19.168 -8.362 1.00 54.44 H ATOM 1254 H4' DC B 6 2.825 19.043 -10.567 1.00 55.30 H ATOM 1255 H3' DC B 6 3.924 17.045 -9.237 1.00 62.31 H ATOM 1256 H2' DC B 6 6.084 17.650 -9.592 1.00 59.44 H ATOM 1257 H2'' DC B 6 5.863 16.776 -10.913 1.00 59.44 H ATOM 1258 H1' DC B 6 5.370 18.606 -12.161 1.00 56.04 H ATOM 1259 H41 DC B 6 10.904 21.623 -10.662 1.00 47.52 H ATOM 1260 H42 DC B 6 10.874 21.554 -12.150 1.00 47.52 H ATOM 1261 H5 DC B 6 9.144 20.729 -9.278 1.00 50.85 H ATOM 1262 H6 DC B 6 7.131 19.660 -9.285 1.00 54.30 H HETATM 1263 P C7R B 7 2.932 15.221 -11.136 1.00 65.68 P ANISOU 1263 P C7R B 7 9242 7786 7926 1781 -2299 -633 P HETATM 1264 C5' C7R B 7 4.889 15.371 -12.775 1.00 70.46 C ANISOU 1264 C5' C7R B 7 9961 8527 8283 1988 -2376 -877 C HETATM 1265 O5' C7R B 7 3.719 14.720 -12.428 1.00 67.79 O ANISOU 1265 O5' C7R B 7 9568 8109 8082 1896 -2475 -783 O HETATM 1266 C4' C7R B 7 5.363 14.960 -14.131 1.00 75.09 C ANISOU 1266 C4' C7R B 7 10589 9160 8782 2094 -2534 -999 C HETATM 1267 O4' C7R B 7 6.448 15.839 -14.503 1.00 73.46 O ANISOU 1267 O4' C7R B 7 10423 9043 8444 2190 -2396 -1076 O HETATM 1268 C3' C7R B 7 5.914 13.538 -14.193 1.00 78.47 C ANISOU 1268 C3' C7R B 7 11101 9507 9206 2093 -2743 -1115 C HETATM 1269 O3' C7R B 7 5.661 12.913 -15.460 1.00 81.41 O ANISOU 1269 O3' C7R B 7 11491 9886 9554 2140 -2929 -1186 O HETATM 1270 C2' C7R B 7 7.398 13.728 -13.923 1.00 75.38 C ANISOU 1270 C2' C7R B 7 10788 9145 8709 2155 -2658 -1217 C HETATM 1271 C1' C7R B 7 7.683 15.162 -14.395 1.00 71.12 C ANISOU 1271 C1' C7R B 7 10220 8724 8077 2228 -2466 -1207 C HETATM 1272 N1 C7R B 7 8.590 15.938 -13.480 1.00 63.49 N ANISOU 1272 N1 C7R B 7 9277 7794 7052 2215 -2265 -1208 N HETATM 1273 C2 C7R B 7 9.562 16.764 -14.039 1.00 59.68 C ANISOU 1273 C2 C7R B 7 8823 7405 6446 2312 -2150 -1285 C HETATM 1274 O2 C7R B 7 9.628 16.871 -15.272 1.00 60.14 O ANISOU 1274 O2 C7R B 7 8890 7512 6449 2410 -2208 -1346 O HETATM 1275 N3 C7R B 7 10.398 17.436 -13.221 1.00 55.29 N ANISOU 1275 N3 C7R B 7 8289 6886 5831 2287 -1977 -1291 N HETATM 1276 C4 C7R B 7 10.300 17.314 -11.908 1.00 53.50 C ANISOU 1276 C4 C7R B 7 8063 6612 5654 2168 -1920 -1223 C HETATM 1277 N4 C7R B 7 11.155 18.016 -11.159 1.00 50.50 N ANISOU 1277 N4 C7R B 7 7710 6281 5197 2133 -1750 -1234 N HETATM 1278 C5 C7R B 7 9.325 16.464 -11.305 1.00 56.30 C ANISOU 1278 C5 C7R B 7 8392 6866 6132 2072 -2033 -1143 C HETATM 1279 C6 C7R B 7 8.496 15.802 -12.123 1.00 59.90 C ANISOU 1279 C6 C7R B 7 8821 7283 6656 2102 -2202 -1139 C HETATM 1280 OP1 C7R B 7 1.464 15.123 -11.470 1.00 68.27 O ANISOU 1280 OP1 C7R B 7 9462 8090 8389 1740 -2363 -506 O HETATM 1281 SP2 C7R B 7 3.785 14.369 -9.603 1.00 66.12 S ANISOU 1281 SP2 C7R B 7 9401 7746 7976 1684 -2308 -680 S HETATM 1282 H5'2 C7R B 7 4.731 16.328 -12.771 1.00 84.55 H HETATM 1283 H5'1 C7R B 7 5.574 15.160 -12.122 1.00 84.55 H HETATM 1284 H4' C7R B 7 4.638 15.054 -14.769 1.00 90.11 H HETATM 1285 H3' C7R B 7 5.521 13.006 -13.483 1.00 94.16 H HETATM 1286 H2'1 C7R B 7 7.920 13.092 -14.435 1.00 90.46 H HETATM 1287 H2'2 C7R B 7 7.585 13.639 -12.975 1.00 90.46 H HETATM 1288 H1' C7R B 7 8.091 15.123 -15.274 1.00 85.34 H HETATM 1289 H42 C7R B 7 11.740 18.522 -11.535 1.00 60.60 H HETATM 1290 H41 C7R B 7 11.121 17.961 -10.302 1.00 60.60 H HETATM 1291 H5 C7R B 7 9.261 16.381 -10.381 1.00 67.56 H HETATM 1292 H6 C7R B 7 7.853 15.234 -11.762 1.00 71.88 H ATOM 1293 P DA B 8 6.131 11.390 -15.684 1.00 83.13 P ANISOU 1293 P DA B 8 11804 10005 9777 2140 -3141 -1311 P ATOM 1294 OP1 DA B 8 5.062 10.730 -16.459 1.00 87.43 O ANISOU 1294 OP1 DA B 8 12325 10523 10373 2094 -3320 -1298 O ATOM 1295 OP2 DA B 8 6.551 10.800 -14.392 1.00 81.89 O ANISOU 1295 OP2 DA B 8 11677 9758 9681 2081 -3124 -1297 O ATOM 1296 O5' DA B 8 7.446 11.551 -16.590 1.00 80.43 O ANISOU 1296 O5' DA B 8 11548 9720 9291 2271 -3127 -1462 O ATOM 1297 C5' DA B 8 7.399 12.338 -17.780 1.00 78.00 C ANISOU 1297 C5' DA B 8 11223 9513 8900 2337 -3071 -1483 C ATOM 1298 C4' DA B 8 8.792 12.580 -18.350 1.00 75.15 C ANISOU 1298 C4' DA B 8 10929 9182 8442 2435 -2961 -1603 C ATOM 1299 O4' DA B 8 9.552 13.445 -17.448 1.00 68.95 O ANISOU 1299 O4' DA B 8 10141 8452 7606 2473 -2813 -1585 O ATOM 1300 C3' DA B 8 9.638 11.323 -18.553 1.00 77.97 C ANISOU 1300 C3' DA B 8 11369 9427 8828 2446 -3029 -1712 C ATOM 1301 O3' DA B 8 10.271 11.354 -19.849 1.00 84.16 O ANISOU 1301 O3' DA B 8 12196 10234 9546 2526 -2996 -1803 O ATOM 1302 C2' DA B 8 10.640 11.367 -17.387 1.00 72.38 C ANISOU 1302 C2' DA B 8 10677 8701 8123 2462 -2947 -1715 C ATOM 1303 C1' DA B 8 10.805 12.858 -17.143 1.00 65.34 C ANISOU 1303 C1' DA B 8 9743 7939 7146 2500 -2785 -1669 C ATOM 1304 N9 DA B 8 11.153 13.231 -15.766 1.00 55.19 N ANISOU 1304 N9 DA B 8 8449 6670 5853 2465 -2713 -1617 N ATOM 1305 C8 DA B 8 10.549 12.815 -14.610 1.00 52.07 C ANISOU 1305 C8 DA B 8 8024 6206 5553 2354 -2743 -1524 C ATOM 1306 N7 DA B 8 11.046 13.373 -13.516 1.00 48.42 N ANISOU 1306 N7 DA B 8 7550 5771 5078 2308 -2597 -1474 N ATOM 1307 C5 DA B 8 12.035 14.203 -13.996 1.00 46.96 C ANISOU 1307 C5 DA B 8 7385 5681 4778 2400 -2479 -1544 C ATOM 1308 C6 DA B 8 12.932 15.064 -13.354 1.00 45.90 C ANISOU 1308 C6 DA B 8 7252 5619 4569 2395 -2305 -1542 C ATOM 1309 N6 DA B 8 12.979 15.218 -12.029 1.00 44.30 N ANISOU 1309 N6 DA B 8 7035 5405 4391 2285 -2220 -1463 N ATOM 1310 N1 DA B 8 13.791 15.756 -14.126 1.00 46.36 N ANISOU 1310 N1 DA B 8 7332 5763 4521 2500 -2220 -1626 N ATOM 1311 C2 DA B 8 13.743 15.591 -15.459 1.00 47.11 C ANISOU 1311 C2 DA B 8 7428 5856 4614 2589 -2273 -1682 C ATOM 1312 N3 DA B 8 12.945 14.811 -16.174 1.00 47.79 N ANISOU 1312 N3 DA B 8 7520 5879 4760 2591 -2425 -1691 N ATOM 1313 C4 DA B 8 12.109 14.135 -15.379 1.00 49.21 C ANISOU 1313 C4 DA B 8 7697 5992 5010 2505 -2552 -1633 C ATOM 1314 H5' DA B 8 6.987 13.192 -17.579 1.00 93.60 H ATOM 1315 H5'' DA B 8 6.862 11.877 -18.444 1.00 93.60 H ATOM 1316 H4' DA B 8 8.701 13.030 -19.204 1.00 90.18 H ATOM 1317 H3' DA B 8 9.079 10.534 -18.477 1.00 93.56 H ATOM 1318 H2' DA B 8 10.274 10.929 -16.602 1.00 86.86 H ATOM 1319 H2'' DA B 8 11.485 10.966 -17.644 1.00 86.86 H ATOM 1320 H1' DA B 8 11.477 13.208 -17.748 1.00 78.41 H ATOM 1321 H8 DA B 8 9.849 12.203 -14.595 1.00 62.48 H ATOM 1322 H61 DA B 8 13.552 15.755 -11.678 1.00 53.16 H ATOM 1323 H62 DA B 8 12.435 14.781 -11.526 1.00 53.16 H ATOM 1324 H2 DA B 8 14.356 16.093 -15.947 1.00 56.53 H ATOM 1325 P DT B 9 11.203 10.141 -20.355 1.00 88.91 P ANISOU 1325 P DT B 9 12884 10729 10169 2569 -3055 -1912 P ATOM 1326 OP1 DT B 9 11.170 10.152 -21.836 1.00 91.09 O ANISOU 1326 OP1 DT B 9 13191 11034 10385 2605 -3069 -1969 O ATOM 1327 OP2 DT B 9 10.814 8.928 -19.600 1.00 92.52 O ANISOU 1327 OP2 DT B 9 13367 11064 10723 2493 -3192 -1905 O ATOM 1328 O5' DT B 9 12.673 10.576 -19.886 1.00 84.45 O ANISOU 1328 O5' DT B 9 12323 10191 9573 2659 -2914 -1936 O ATOM 1329 C5' DT B 9 13.120 11.908 -20.135 1.00 78.93 C ANISOU 1329 C5' DT B 9 11582 9613 8794 2720 -2753 -1918 C ATOM 1330 C4' DT B 9 14.473 12.174 -19.495 1.00 72.76 C ANISOU 1330 C4' DT B 9 10791 8853 8001 2775 -2639 -1921 C ATOM 1331 O4' DT B 9 14.299 12.566 -18.111 1.00 66.96 O ANISOU 1331 O4' DT B 9 10028 8139 7276 2712 -2600 -1859 O ATOM 1332 C3' DT B 9 15.426 10.976 -19.474 1.00 73.58 C ANISOU 1332 C3' DT B 9 10942 8861 8153 2813 -2711 -1975 C ATOM 1333 O3' DT B 9 16.531 11.210 -20.344 1.00 79.84 O ANISOU 1333 O3' DT B 9 11732 9701 8904 2902 -2632 -2005 O ATOM 1334 C2' DT B 9 15.847 10.854 -18.004 1.00 68.71 C ANISOU 1334 C2' DT B 9 10312 8227 7567 2776 -2699 -1937 C ATOM 1335 C1' DT B 9 15.449 12.196 -17.414 1.00 63.05 C ANISOU 1335 C1' DT B 9 9541 7620 6796 2732 -2573 -1869 C ATOM 1336 N1 DT B 9 15.149 12.166 -15.940 1.00 55.38 N ANISOU 1336 N1 DT B 9 8560 6637 5846 2640 -2589 -1809 N ATOM 1337 C2 DT B 9 15.804 13.042 -15.104 1.00 50.08 C ANISOU 1337 C2 DT B 9 7860 6051 5118 2623 -2454 -1771 C ATOM 1338 O2 DT B 9 16.629 13.849 -15.494 1.00 49.14 O ANISOU 1338 O2 DT B 9 7713 6014 4944 2677 -2319 -1781 O ATOM 1339 N3 DT B 9 15.455 12.947 -13.784 1.00 47.58 N ANISOU 1339 N3 DT B 9 7545 5722 4813 2525 -2482 -1710 N ATOM 1340 C4 DT B 9 14.540 12.088 -13.226 1.00 46.87 C ANISOU 1340 C4 DT B 9 7467 5543 4798 2449 -2629 -1668 C ATOM 1341 O4 DT B 9 14.314 12.070 -12.036 1.00 46.04 O ANISOU 1341 O4 DT B 9 7356 5433 4706 2359 -2637 -1595 O ATOM 1342 C5 DT B 9 13.886 11.193 -14.146 1.00 49.11 C ANISOU 1342 C5 DT B 9 7770 5738 5152 2471 -2761 -1707 C ATOM 1343 C7 DT B 9 12.878 10.204 -13.639 1.00 48.98 C ANISOU 1343 C7 DT B 9 7760 5617 5235 2384 -2920 -1658 C ATOM 1344 C6 DT B 9 14.211 11.276 -15.449 1.00 52.97 C ANISOU 1344 C6 DT B 9 8272 6240 5614 2561 -2736 -1781 C ATOM 1345 H5' DT B 9 12.472 12.532 -19.773 1.00 94.71 H ATOM 1346 H5'' DT B 9 13.191 12.045 -21.093 1.00 94.71 H ATOM 1347 H4' DT B 9 14.903 12.901 -19.972 1.00 87.31 H ATOM 1348 H3' DT B 9 14.953 10.175 -19.749 1.00 88.29 H ATOM 1349 H2' DT B 9 15.365 10.133 -17.570 1.00 82.45 H ATOM 1350 H2'' DT B 9 16.805 10.720 -17.933 1.00 82.45 H ATOM 1351 H1' DT B 9 16.150 12.844 -17.586 1.00 75.66 H ATOM 1352 H3 DT B 9 15.856 13.482 -13.243 1.00 57.10 H ATOM 1353 H71 DT B 9 12.021 10.369 -14.065 1.00 58.78 H ATOM 1354 H72 DT B 9 13.174 9.304 -13.847 1.00 58.78 H ATOM 1355 H73 DT B 9 12.785 10.300 -12.679 1.00 58.78 H ATOM 1356 H6 DT B 9 13.792 10.700 -16.047 1.00 63.56 H ATOM 1357 P DT B 10 17.760 10.169 -20.422 1.00 85.43 P ANISOU 1357 P DT B 10 12478 10343 9640 2962 -2679 -2051 P ATOM 1358 OP1 DT B 10 18.191 10.118 -21.836 1.00 89.79 O ANISOU 1358 OP1 DT B 10 13051 10915 10149 3015 -2659 -2093 O ATOM 1359 OP2 DT B 10 17.390 8.922 -19.711 1.00 87.90 O ANISOU 1359 OP2 DT B 10 12844 10524 10029 2926 -2825 -2075 O ATOM 1360 O5' DT B 10 18.908 10.914 -19.593 1.00 81.96 O ANISOU 1360 O5' DT B 10 11977 9990 9173 2985 -2554 -2004 O ATOM 1361 C5' DT B 10 18.971 12.337 -19.643 1.00 75.43 C ANISOU 1361 C5' DT B 10 11084 9290 8285 2973 -2401 -1951 C ATOM 1362 C4' DT B 10 20.029 12.881 -18.709 1.00 67.88 C ANISOU 1362 C4' DT B 10 10079 8403 7309 2966 -2299 -1911 C ATOM 1363 O4' DT B 10 19.528 12.887 -17.339 1.00 62.84 O ANISOU 1363 O4' DT B 10 9444 7742 6690 2896 -2314 -1882 O ATOM 1364 C3' DT B 10 21.328 12.086 -18.662 1.00 68.03 C ANISOU 1364 C3' DT B 10 10112 8395 7343 3025 -2340 -1942 C ATOM 1365 O3' DT B 10 22.421 12.993 -18.475 1.00 71.69 O ANISOU 1365 O3' DT B 10 10512 8968 7757 3026 -2204 -1904 O ATOM 1366 C2' DT B 10 21.110 11.168 -17.456 1.00 64.13 C ANISOU 1366 C2' DT B 10 9658 7803 6904 3003 -2454 -1954 C ATOM 1367 C1' DT B 10 20.383 12.110 -16.513 1.00 59.95 C ANISOU 1367 C1' DT B 10 9096 7329 6352 2910 -2373 -1896 C ATOM 1368 N1 DT B 10 19.540 11.480 -15.458 1.00 54.09 N ANISOU 1368 N1 DT B 10 8392 6505 5655 2832 -2477 -1884 N ATOM 1369 C2 DT B 10 19.631 11.964 -14.170 1.00 50.67 C ANISOU 1369 C2 DT B 10 7937 6123 5191 2747 -2423 -1828 C ATOM 1370 O2 DT B 10 20.408 12.842 -13.839 1.00 49.84 O ANISOU 1370 O2 DT B 10 7790 6120 5026 2738 -2292 -1803 O ATOM 1371 N3 DT B 10 18.791 11.380 -13.274 1.00 49.59 N ANISOU 1371 N3 DT B 10 7826 5922 5095 2656 -2528 -1790 N ATOM 1372 C4 DT B 10 17.872 10.395 -13.514 1.00 50.74 C ANISOU 1372 C4 DT B 10 8010 5953 5317 2640 -2675 -1804 C ATOM 1373 O4 DT B 10 17.170 9.933 -12.621 1.00 51.20 O ANISOU 1373 O4 DT B 10 8073 5962 5420 2547 -2761 -1744 O ATOM 1374 C5 DT B 10 17.810 9.922 -14.885 1.00 52.02 C ANISOU 1374 C5 DT B 10 8202 6059 5503 2731 -2723 -1881 C ATOM 1375 C7 DT B 10 16.856 8.825 -15.260 1.00 54.11 C ANISOU 1375 C7 DT B 10 8515 6201 5844 2707 -2881 -1907 C ATOM 1376 C6 DT B 10 18.631 10.493 -15.790 1.00 52.55 C ANISOU 1376 C6 DT B 10 8248 6196 5522 2821 -2622 -1914 C ATOM 1377 H5' DT B 10 18.108 12.701 -19.389 1.00 90.51 H ATOM 1378 H5'' DT B 10 19.177 12.613 -20.549 1.00 90.51 H ATOM 1379 H4' DT B 10 20.233 13.793 -18.969 1.00 81.46 H ATOM 1380 H3' DT B 10 21.443 11.568 -19.474 1.00 81.64 H ATOM 1381 H2' DT B 10 20.553 10.410 -17.691 1.00 76.95 H ATOM 1382 H2'' DT B 10 21.956 10.881 -17.079 1.00 76.95 H ATOM 1383 H1' DT B 10 21.031 12.696 -16.091 1.00 71.94 H ATOM 1384 H3 DT B 10 18.843 11.663 -12.463 1.00 59.51 H ATOM 1385 H71 DT B 10 16.360 8.546 -14.474 1.00 64.93 H ATOM 1386 H72 DT B 10 16.239 9.150 -15.934 1.00 64.93 H ATOM 1387 H73 DT B 10 17.354 8.071 -15.613 1.00 64.93 H ATOM 1388 H6 DT B 10 18.591 10.203 -16.672 1.00 63.06 H ATOM 1389 P DA B 11 23.886 12.683 -19.047 1.00 75.14 P ANISOU 1389 P DA B 11 10547 9755 8247 3221 556 614 P ATOM 1390 OP1 DA B 11 24.326 13.894 -19.769 1.00 77.69 O ANISOU 1390 OP1 DA B 11 10913 10129 8477 3224 600 693 O ATOM 1391 OP2 DA B 11 23.870 11.367 -19.725 1.00 76.28 O ANISOU 1391 OP2 DA B 11 10496 10026 8461 3348 450 541 O ATOM 1392 O5' DA B 11 24.778 12.539 -17.729 1.00 75.12 O ANISOU 1392 O5' DA B 11 10652 9685 8204 3017 536 651 O ATOM 1393 C5' DA B 11 24.666 13.492 -16.670 1.00 73.64 C ANISOU 1393 C5' DA B 11 10664 9340 7976 2870 633 701 C ATOM 1394 C4' DA B 11 25.205 12.915 -15.370 1.00 70.83 C ANISOU 1394 C4' DA B 11 10376 8913 7624 2709 599 700 C ATOM 1395 O4' DA B 11 24.127 12.260 -14.639 1.00 66.68 O ANISOU 1395 O4' DA B 11 9868 8269 7198 2729 624 623 O ATOM 1396 C3' DA B 11 26.287 11.837 -15.544 1.00 70.88 C ANISOU 1396 C3' DA B 11 10249 9057 7624 2693 469 689 C ATOM 1397 O3' DA B 11 27.248 11.921 -14.519 1.00 73.54 O ANISOU 1397 O3' DA B 11 10687 9351 7905 2507 453 739 O ATOM 1398 C2' DA B 11 25.488 10.558 -15.430 1.00 66.25 C ANISOU 1398 C2' DA B 11 9557 8463 7154 2786 422 588 C ATOM 1399 C1' DA B 11 24.542 10.952 -14.316 1.00 63.03 C ANISOU 1399 C1' DA B 11 9306 7860 6783 2714 522 573 C ATOM 1400 N9 DA B 11 23.386 10.093 -14.180 1.00 57.19 N ANISOU 1400 N9 DA B 11 8507 7066 6157 2813 522 479 N ATOM 1401 C8 DA B 11 22.854 9.263 -15.125 1.00 56.34 C ANISOU 1401 C8 DA B 11 8229 7056 6122 2988 467 408 C ATOM 1402 N7 DA B 11 21.807 8.590 -14.712 1.00 54.18 N ANISOU 1402 N7 DA B 11 7940 6700 5947 3042 482 330 N ATOM 1403 C5 DA B 11 21.652 9.007 -13.400 1.00 51.91 C ANISOU 1403 C5 DA B 11 7825 6250 5650 2890 550 351 C ATOM 1404 C6 DA B 11 20.727 8.665 -12.407 1.00 48.64 C ANISOU 1404 C6 DA B 11 7484 5687 5310 2858 596 298 C ATOM 1405 N6 DA B 11 19.743 7.789 -12.602 1.00 48.23 N ANISOU 1405 N6 DA B 11 7336 5627 5361 2982 578 209 N ATOM 1406 N1 DA B 11 20.857 9.257 -11.201 1.00 47.48 N ANISOU 1406 N1 DA B 11 7514 5399 5128 2691 660 341 N ATOM 1407 C2 DA B 11 21.851 10.137 -11.012 1.00 47.76 C ANISOU 1407 C2 DA B 11 7645 5443 5059 2566 677 430 C ATOM 1408 N3 DA B 11 22.781 10.542 -11.864 1.00 49.14 N ANISOU 1408 N3 DA B 11 7766 5750 5155 2580 639 488 N ATOM 1409 C4 DA B 11 22.623 9.931 -13.056 1.00 52.91 C ANISOU 1409 C4 DA B 11 8067 6365 5670 2748 575 443 C ATOM 1410 H5' DA B 11 23.733 13.730 -16.552 1.00 88.37 H ATOM 1411 H5'' DA B 11 25.171 14.287 -16.901 1.00 88.37 H ATOM 1412 H4' DA B 11 25.562 13.636 -14.828 1.00 85.00 H ATOM 1413 H3' DA B 11 26.703 11.906 -16.417 1.00 85.05 H ATOM 1414 H2' DA B 11 25.008 10.368 -16.250 1.00 79.51 H ATOM 1415 H2'' DA B 11 26.052 9.814 -15.166 1.00 79.51 H ATOM 1416 H1' DA B 11 25.027 10.969 -13.477 1.00 75.64 H ATOM 1417 H8 DA B 11 23.195 9.191 -15.987 1.00 67.61 H ATOM 1418 H61 DA B 11 19.198 7.606 -11.962 1.00 57.87 H ATOM 1419 H62 DA B 11 19.653 7.407 -13.367 1.00 57.87 H ATOM 1420 H2 DA B 11 21.892 10.518 -10.165 1.00 57.31 H ATOM 1421 P DG B 12 28.567 12.819 -14.686 1.00 74.39 P ANISOU 1421 P DG B 12 10853 9524 7886 2398 447 842 P ATOM 1422 OP1 DG B 12 28.159 14.187 -15.084 1.00 74.11 O ANISOU 1422 OP1 DG B 12 10916 9442 7799 2418 551 895 O ATOM 1423 OP2 DG B 12 29.513 12.038 -15.510 1.00 75.72 O ANISOU 1423 OP2 DG B 12 10855 9876 8040 2452 328 838 O ATOM 1424 O5' DG B 12 29.110 12.886 -13.184 1.00 72.02 O ANISOU 1424 O5' DG B 12 10704 9105 7556 2189 462 877 O ATOM 1425 C5' DG B 12 28.293 13.463 -12.181 1.00 67.90 C ANISOU 1425 C5' DG B 12 10346 8400 7053 2112 566 877 C ATOM 1426 C4' DG B 12 28.271 12.612 -10.930 1.00 62.44 C ANISOU 1426 C4' DG B 12 9696 7617 6412 2007 539 837 C ATOM 1427 O4' DG B 12 27.172 11.669 -10.974 1.00 59.63 O ANISOU 1427 O4' DG B 12 9254 7233 6171 2126 526 740 O ATOM 1428 C3' DG B 12 29.518 11.765 -10.694 1.00 60.07 C ANISOU 1428 C3' DG B 12 9325 7414 6086 1924 426 848 C ATOM 1429 O3' DG B 12 29.847 11.869 -9.363 1.00 60.10 O ANISOU 1429 O3' DG B 12 9468 7299 6068 1748 449 874 O ATOM 1430 C2' DG B 12 29.078 10.348 -11.076 1.00 56.48 C ANISOU 1430 C2' DG B 12 8697 7031 5732 2053 340 753 C ATOM 1431 C1' DG B 12 27.647 10.378 -10.606 1.00 55.08 C ANISOU 1431 C1' DG B 12 8583 6708 5637 2100 423 695 C ATOM 1432 N9 DG B 12 26.759 9.391 -11.194 1.00 49.12 N ANISOU 1432 N9 DG B 12 7682 5997 4986 2267 384 602 N ATOM 1433 C8 DG B 12 26.709 8.977 -12.492 1.00 47.79 C ANISOU 1433 C8 DG B 12 7344 5975 4838 2432 326 571 C ATOM 1434 N7 DG B 12 25.756 8.117 -12.727 1.00 45.77 N ANISOU 1434 N7 DG B 12 6990 5717 4683 2559 307 484 N ATOM 1435 C5 DG B 12 25.122 7.968 -11.503 1.00 43.65 C ANISOU 1435 C5 DG B 12 6835 5288 4463 2472 357 455 C ATOM 1436 C6 DG B 12 24.020 7.166 -11.132 1.00 41.20 C ANISOU 1436 C6 DG B 12 6493 4901 4261 2539 364 367 C ATOM 1437 O6 DG B 12 23.355 6.383 -11.838 1.00 40.38 O ANISOU 1437 O6 DG B 12 6249 4859 4235 2695 325 294 O ATOM 1438 N1 DG B 12 23.715 7.310 -9.781 1.00 40.61 N ANISOU 1438 N1 DG B 12 6570 4662 4200 2404 422 368 N ATOM 1439 C2 DG B 12 24.391 8.114 -8.902 1.00 42.25 C ANISOU 1439 C2 DG B 12 6937 4789 4326 2227 466 444 C ATOM 1440 N2 DG B 12 23.954 8.109 -7.633 1.00 43.13 N ANISOU 1440 N2 DG B 12 7179 4741 4467 2115 518 431 N ATOM 1441 N3 DG B 12 25.415 8.875 -9.237 1.00 43.91 N ANISOU 1441 N3 DG B 12 7178 5069 4436 2163 461 526 N ATOM 1442 C4 DG B 12 25.728 8.746 -10.550 1.00 45.66 C ANISOU 1442 C4 DG B 12 7255 5452 4644 2293 405 527 C ATOM 1443 H5' DG B 12 27.388 13.551 -12.521 1.00 81.48 H ATOM 1444 H5'' DG B 12 28.635 14.343 -11.960 1.00 81.48 H ATOM 1445 H4' DG B 12 28.146 13.195 -10.165 1.00 74.93 H ATOM 1446 H3' DG B 12 30.249 12.064 -11.257 1.00 72.09 H ATOM 1447 H2' DG B 12 29.130 10.212 -12.035 1.00 67.78 H ATOM 1448 H2'' DG B 12 29.591 9.680 -10.594 1.00 67.78 H ATOM 1449 H1' DG B 12 27.626 10.293 -9.640 1.00 66.10 H ATOM 1450 H8 DG B 12 27.290 9.286 -13.149 1.00 57.34 H ATOM 1451 H1 DG B 12 23.065 6.841 -9.470 1.00 48.74 H ATOM 1452 H21 DG B 12 24.341 8.601 -7.043 1.00 51.75 H ATOM 1453 H22 DG B 12 23.287 7.615 -7.410 1.00 51.75 H ATOM 1454 P DA B 13 31.295 11.479 -8.828 1.00 59.08 P ANISOU 1454 P DA B 13 9340 7229 5878 1600 365 919 P ATOM 1455 OP1 DA B 13 32.004 12.768 -8.698 1.00 60.65 O ANISOU 1455 OP1 DA B 13 9671 7406 5967 1485 422 1018 O ATOM 1456 OP2 DA B 13 31.847 10.351 -9.616 1.00 59.44 O ANISOU 1456 OP2 DA B 13 9191 7443 5951 1693 241 880 O ATOM 1457 O5' DA B 13 30.971 10.909 -7.381 1.00 56.38 O ANISOU 1457 O5' DA B 13 9089 6742 5589 1482 376 882 O ATOM 1458 C5' DA B 13 29.967 11.543 -6.600 1.00 53.85 C ANISOU 1458 C5' DA B 13 8919 6247 5295 1442 487 876 C ATOM 1459 C4' DA B 13 29.355 10.573 -5.626 1.00 50.44 C ANISOU 1459 C4' DA B 13 8495 5716 4952 1413 473 803 C ATOM 1460 O4' DA B 13 28.471 9.643 -6.317 1.00 48.31 O ANISOU 1460 O4' DA B 13 8074 5499 4782 1589 436 713 O ATOM 1461 C3' DA B 13 30.356 9.708 -4.886 1.00 50.36 C ANISOU 1461 C3' DA B 13 8465 5735 4933 1292 383 805 C ATOM 1462 O3' DA B 13 29.884 9.520 -3.570 1.00 52.97 O ANISOU 1462 O3' DA B 13 8914 5908 5304 1184 424 782 O ATOM 1463 C2' DA B 13 30.382 8.413 -5.714 1.00 48.86 C ANISOU 1463 C2' DA B 13 8066 5690 4810 1433 272 734 C ATOM 1464 C1' DA B 13 28.928 8.303 -6.137 1.00 47.69 C ANISOU 1464 C1' DA B 13 7878 5492 4751 1588 325 663 C ATOM 1465 N9 DA B 13 28.656 7.574 -7.387 1.00 44.76 N ANISOU 1465 N9 DA B 13 7313 5262 4431 1776 258 607 N ATOM 1466 C8 DA B 13 29.275 7.707 -8.609 1.00 43.39 C ANISOU 1466 C8 DA B 13 7025 5249 4212 1864 208 635 C ATOM 1467 N7 DA B 13 28.750 6.950 -9.557 1.00 40.75 N ANISOU 1467 N7 DA B 13 6527 5010 3946 2037 158 568 N ATOM 1468 C5 DA B 13 27.714 6.297 -8.901 1.00 41.14 C ANISOU 1468 C5 DA B 13 6589 4952 4092 2061 179 492 C ATOM 1469 C6 DA B 13 26.754 5.366 -9.332 1.00 41.07 C ANISOU 1469 C6 DA B 13 6455 4963 4187 2213 151 399 C ATOM 1470 N6 DA B 13 26.691 4.902 -10.581 1.00 41.67 N ANISOU 1470 N6 DA B 13 6362 5182 4289 2375 92 366 N ATOM 1471 N1 DA B 13 25.863 4.920 -8.421 1.00 39.79 N ANISOU 1471 N1 DA B 13 6348 4667 4103 2191 186 342 N ATOM 1472 C2 DA B 13 25.926 5.377 -7.180 1.00 39.93 C ANISOU 1472 C2 DA B 13 6533 4542 4095 2030 244 375 C ATOM 1473 N3 DA B 13 26.772 6.253 -6.656 1.00 40.28 N ANISOU 1473 N3 DA B 13 6708 4551 4045 1877 276 460 N ATOM 1474 C4 DA B 13 27.638 6.687 -7.580 1.00 41.10 C ANISOU 1474 C4 DA B 13 6754 4789 4074 1903 242 516 C ATOM 1475 H5' DA B 13 29.274 11.885 -7.188 1.00 64.62 H ATOM 1476 H5'' DA B 13 30.362 12.281 -6.110 1.00 64.62 H ATOM 1477 H4' DA B 13 28.835 11.071 -4.976 1.00 60.52 H ATOM 1478 H3' DA B 13 31.230 10.129 -4.880 1.00 60.43 H ATOM 1479 H2' DA B 13 30.963 8.505 -6.485 1.00 58.64 H ATOM 1480 H2'' DA B 13 30.642 7.656 -5.166 1.00 58.64 H ATOM 1481 H1' DA B 13 28.422 7.892 -5.419 1.00 57.23 H ATOM 1482 H8 DA B 13 29.998 8.273 -8.753 1.00 52.07 H ATOM 1483 H61 DA B 13 26.089 4.327 -10.796 1.00 50.00 H ATOM 1484 H62 DA B 13 27.253 5.178 -11.171 1.00 50.00 H ATOM 1485 H2 DA B 13 25.284 5.041 -6.597 1.00 47.91 H ATOM 1486 P DG B 14 30.862 9.091 -2.384 1.00 54.33 P ANISOU 1486 P DG B 14 9154 6044 5446 998 375 808 P ATOM 1487 OP1 DG B 14 30.358 9.821 -1.187 1.00 52.81 O ANISOU 1487 OP1 DG B 14 9157 5662 5245 870 479 830 O ATOM 1488 OP2 DG B 14 32.270 9.227 -2.861 1.00 56.01 O ANISOU 1488 OP2 DG B 14 9318 6394 5569 947 304 874 O ATOM 1489 O5' DG B 14 30.570 7.525 -2.212 1.00 53.83 O ANISOU 1489 O5' DG B 14 8957 6011 5484 1059 285 714 O ATOM 1490 C5' DG B 14 29.241 7.055 -1.964 1.00 51.05 C ANISOU 1490 C5' DG B 14 8597 5566 5235 1144 324 633 C ATOM 1491 C4' DG B 14 29.167 5.533 -2.107 1.00 48.10 C ANISOU 1491 C4' DG B 14 8060 5267 4947 1223 218 549 C ATOM 1492 O4' DG B 14 28.878 5.176 -3.497 1.00 47.28 O ANISOU 1492 O4' DG B 14 7786 5303 4876 1414 174 511 O ATOM 1493 C3' DG B 14 30.458 4.793 -1.754 1.00 46.88 C ANISOU 1493 C3' DG B 14 7857 5196 4759 1121 112 569 C ATOM 1494 O3' DG B 14 30.173 3.648 -0.953 1.00 48.18 O ANISOU 1494 O3' DG B 14 7994 5310 5004 1095 66 500 O ATOM 1495 C2' DG B 14 31.024 4.418 -3.120 1.00 45.84 C ANISOU 1495 C2' DG B 14 7546 5259 4612 1250 26 566 C ATOM 1496 C1' DG B 14 29.752 4.132 -3.874 1.00 45.32 C ANISOU 1496 C1' DG B 14 7389 5197 4633 1435 50 492 C ATOM 1497 N9 DG B 14 29.898 4.087 -5.322 1.00 43.28 N ANISOU 1497 N9 DG B 14 6980 5099 4366 1590 6 489 N ATOM 1498 C8 DG B 14 30.848 4.707 -6.094 1.00 43.29 C ANISOU 1498 C8 DG B 14 6955 5215 4276 1586 -16 558 C ATOM 1499 N7 DG B 14 30.718 4.461 -7.368 1.00 42.13 N ANISOU 1499 N7 DG B 14 6658 5201 4147 1748 -57 533 N ATOM 1500 C5 DG B 14 29.609 3.635 -7.438 1.00 39.61 C ANISOU 1500 C5 DG B 14 6263 4851 3936 1866 -62 442 C ATOM 1501 C6 DG B 14 29.003 3.034 -8.549 1.00 39.38 C ANISOU 1501 C6 DG B 14 6070 4921 3971 2056 -100 378 C ATOM 1502 O6 DG B 14 29.327 3.132 -9.725 1.00 39.46 O ANISOU 1502 O6 DG B 14 5970 5069 3955 2162 -137 391 O ATOM 1503 N1 DG B 14 27.917 2.255 -8.185 1.00 39.02 N ANISOU 1503 N1 DG B 14 5996 4799 4031 2122 -93 292 N ATOM 1504 C2 DG B 14 27.475 2.073 -6.890 1.00 38.90 C ANISOU 1504 C2 DG B 14 6096 4630 4054 2014 -53 270 C ATOM 1505 N2 DG B 14 26.392 1.292 -6.716 1.00 38.55 N ANISOU 1505 N2 DG B 14 6003 4529 4114 2101 -50 183 N ATOM 1506 N3 DG B 14 28.038 2.636 -5.841 1.00 39.12 N ANISOU 1506 N3 DG B 14 6278 4563 4021 1835 -16 329 N ATOM 1507 C4 DG B 14 29.102 3.392 -6.189 1.00 40.93 C ANISOU 1507 C4 DG B 14 6535 4866 4148 1770 -24 413 C ATOM 1508 H5' DG B 14 28.634 7.465 -2.599 1.00 61.26 H ATOM 1509 H5'' DG B 14 28.978 7.304 -1.064 1.00 61.26 H ATOM 1510 H4' DG B 14 28.451 5.200 -1.543 1.00 57.72 H ATOM 1511 H3' DG B 14 31.069 5.387 -1.289 1.00 56.26 H ATOM 1512 HO3' DG B 14 30.385 2.882 -1.225 1.00 57.82 H ATOM 1513 H2' DG B 14 31.505 5.162 -3.516 1.00 55.01 H ATOM 1514 H2'' DG B 14 31.582 3.627 -3.062 1.00 55.01 H ATOM 1515 H1' DG B 14 29.386 3.288 -3.567 1.00 54.38 H ATOM 1516 H8 DG B 14 31.516 5.251 -5.743 1.00 51.94 H ATOM 1517 H1 DG B 14 27.481 1.861 -8.814 1.00 46.82 H ATOM 1518 H21 DG B 14 26.076 1.166 -5.927 1.00 46.25 H ATOM 1519 H22 DG B 14 26.017 0.920 -7.395 1.00 46.25 H TER 1520 DG B 14 ATOM 1521 O5' DT C 0 29.315 -3.692 -16.130 1.00 81.20 O ANISOU 1521 O5' DT C 0 11162 10470 9220 1735 -1244 -1393 O ATOM 1522 C5' DT C 0 28.665 -4.966 -16.097 1.00 77.92 C ANISOU 1522 C5' DT C 0 10785 10053 8767 1668 -1305 -1464 C ATOM 1523 C4' DT C 0 27.836 -5.129 -14.831 1.00 71.97 C ANISOU 1523 C4' DT C 0 10084 9216 8044 1588 -1294 -1464 C ATOM 1524 O4' DT C 0 28.535 -4.534 -13.693 1.00 65.92 O ANISOU 1524 O4' DT C 0 9377 8329 7342 1588 -1260 -1439 O ATOM 1525 C3' DT C 0 26.483 -4.437 -14.860 1.00 70.14 C ANISOU 1525 C3' DT C 0 9782 9058 7811 1570 -1244 -1400 C ATOM 1526 O3' DT C 0 25.578 -5.117 -14.031 1.00 73.36 O ANISOU 1526 O3' DT C 0 10238 9414 8221 1486 -1264 -1430 O ATOM 1527 C2' DT C 0 26.817 -3.068 -14.313 1.00 64.78 C ANISOU 1527 C2' DT C 0 9083 8342 7188 1609 -1170 -1319 C ATOM 1528 C1' DT C 0 27.778 -3.440 -13.191 1.00 60.13 C ANISOU 1528 C1' DT C 0 8602 7604 6643 1584 -1190 -1360 C ATOM 1529 N1 DT C 0 28.712 -2.339 -12.767 1.00 50.49 N ANISOU 1529 N1 DT C 0 7383 6326 5474 1637 -1138 -1306 N ATOM 1530 C2 DT C 0 28.762 -1.970 -11.435 1.00 44.64 C ANISOU 1530 C2 DT C 0 6702 5470 4790 1601 -1108 -1287 C ATOM 1531 O2 DT C 0 28.088 -2.495 -10.562 1.00 42.40 O ANISOU 1531 O2 DT C 0 6469 5125 4515 1529 -1122 -1311 O ATOM 1532 N3 DT C 0 29.653 -0.975 -11.150 1.00 42.57 N ANISOU 1532 N3 DT C 0 6439 5164 4573 1654 -1063 -1239 N ATOM 1533 C4 DT C 0 30.467 -0.299 -12.033 1.00 42.42 C ANISOU 1533 C4 DT C 0 6364 5203 4550 1736 -1042 -1206 C ATOM 1534 O4 DT C 0 31.223 0.595 -11.667 1.00 40.46 O ANISOU 1534 O4 DT C 0 6119 4906 4347 1777 -1000 -1163 O ATOM 1535 C5 DT C 0 30.368 -0.722 -13.416 1.00 46.27 C ANISOU 1535 C5 DT C 0 6790 5811 4977 1770 -1075 -1228 C ATOM 1536 C7 DT C 0 31.221 -0.064 -14.475 1.00 47.15 C ANISOU 1536 C7 DT C 0 6839 5996 5078 1860 -1057 -1196 C ATOM 1537 C6 DT C 0 29.506 -1.715 -13.714 1.00 47.60 C ANISOU 1537 C6 DT C 0 6960 6024 5100 1719 -1121 -1276 C ATOM 1538 H5' DT C 0 29.335 -5.666 -16.130 1.00 93.50 H ATOM 1539 H5'' DT C 0 28.084 -5.046 -16.869 1.00 93.50 H ATOM 1540 H4' DT C 0 27.703 -6.075 -14.661 1.00 86.36 H ATOM 1541 H3' DT C 0 26.145 -4.374 -15.767 1.00 84.17 H ATOM 1542 H2' DT C 0 27.257 -2.522 -14.983 1.00 77.74 H ATOM 1543 H2'' DT C 0 26.025 -2.629 -13.963 1.00 77.74 H ATOM 1544 H1' DT C 0 27.267 -3.736 -12.421 1.00 72.16 H ATOM 1545 H3 DT C 0 29.695 -0.726 -10.327 1.00 51.09 H ATOM 1546 H71 DT C 0 31.786 -0.731 -14.896 1.00 56.57 H ATOM 1547 H72 DT C 0 30.649 0.345 -15.144 1.00 56.57 H ATOM 1548 H73 DT C 0 31.777 0.618 -14.065 1.00 56.57 H ATOM 1549 H6 DT C 0 29.439 -1.992 -14.600 1.00 57.12 H ATOM 1550 HO5' DT C 0 29.811 -3.491 -16.777 1.00 97.44 H ATOM 1551 P DC C 1 24.167 -5.634 -14.583 1.00 75.14 P ANISOU 1551 P DC C 1 10414 9740 8397 1443 -1282 -1440 P ATOM 1552 OP1 DC C 1 24.312 -7.093 -14.801 1.00 77.67 O ANISOU 1552 OP1 DC C 1 10789 10044 8678 1404 -1364 -1534 O ATOM 1553 OP2 DC C 1 23.720 -4.723 -15.661 1.00 75.86 O ANISOU 1553 OP2 DC C 1 10392 9966 8465 1503 -1239 -1374 O ATOM 1554 O5' DC C 1 23.193 -5.389 -13.346 1.00 70.34 O ANISOU 1554 O5' DC C 1 9834 9066 7826 1375 -1249 -1411 O ATOM 1555 C5' DC C 1 22.860 -4.072 -12.999 1.00 64.76 C ANISOU 1555 C5' DC C 1 9079 8367 7157 1399 -1173 -1324 C ATOM 1556 C4' DC C 1 23.016 -3.835 -11.509 1.00 58.29 C ANISOU 1556 C4' DC C 1 8337 7412 6398 1357 -1149 -1314 C ATOM 1557 O4' DC C 1 24.352 -3.351 -11.242 1.00 52.98 O ANISOU 1557 O4' DC C 1 7698 6668 5763 1406 -1135 -1305 O ATOM 1558 C3' DC C 1 22.056 -2.794 -10.976 1.00 56.27 C ANISOU 1558 C3' DC C 1 8037 7169 6172 1344 -1079 -1235 C ATOM 1559 O3' DC C 1 20.928 -3.413 -10.346 1.00 58.60 O ANISOU 1559 O3' DC C 1 8360 7445 6461 1263 -1095 -1256 O ATOM 1560 C2' DC C 1 22.874 -1.957 -10.006 1.00 54.14 C ANISOU 1560 C2' DC C 1 7810 6794 5966 1364 -1035 -1197 C ATOM 1561 C1' DC C 1 24.328 -2.337 -10.259 1.00 50.38 C ANISOU 1561 C1' DC C 1 7379 6271 5491 1406 -1072 -1243 C ATOM 1562 N1 DC C 1 25.195 -1.166 -10.716 1.00 43.63 N ANISOU 1562 N1 DC C 1 6474 5443 4660 1492 -1023 -1183 N ATOM 1563 C2 DC C 1 25.779 -0.347 -9.762 1.00 39.03 C ANISOU 1563 C2 DC C 1 5927 4766 4138 1504 -978 -1144 C ATOM 1564 O2 DC C 1 25.578 -0.588 -8.581 1.00 38.87 O ANISOU 1564 O2 DC C 1 5976 4644 4150 1445 -979 -1159 O ATOM 1565 N3 DC C 1 26.565 0.673 -10.157 1.00 36.93 N ANISOU 1565 N3 DC C 1 5618 4521 3893 1580 -936 -1091 N ATOM 1566 C4 DC C 1 26.776 0.896 -11.446 1.00 37.25 C ANISOU 1566 C4 DC C 1 5583 4672 3897 1642 -936 -1077 C ATOM 1567 N4 DC C 1 27.567 1.920 -11.783 1.00 37.16 N ANISOU 1567 N4 DC C 1 5532 4677 3910 1716 -893 -1024 N ATOM 1568 C5 DC C 1 26.173 0.091 -12.450 1.00 38.76 C ANISOU 1568 C5 DC C 1 5736 4966 4027 1632 -981 -1115 C ATOM 1569 C6 DC C 1 25.388 -0.919 -12.040 1.00 41.94 C ANISOU 1569 C6 DC C 1 6182 5345 4409 1556 -1023 -1167 C ATOM 1570 H5' DC C 1 21.940 -3.900 -13.253 1.00 77.71 H ATOM 1571 H5'' DC C 1 23.442 -3.462 -13.479 1.00 77.71 H ATOM 1572 H4' DC C 1 22.878 -4.670 -11.035 1.00 69.95 H ATOM 1573 H3' DC C 1 21.750 -2.234 -11.706 1.00 67.52 H ATOM 1574 H2' DC C 1 22.738 -1.013 -10.181 1.00 64.97 H ATOM 1575 H2'' DC C 1 22.627 -2.168 -9.091 1.00 64.97 H ATOM 1576 H1' DC C 1 24.701 -2.695 -9.438 1.00 60.46 H ATOM 1577 H41 DC C 1 27.722 2.089 -12.612 1.00 44.59 H ATOM 1578 H42 DC C 1 27.921 2.409 -11.170 1.00 44.59 H ATOM 1579 H5 DC C 1 26.322 0.252 -13.354 1.00 46.52 H ATOM 1580 H6 DC C 1 24.999 -1.481 -12.671 1.00 50.33 H ATOM 1581 P DT C 2 19.512 -2.638 -10.332 1.00 62.36 P ANISOU 1581 P DT C 2 8761 7997 6937 1247 -1039 -1186 P ATOM 1582 OP1 DT C 2 18.419 -3.620 -10.138 1.00 65.82 O ANISOU 1582 OP1 DT C 2 9219 8446 7345 1169 -1078 -1229 O ATOM 1583 OP2 DT C 2 19.477 -1.731 -11.507 1.00 62.17 O ANISOU 1583 OP2 DT C 2 8631 8097 6892 1323 -1001 -1126 O ATOM 1584 O5' DT C 2 19.577 -1.734 -9.022 1.00 58.58 O ANISOU 1584 O5' DT C 2 8318 7416 6525 1233 -981 -1133 O ATOM 1585 C5' DT C 2 20.096 -2.265 -7.825 1.00 56.85 C ANISOU 1585 C5' DT C 2 8203 7057 6341 1186 -1004 -1177 C ATOM 1586 C4' DT C 2 20.402 -1.153 -6.857 1.00 56.27 C ANISOU 1586 C4' DT C 2 8144 6905 6331 1201 -940 -1115 C ATOM 1587 O4' DT C 2 21.551 -0.391 -7.327 1.00 56.13 O ANISOU 1587 O4' DT C 2 8102 6894 6330 1282 -916 -1086 O ATOM 1588 C3' DT C 2 19.263 -0.153 -6.690 1.00 57.40 C ANISOU 1588 C3' DT C 2 8219 7102 6488 1196 -874 -1036 C ATOM 1589 O3' DT C 2 19.022 0.046 -5.332 1.00 59.18 O ANISOU 1589 O3' DT C 2 8503 7221 6760 1147 -849 -1023 O ATOM 1590 C2' DT C 2 19.751 1.110 -7.417 1.00 56.23 C ANISOU 1590 C2' DT C 2 7991 7021 6352 1285 -818 -965 C ATOM 1591 C1' DT C 2 21.265 0.993 -7.316 1.00 55.14 C ANISOU 1591 C1' DT C 2 7910 6806 6235 1323 -840 -996 C ATOM 1592 N1 DT C 2 22.056 1.638 -8.436 1.00 53.46 N ANISOU 1592 N1 DT C 2 7632 6671 6010 1412 -823 -966 N ATOM 1593 C2 DT C 2 23.052 2.547 -8.121 1.00 51.34 C ANISOU 1593 C2 DT C 2 7371 6348 5788 1464 -783 -927 C ATOM 1594 O2 DT C 2 23.304 2.897 -6.978 1.00 51.16 O ANISOU 1594 O2 DT C 2 7404 6219 5816 1443 -758 -913 O ATOM 1595 N3 DT C 2 23.735 3.048 -9.198 1.00 48.74 N ANISOU 1595 N3 DT C 2 6980 6094 5443 1543 -773 -903 N ATOM 1596 C4 DT C 2 23.543 2.741 -10.520 1.00 49.98 C ANISOU 1596 C4 DT C 2 7072 6373 5545 1575 -798 -914 C ATOM 1597 O4 DT C 2 24.215 3.242 -11.402 1.00 49.02 O ANISOU 1597 O4 DT C 2 6900 6311 5414 1647 -786 -891 O ATOM 1598 C5 DT C 2 22.500 1.778 -10.793 1.00 53.55 C ANISOU 1598 C5 DT C 2 7520 6877 5950 1518 -840 -957 C ATOM 1599 C7 DT C 2 22.202 1.368 -12.214 1.00 54.32 C ANISOU 1599 C7 DT C 2 7548 7108 5984 1547 -871 -974 C ATOM 1600 C6 DT C 2 21.812 1.276 -9.748 1.00 54.11 C ANISOU 1600 C6 DT C 2 7650 6875 6036 1440 -851 -981 C ATOM 1601 H5' DT C 2 20.909 -2.757 -8.017 1.00 68.22 H ATOM 1602 H5'' DT C 2 19.444 -2.864 -7.430 1.00 68.22 H ATOM 1603 H4' DT C 2 20.613 -1.537 -5.992 1.00 67.52 H ATOM 1604 H3' DT C 2 18.463 -0.493 -7.120 1.00 68.88 H ATOM 1605 H2' DT C 2 19.468 1.104 -8.344 1.00 67.47 H ATOM 1606 H2'' DT C 2 19.438 1.909 -6.964 1.00 67.47 H ATOM 1607 H1' DT C 2 21.554 1.367 -6.469 1.00 66.17 H ATOM 1608 H3 DT C 2 24.352 3.622 -9.025 1.00 58.48 H ATOM 1609 H71 DT C 2 22.796 1.840 -12.818 1.00 65.19 H ATOM 1610 H72 DT C 2 22.337 0.412 -12.310 1.00 65.19 H ATOM 1611 H73 DT C 2 21.282 1.587 -12.428 1.00 65.19 H ATOM 1612 H6 DT C 2 21.146 0.649 -9.918 1.00 64.94 H ATOM 1613 P DC C 3 17.607 0.606 -4.834 1.00 62.49 P ANISOU 1613 P DC C 3 8883 7670 7192 1106 -800 -967 P ATOM 1614 OP1 DC C 3 17.242 -0.129 -3.594 1.00 62.47 O ANISOU 1614 OP1 DC C 3 8968 7560 7207 1022 -824 -1009 O ATOM 1615 OP2 DC C 3 16.725 0.659 -6.038 1.00 62.77 O ANISOU 1615 OP2 DC C 3 8823 7851 7176 1124 -798 -947 O ATOM 1616 O5' DC C 3 17.952 2.095 -4.378 1.00 60.91 O ANISOU 1616 O5' DC C 3 8655 7442 7047 1155 -722 -884 O ATOM 1617 C5' DC C 3 19.093 2.315 -3.598 1.00 57.42 C ANISOU 1617 C5' DC C 3 8281 6886 6652 1170 -716 -891 C ATOM 1618 C4' DC C 3 19.628 3.703 -3.817 1.00 54.16 C ANISOU 1618 C4' DC C 3 7814 6494 6273 1245 -651 -815 C ATOM 1619 O4' DC C 3 20.201 3.822 -5.142 1.00 53.34 O ANISOU 1619 O4' DC C 3 7648 6483 6134 1315 -661 -813 O ATOM 1620 C3' DC C 3 18.579 4.810 -3.718 1.00 51.81 C ANISOU 1620 C3' DC C 3 7441 6252 5990 1251 -580 -732 C ATOM 1621 O3' DC C 3 18.935 5.660 -2.660 1.00 50.33 O ANISOU 1621 O3' DC C 3 7287 5971 5864 1255 -531 -690 O ATOM 1622 C2' DC C 3 18.613 5.499 -5.095 1.00 50.76 C ANISOU 1622 C2' DC C 3 7205 6252 5830 1328 -556 -685 C ATOM 1623 C1' DC C 3 19.996 5.138 -5.588 1.00 51.39 C ANISOU 1623 C1' DC C 3 7315 6308 5903 1374 -594 -728 C ATOM 1624 N1 DC C 3 20.205 5.154 -7.071 1.00 50.70 N ANISOU 1624 N1 DC C 3 7151 6343 5768 1435 -607 -725 N ATOM 1625 C2 DC C 3 21.312 5.828 -7.583 1.00 49.02 C ANISOU 1625 C2 DC C 3 6914 6140 5571 1512 -588 -699 C ATOM 1626 O2 DC C 3 22.057 6.435 -6.794 1.00 47.71 O ANISOU 1626 O2 DC C 3 6788 5881 5456 1527 -558 -677 O ATOM 1627 N3 DC C 3 21.534 5.806 -8.922 1.00 49.09 N ANISOU 1627 N3 DC C 3 6857 6258 5537 1567 -602 -699 N ATOM 1628 C4 DC C 3 20.710 5.119 -9.724 1.00 50.32 C ANISOU 1628 C4 DC C 3 6973 6509 5636 1546 -636 -725 C ATOM 1629 N4 DC C 3 20.966 5.114 -11.045 1.00 50.38 N ANISOU 1629 N4 DC C 3 6916 6625 5602 1603 -650 -724 N ATOM 1630 C5 DC C 3 19.585 4.410 -9.211 1.00 51.02 C ANISOU 1630 C5 DC C 3 7087 6589 5710 1467 -658 -753 C ATOM 1631 C6 DC C 3 19.377 4.448 -7.893 1.00 51.19 C ANISOU 1631 C6 DC C 3 7173 6502 5774 1414 -642 -752 C ATOM 1632 H5' DC C 3 19.775 1.668 -3.840 1.00 68.91 H ATOM 1633 H5'' DC C 3 18.866 2.204 -2.662 1.00 68.91 H ATOM 1634 H4' DC C 3 20.323 3.874 -3.162 1.00 65.00 H ATOM 1635 H3' DC C 3 17.703 4.426 -3.558 1.00 62.17 H ATOM 1636 H2' DC C 3 17.931 5.134 -5.681 1.00 60.91 H ATOM 1637 H2'' DC C 3 18.518 6.460 -5.004 1.00 60.91 H ATOM 1638 H1' DC C 3 20.647 5.722 -5.167 1.00 61.67 H ATOM 1639 H41 DC C 3 20.452 4.681 -11.582 1.00 60.46 H ATOM 1640 H42 DC C 3 21.644 5.544 -11.354 1.00 60.46 H ATOM 1641 H5 DC C 3 19.013 3.942 -9.775 1.00 61.23 H ATOM 1642 H6 DC C 3 18.655 3.988 -7.530 1.00 61.43 H ATOM 1643 P DT C 4 17.871 6.651 -2.015 1.00 51.58 P ANISOU 1643 P DT C 4 7407 6138 6054 1237 -462 -615 P ATOM 1644 OP1 DT C 4 18.109 6.617 -0.549 1.00 51.00 O ANISOU 1644 OP1 DT C 4 7422 5925 6030 1190 -454 -627 O ATOM 1645 OP2 DT C 4 16.516 6.404 -2.559 1.00 54.58 O ANISOU 1645 OP2 DT C 4 7726 6621 6391 1207 -465 -606 O ATOM 1646 O5' DT C 4 18.312 8.071 -2.606 1.00 47.94 O ANISOU 1646 O5' DT C 4 6866 5733 5616 1324 -398 -535 O ATOM 1647 C5' DT C 4 19.665 8.475 -2.514 1.00 42.97 C ANISOU 1647 C5' DT C 4 6266 5043 5019 1376 -391 -533 C ATOM 1648 C4' DT C 4 19.933 9.642 -3.425 1.00 39.28 C ANISOU 1648 C4' DT C 4 5707 4663 4555 1460 -340 -462 C ATOM 1649 O4' DT C 4 20.053 9.190 -4.811 1.00 37.51 O ANISOU 1649 O4' DT C 4 5430 4549 4275 1497 -376 -485 O ATOM 1650 C3' DT C 4 18.827 10.701 -3.445 1.00 37.77 C ANISOU 1650 C3' DT C 4 5437 4540 4375 1467 -273 -380 C ATOM 1651 O3' DT C 4 19.410 11.954 -3.624 1.00 35.17 O ANISOU 1651 O3' DT C 4 5062 4220 4081 1537 -215 -313 O ATOM 1652 C2' DT C 4 18.021 10.280 -4.666 1.00 38.43 C ANISOU 1652 C2' DT C 4 5446 4759 4395 1472 -296 -387 C ATOM 1653 C1' DT C 4 19.182 9.983 -5.608 1.00 37.28 C ANISOU 1653 C1' DT C 4 5297 4642 4228 1529 -331 -419 C ATOM 1654 N1 DT C 4 18.876 9.267 -6.872 1.00 36.81 N ANISOU 1654 N1 DT C 4 5189 4696 4103 1540 -376 -452 N ATOM 1655 C2 DT C 4 19.782 9.358 -7.903 1.00 37.12 C ANISOU 1655 C2 DT C 4 5193 4788 4122 1608 -389 -456 C ATOM 1656 O2 DT C 4 20.799 10.021 -7.840 1.00 34.97 O ANISOU 1656 O2 DT C 4 4927 4477 3883 1660 -365 -432 O ATOM 1657 N3 DT C 4 19.458 8.647 -9.023 1.00 38.59 N ANISOU 1657 N3 DT C 4 5339 5077 4248 1613 -432 -490 N ATOM 1658 C4 DT C 4 18.349 7.872 -9.215 1.00 39.83 C ANISOU 1658 C4 DT C 4 5484 5287 4363 1558 -462 -519 C ATOM 1659 O4 DT C 4 18.142 7.277 -10.265 1.00 41.24 O ANISOU 1659 O4 DT C 4 5623 5558 4487 1569 -500 -548 O ATOM 1660 C5 DT C 4 17.437 7.809 -8.102 1.00 39.07 C ANISOU 1660 C5 DT C 4 5426 5130 4291 1488 -447 -513 C ATOM 1661 C7 DT C 4 16.179 6.991 -8.215 1.00 39.12 C ANISOU 1661 C7 DT C 4 5421 5187 4254 1424 -477 -543 C ATOM 1662 C6 DT C 4 17.739 8.507 -6.991 1.00 37.75 C ANISOU 1662 C6 DT C 4 5298 4862 4182 1482 -404 -480 C ATOM 1663 H5' DT C 4 20.238 7.734 -2.767 1.00 51.57 H ATOM 1664 H5'' DT C 4 19.860 8.732 -1.600 1.00 51.57 H ATOM 1665 H4' DT C 4 20.765 10.063 -3.158 1.00 47.14 H ATOM 1666 H3' DT C 4 18.291 10.668 -2.637 1.00 45.33 H ATOM 1667 H2' DT C 4 17.496 9.485 -4.487 1.00 46.11 H ATOM 1668 H2'' DT C 4 17.473 11.009 -4.997 1.00 46.11 H ATOM 1669 H1' DT C 4 19.629 10.816 -5.823 1.00 44.74 H ATOM 1670 H3 DT C 4 20.009 8.698 -9.682 1.00 46.31 H ATOM 1671 H71 DT C 4 16.139 6.579 -9.092 1.00 46.94 H ATOM 1672 H72 DT C 4 16.179 6.302 -7.533 1.00 46.94 H ATOM 1673 H73 DT C 4 15.408 7.567 -8.093 1.00 46.94 H ATOM 1674 H6 DT C 4 17.158 8.461 -6.266 1.00 45.30 H ATOM 1675 P DA C 5 19.474 13.062 -2.460 1.00 32.73 P ANISOU 1675 P DA C 5 4772 3824 3840 1538 -149 -254 P ATOM 1676 OP1 DA C 5 20.048 12.527 -1.217 1.00 32.08 O ANISOU 1676 OP1 DA C 5 4797 3598 3792 1491 -174 -302 O ATOM 1677 OP2 DA C 5 18.107 13.603 -2.431 1.00 35.01 O ANISOU 1677 OP2 DA C 5 4998 4178 4125 1518 -106 -199 O ATOM 1678 O5' DA C 5 20.509 14.121 -3.072 1.00 33.04 O ANISOU 1678 O5' DA C 5 4764 3887 3903 1629 -111 -203 O ATOM 1679 C5' DA C 5 21.846 13.691 -3.297 1.00 32.31 C ANISOU 1679 C5' DA C 5 4716 3749 3810 1660 -150 -249 C ATOM 1680 C4' DA C 5 22.459 14.352 -4.533 1.00 32.15 C ANISOU 1680 C4' DA C 5 4618 3821 3776 1747 -131 -211 C ATOM 1681 O4' DA C 5 21.997 13.713 -5.761 1.00 32.66 O ANISOU 1681 O4' DA C 5 4628 4005 3776 1754 -169 -235 O ATOM 1682 C3' DA C 5 22.156 15.825 -4.700 1.00 32.09 C ANISOU 1682 C3' DA C 5 4530 3864 3799 1798 -53 -116 C ATOM 1683 O3' DA C 5 23.327 16.466 -5.245 1.00 32.39 O ANISOU 1683 O3' DA C 5 4545 3908 3853 1874 -37 -91 O ATOM 1684 C2' DA C 5 20.958 15.835 -5.657 1.00 32.62 C ANISOU 1684 C2' DA C 5 4508 4068 3817 1799 -46 -90 C ATOM 1685 C1' DA C 5 21.267 14.655 -6.562 1.00 32.93 C ANISOU 1685 C1' DA C 5 4556 4156 3798 1797 -118 -162 C ATOM 1686 N9 DA C 5 20.108 13.945 -7.121 1.00 33.43 N ANISOU 1686 N9 DA C 5 4585 4310 3807 1758 -147 -184 N ATOM 1687 C8 DA C 5 18.993 13.521 -6.463 1.00 33.57 C ANISOU 1687 C8 DA C 5 4624 4312 3820 1686 -151 -196 C ATOM 1688 N7 DA C 5 18.169 12.830 -7.217 1.00 34.05 N ANISOU 1688 N7 DA C 5 4647 4465 3825 1664 -184 -221 N ATOM 1689 C5 DA C 5 18.803 12.778 -8.441 1.00 34.23 C ANISOU 1689 C5 DA C 5 4624 4569 3815 1725 -204 -227 C ATOM 1690 C6 DA C 5 18.442 12.190 -9.673 1.00 36.18 C ANISOU 1690 C6 DA C 5 4816 4933 3999 1738 -240 -251 C ATOM 1691 N6 DA C 5 17.294 11.518 -9.865 1.00 37.71 N ANISOU 1691 N6 DA C 5 4992 5183 4151 1686 -265 -274 N ATOM 1692 N1 DA C 5 19.291 12.336 -10.701 1.00 35.46 N ANISOU 1692 N1 DA C 5 4687 4899 3888 1806 -250 -250 N ATOM 1693 C2 DA C 5 20.427 13.009 -10.508 1.00 34.38 C ANISOU 1693 C2 DA C 5 4566 4705 3792 1857 -225 -227 C ATOM 1694 N3 DA C 5 20.876 13.594 -9.406 1.00 33.90 N ANISOU 1694 N3 DA C 5 4555 4535 3791 1851 -191 -204 N ATOM 1695 C4 DA C 5 19.996 13.452 -8.400 1.00 33.86 C ANISOU 1695 C4 DA C 5 4585 4476 3803 1783 -181 -205 C ATOM 1696 H5' DA C 5 21.852 12.728 -3.419 1.00 38.77 H ATOM 1697 H5'' DA C 5 22.384 13.913 -2.521 1.00 38.77 H ATOM 1698 H4' DA C 5 23.422 14.248 -4.482 1.00 38.58 H ATOM 1699 H3' DA C 5 21.915 16.220 -3.848 1.00 38.51 H ATOM 1700 H2' DA C 5 20.129 15.693 -5.174 1.00 39.14 H ATOM 1701 H2'' DA C 5 20.928 16.661 -6.164 1.00 39.14 H ATOM 1702 H1' DA C 5 21.833 14.955 -7.290 1.00 39.51 H ATOM 1703 H8 DA C 5 18.830 13.707 -5.567 1.00 40.29 H ATOM 1704 H61 DA C 5 17.113 11.190 -10.639 1.00 45.25 H ATOM 1705 H62 DA C 5 16.741 11.417 -9.214 1.00 45.25 H ATOM 1706 H2 DA C 5 20.986 13.069 -11.249 1.00 41.26 H ATOM 1707 P DA C 6 23.451 18.057 -5.359 1.00 36.11 P ANISOU 1707 P DA C 6 4946 4407 4366 1940 44 4 P ATOM 1708 OP1 DA C 6 24.917 18.315 -5.393 1.00 35.96 O ANISOU 1708 OP1 DA C 6 4957 4331 4375 1992 40 -2 O ATOM 1709 OP2 DA C 6 22.580 18.700 -4.370 1.00 34.95 O ANISOU 1709 OP2 DA C 6 4802 4220 4259 1903 94 50 O ATOM 1710 O5' DA C 6 22.835 18.356 -6.804 1.00 37.40 O ANISOU 1710 O5' DA C 6 4999 4731 4482 1986 55 42 O ATOM 1711 C5' DA C 6 23.423 17.726 -7.931 1.00 36.62 C ANISOU 1711 C5' DA C 6 4880 4697 4335 2021 8 2 C ATOM 1712 C4' DA C 6 22.556 17.855 -9.161 1.00 36.76 C ANISOU 1712 C4' DA C 6 4800 4866 4303 2046 15 32 C ATOM 1713 O4' DA C 6 21.466 16.903 -9.113 1.00 36.97 O ANISOU 1713 O4' DA C 6 4837 4922 4289 1978 -22 -10 O ATOM 1714 C3' DA C 6 21.889 19.242 -9.378 1.00 36.87 C ANISOU 1714 C3' DA C 6 4722 4947 4338 2086 93 130 C ATOM 1715 O3' DA C 6 22.519 19.883 -10.501 1.00 37.87 O ANISOU 1715 O3' DA C 6 4778 5157 4455 2168 111 168 O ATOM 1716 C2' DA C 6 20.413 18.918 -9.645 1.00 36.74 C ANISOU 1716 C2' DA C 6 4661 5015 4282 2042 90 135 C ATOM 1717 C1' DA C 6 20.434 17.427 -9.940 1.00 36.54 C ANISOU 1717 C1' DA C 6 4684 4994 4206 1998 10 44 C ATOM 1718 N9 DA C 6 19.182 16.725 -9.656 1.00 35.16 N ANISOU 1718 N9 DA C 6 4517 4839 4003 1926 -11 18 N ATOM 1719 C8 DA C 6 18.527 16.654 -8.470 1.00 33.84 C ANISOU 1719 C8 DA C 6 4400 4593 3865 1862 2 16 C ATOM 1720 N7 DA C 6 17.429 15.941 -8.517 1.00 34.35 N ANISOU 1720 N7 DA C 6 4459 4700 3893 1806 -24 -10 N ATOM 1721 C5 DA C 6 17.378 15.493 -9.822 1.00 34.99 C ANISOU 1721 C5 DA C 6 4485 4894 3916 1835 -57 -29 C ATOM 1722 C6 DA C 6 16.456 14.692 -10.521 1.00 35.11 C ANISOU 1722 C6 DA C 6 4468 5001 3873 1804 -94 -60 C ATOM 1723 N6 DA C 6 15.376 14.150 -9.963 1.00 35.29 N ANISOU 1723 N6 DA C 6 4511 5012 3884 1732 -107 -80 N ATOM 1724 N1 DA C 6 16.689 14.475 -11.829 1.00 35.44 N ANISOU 1724 N1 DA C 6 4452 5146 3867 1851 -119 -70 N ATOM 1725 C2 DA C 6 17.782 14.990 -12.381 1.00 35.62 C ANISOU 1725 C2 DA C 6 4455 5179 3900 1922 -107 -52 C ATOM 1726 N3 DA C 6 18.715 15.752 -11.830 1.00 36.82 N ANISOU 1726 N3 DA C 6 4634 5252 4106 1957 -73 -22 N ATOM 1727 C4 DA C 6 18.448 15.974 -10.538 1.00 35.93 C ANISOU 1727 C4 DA C 6 4575 5036 4039 1910 -49 -12 C ATOM 1728 H5' DA C 6 23.555 16.785 -7.734 1.00 43.94 H ATOM 1729 H5'' DA C 6 24.285 18.135 -8.108 1.00 43.94 H ATOM 1730 H4' DA C 6 23.101 17.655 -9.938 1.00 44.12 H ATOM 1731 H3' DA C 6 21.978 19.788 -8.581 1.00 44.24 H ATOM 1732 H2' DA C 6 19.875 19.104 -8.860 1.00 44.09 H ATOM 1733 H2'' DA C 6 20.087 19.414 -10.412 1.00 44.09 H ATOM 1734 H1' DA C 6 20.672 17.290 -10.870 1.00 43.85 H ATOM 1735 H8 DA C 6 18.826 17.077 -7.697 1.00 40.61 H ATOM 1736 H61 DA C 6 14.841 13.670 -10.437 1.00 42.34 H ATOM 1737 H62 DA C 6 15.212 14.279 -9.129 1.00 42.34 H ATOM 1738 H2 DA C 6 17.903 14.797 -13.283 1.00 42.75 H ATOM 1739 P DT C 7 22.138 21.362 -10.989 1.00 68.47 P ANISOU 1739 P DT C 7 9418 9851 6748 5018 -87 2175 P ATOM 1740 OP1 DT C 7 23.458 21.976 -11.255 1.00 69.16 O ANISOU 1740 OP1 DT C 7 9460 9917 6901 4982 -119 2292 O ATOM 1741 OP2 DT C 7 21.188 22.006 -10.049 1.00 68.42 O ANISOU 1741 OP2 DT C 7 9435 9759 6803 5010 -175 2107 O ATOM 1742 O5' DT C 7 21.384 21.102 -12.385 1.00 68.75 O ANISOU 1742 O5' DT C 7 9461 9936 6726 5048 -71 2186 O ATOM 1743 C5' DT C 7 21.878 20.084 -13.273 1.00 68.51 C ANISOU 1743 C5' DT C 7 9425 10010 6596 5075 46 2208 C ATOM 1744 C4' DT C 7 20.904 19.789 -14.404 1.00 68.66 C ANISOU 1744 C4' DT C 7 9463 10069 6558 5107 55 2191 C ATOM 1745 O4' DT C 7 19.865 18.903 -13.934 1.00 67.78 O ANISOU 1745 O4' DT C 7 9394 9992 6368 5141 113 2069 O ATOM 1746 C3' DT C 7 20.191 21.020 -15.002 1.00 69.62 C ANISOU 1746 C3' DT C 7 9578 10111 6765 5090 -83 2238 C ATOM 1747 O3' DT C 7 20.571 21.180 -16.372 1.00 81.78 O ANISOU 1747 O3' DT C 7 11097 11683 8292 5092 -85 2332 O ATOM 1748 C2' DT C 7 18.691 20.723 -14.842 1.00 69.20 C ANISOU 1748 C2' DT C 7 9565 10052 6676 5119 -93 2133 C ATOM 1749 C1' DT C 7 18.655 19.217 -14.582 1.00 68.12 C ANISOU 1749 C1' DT C 7 9456 10013 6415 5157 51 2047 C ATOM 1750 N1 DT C 7 17.528 18.758 -13.711 1.00 67.37 N ANISOU 1750 N1 DT C 7 9403 9910 6285 5175 62 1924 N ATOM 1751 C2 DT C 7 16.567 17.928 -14.231 1.00 66.98 C ANISOU 1751 C2 DT C 7 9385 9917 6147 5213 113 1858 C ATOM 1752 O2 DT C 7 16.557 17.562 -15.381 1.00 67.23 O ANISOU 1752 O2 DT C 7 9412 10002 6129 5234 147 1892 O ATOM 1753 N3 DT C 7 15.604 17.546 -13.350 1.00 66.32 N ANISOU 1753 N3 DT C 7 9338 9823 6035 5226 119 1750 N ATOM 1754 C4 DT C 7 15.509 17.890 -12.022 1.00 66.01 C ANISOU 1754 C4 DT C 7 9310 9726 6044 5206 84 1702 C ATOM 1755 O4 DT C 7 14.600 17.491 -11.312 1.00 65.43 O ANISOU 1755 O4 DT C 7 9274 9651 5937 5220 94 1606 O ATOM 1756 C5 DT C 7 16.548 18.759 -11.537 1.00 66.44 C ANISOU 1756 C5 DT C 7 9331 9722 6191 5169 32 1774 C ATOM 1757 C7 DT C 7 16.546 19.215 -10.116 1.00 66.20 C ANISOU 1757 C7 DT C 7 9309 9622 6220 5147 -13 1730 C ATOM 1758 C6 DT C 7 17.499 19.143 -12.391 1.00 67.09 C ANISOU 1758 C6 DT C 7 9375 9813 6303 5154 23 1880 C ATOM 1759 H5' DT C 7 22.029 19.270 -12.768 1.00 82.21 H ATOM 1760 H5'' DT C 7 22.721 20.379 -13.653 1.00 82.21 H ATOM 1761 H4' DT C 7 21.388 19.342 -15.115 1.00 82.40 H ATOM 1762 H3' DT C 7 20.426 21.815 -14.498 1.00 83.55 H ATOM 1763 H2' DT C 7 18.325 21.209 -14.087 1.00 83.04 H ATOM 1764 H2'' DT C 7 18.211 20.941 -15.656 1.00 83.04 H ATOM 1765 H1' DT C 7 18.616 18.747 -15.430 1.00 81.75 H ATOM 1766 H3 DT C 7 14.989 17.028 -13.656 1.00 79.58 H ATOM 1767 H71 DT C 7 17.361 18.921 -9.681 1.00 79.44 H ATOM 1768 H72 DT C 7 16.495 20.184 -10.088 1.00 79.44 H ATOM 1769 H73 DT C 7 15.779 18.838 -9.657 1.00 79.44 H ATOM 1770 H6 DT C 7 18.175 19.700 -12.079 1.00 80.51 H ATOM 1771 P DG C 8 20.189 22.504 -17.213 1.00 91.57 P ANISOU 1771 P DG C 8 12324 12849 9618 5068 -224 2415 P ATOM 1772 OP1 DG C 8 21.239 22.567 -18.261 1.00 93.88 O ANISOU 1772 OP1 DG C 8 12587 13182 9900 5059 -200 2528 O ATOM 1773 OP2 DG C 8 19.935 23.658 -16.302 1.00 92.42 O ANISOU 1773 OP2 DG C 8 12427 12847 9841 5032 -347 2414 O ATOM 1774 O5' DG C 8 18.796 22.128 -17.909 1.00 93.91 O ANISOU 1774 O5' DG C 8 12653 13170 9858 5106 -224 2352 O ATOM 1775 C5' DG C 8 18.661 20.885 -18.597 1.00 93.57 C ANISOU 1775 C5' DG C 8 12627 13228 9697 5149 -106 2315 C ATOM 1776 C4' DG C 8 17.330 20.813 -19.316 1.00 92.50 C ANISOU 1776 C4' DG C 8 12519 13095 9531 5177 -139 2272 C ATOM 1777 O4' DG C 8 16.331 20.232 -18.434 1.00 88.37 O ANISOU 1777 O4' DG C 8 12029 12572 8975 5198 -113 2147 O ATOM 1778 C3' DG C 8 16.766 22.163 -19.755 1.00 93.86 C ANISOU 1778 C3' DG C 8 12682 13179 9800 5150 -286 2329 C ATOM 1779 O3' DG C 8 16.103 22.033 -21.028 1.00 95.32 O ANISOU 1779 O3' DG C 8 12880 13395 9942 5174 -296 2346 O ATOM 1780 C2' DG C 8 15.818 22.530 -18.611 1.00 89.77 C ANISOU 1780 C2' DG C 8 12182 12593 9335 5144 -345 2242 C ATOM 1781 C1' DG C 8 15.299 21.172 -18.163 1.00 84.22 C ANISOU 1781 C1' DG C 8 11511 11960 8527 5185 -231 2126 C ATOM 1782 N9 DG C 8 14.985 21.067 -16.748 1.00 74.23 N ANISOU 1782 N9 DG C 8 10261 10661 7280 5180 -227 2038 N ATOM 1783 C8 DG C 8 15.614 21.695 -15.705 1.00 71.92 C ANISOU 1783 C8 DG C 8 9953 10309 7064 5147 -267 2053 C ATOM 1784 N7 DG C 8 15.128 21.374 -14.537 1.00 69.18 N ANISOU 1784 N7 DG C 8 9630 9946 6709 5153 -248 1958 N ATOM 1785 C5 DG C 8 14.128 20.463 -14.825 1.00 68.65 C ANISOU 1785 C5 DG C 8 9597 9934 6554 5191 -191 1875 C ATOM 1786 C6 DG C 8 13.263 19.763 -13.961 1.00 67.82 C ANISOU 1786 C6 DG C 8 9528 9842 6398 5212 -150 1759 C ATOM 1787 O6 DG C 8 13.196 19.815 -12.726 1.00 67.37 O ANISOU 1787 O6 DG C 8 9484 9750 6363 5202 -154 1702 O ATOM 1788 N1 DG C 8 12.395 18.945 -14.663 1.00 67.55 N ANISOU 1788 N1 DG C 8 9519 9867 6280 5248 -103 1708 N ATOM 1789 C2 DG C 8 12.363 18.815 -16.026 1.00 68.03 C ANISOU 1789 C2 DG C 8 9571 9968 6308 5264 -97 1762 C ATOM 1790 N2 DG C 8 11.439 17.980 -16.515 1.00 67.68 N ANISOU 1790 N2 DG C 8 9556 9976 6184 5299 -54 1698 N ATOM 1791 N3 DG C 8 13.177 19.453 -16.852 1.00 68.81 N ANISOU 1791 N3 DG C 8 9637 10058 6451 5246 -132 1871 N ATOM 1792 C4 DG C 8 14.032 20.257 -16.181 1.00 69.08 C ANISOU 1792 C4 DG C 8 9646 10035 6567 5209 -178 1923 C ATOM 1793 H5' DG C 8 18.719 20.158 -17.957 1.00112.28 H ATOM 1794 H5'' DG C 8 19.379 20.798 -19.244 1.00112.28 H ATOM 1795 H4' DG C 8 17.426 20.245 -20.096 1.00111.00 H ATOM 1796 H3' DG C 8 17.480 22.816 -19.817 1.00112.63 H ATOM 1797 H2' DG C 8 16.300 22.969 -17.893 1.00107.73 H ATOM 1798 H2'' DG C 8 15.092 23.087 -18.932 1.00107.73 H ATOM 1799 H1' DG C 8 14.513 20.942 -18.684 1.00101.06 H ATOM 1800 H8 DG C 8 16.318 22.292 -15.819 1.00 86.30 H ATOM 1801 H1 DG C 8 11.822 18.494 -14.208 1.00 81.06 H ATOM 1802 H21 DG C 8 11.376 17.859 -17.364 1.00 81.22 H ATOM 1803 H22 DG C 8 10.909 17.565 -15.981 1.00 81.22 H ATOM 1804 P DG C 9 15.489 23.310 -21.799 1.00 95.50 P ANISOU 1804 P DG C 9 12897 13344 10045 5153 -438 2414 P ATOM 1805 OP1 DG C 9 16.058 23.261 -23.165 1.00 97.69 O ANISOU 1805 OP1 DG C 9 13165 13668 10283 5157 -421 2508 O ATOM 1806 OP2 DG C 9 15.609 24.540 -20.980 1.00 94.46 O ANISOU 1806 OP2 DG C 9 12747 13111 10032 5109 -549 2444 O ATOM 1807 O5' DG C 9 13.931 22.973 -21.876 1.00 88.80 O ANISOU 1807 O5' DG C 9 12082 12494 9166 5185 -454 2318 O ATOM 1808 C5' DG C 9 13.509 21.626 -22.072 1.00 82.18 C ANISOU 1808 C5' DG C 9 11269 11739 8215 5230 -343 2236 C ATOM 1809 C4' DG C 9 12.047 21.479 -21.724 1.00 77.29 C ANISOU 1809 C4' DG C 9 10679 11097 7593 5251 -375 2137 C ATOM 1810 O4' DG C 9 11.891 21.273 -20.289 1.00 74.70 O ANISOU 1810 O4' DG C 9 10358 10744 7279 5246 -353 2051 O ATOM 1811 C3' DG C 9 11.207 22.700 -22.049 1.00 77.82 C ANISOU 1811 C3' DG C 9 10740 11078 7750 5231 -515 2171 C ATOM 1812 O3' DG C 9 9.940 22.302 -22.481 1.00 80.98 O ANISOU 1812 O3' DG C 9 11165 11492 8111 5262 -523 2107 O ATOM 1813 C2' DG C 9 11.155 23.435 -20.719 1.00 75.13 C ANISOU 1813 C2' DG C 9 10390 10658 7499 5203 -573 2143 C ATOM 1814 C1' DG C 9 11.022 22.265 -19.768 1.00 72.34 C ANISOU 1814 C1' DG C 9 10060 10355 7072 5228 -466 2033 C ATOM 1815 N9 DG C 9 11.387 22.540 -18.383 1.00 71.31 N ANISOU 1815 N9 DG C 9 9923 10178 6992 5206 -471 2000 N ATOM 1816 C8 DG C 9 12.411 23.333 -17.922 1.00 71.66 C ANISOU 1816 C8 DG C 9 9940 10175 7112 5168 -511 2070 C ATOM 1817 N7 DG C 9 12.508 23.351 -16.617 1.00 71.12 N ANISOU 1817 N7 DG C 9 9877 10074 7072 5158 -504 2015 N ATOM 1818 C5 DG C 9 11.482 22.514 -16.193 1.00 70.37 C ANISOU 1818 C5 DG C 9 9815 10008 6913 5190 -454 1902 C ATOM 1819 C6 DG C 9 11.079 22.150 -14.886 1.00 69.59 C ANISOU 1819 C6 DG C 9 9740 9896 6806 5196 -425 1804 C ATOM 1820 O6 DG C 9 11.564 22.512 -13.798 1.00 69.41 O ANISOU 1820 O6 DG C 9 9711 9829 6833 5173 -440 1795 O ATOM 1821 N1 DG C 9 9.995 21.279 -14.913 1.00 69.03 N ANISOU 1821 N1 DG C 9 9701 9867 6659 5230 -378 1710 N ATOM 1822 C2 DG C 9 9.379 20.822 -16.054 1.00 69.19 C ANISOU 1822 C2 DG C 9 9731 9935 6623 5257 -363 1710 C ATOM 1823 N2 DG C 9 8.346 19.990 -15.882 1.00 68.59 N ANISOU 1823 N2 DG C 9 9689 9894 6480 5287 -321 1613 N ATOM 1824 N3 DG C 9 9.738 21.165 -17.277 1.00 69.92 N ANISOU 1824 N3 DG C 9 9803 10039 6723 5254 -390 1800 N ATOM 1825 C4 DG C 9 10.792 22.006 -17.272 1.00 70.47 C ANISOU 1825 C4 DG C 9 9842 10071 6864 5220 -433 1892 C ATOM 1826 H5' DG C 9 14.035 21.040 -21.505 1.00 98.61 H ATOM 1827 H5'' DG C 9 13.645 21.379 -23.001 1.00 98.61 H ATOM 1828 H4' DG C 9 11.686 20.712 -22.195 1.00 92.75 H ATOM 1829 H3' DG C 9 11.643 23.245 -22.722 1.00 93.39 H ATOM 1830 H2' DG C 9 11.976 23.925 -20.558 1.00 90.16 H ATOM 1831 H2'' DG C 9 10.379 24.015 -20.669 1.00 90.16 H ATOM 1832 H1' DG C 9 10.111 21.935 -19.797 1.00 86.81 H ATOM 1833 H8 DG C 9 12.982 23.807 -18.483 1.00 85.99 H ATOM 1834 H1 DG C 9 9.685 21.007 -14.158 1.00 82.83 H ATOM 1835 H21 DG C 9 7.922 19.684 -16.565 1.00 82.31 H ATOM 1836 H22 DG C 9 8.105 19.761 -15.089 1.00 82.31 H ATOM 1837 P DC C 10 9.204 23.093 -23.661 1.00 85.04 P ANISOU 1837 P DC C 10 11678 11970 8662 5259 -628 2166 P ATOM 1838 OP1 DC C 10 9.458 22.310 -24.895 1.00 86.60 O ANISOU 1838 OP1 DC C 10 11887 12250 8767 5287 -562 2196 O ATOM 1839 OP2 DC C 10 9.554 24.536 -23.585 1.00 86.58 O ANISOU 1839 OP2 DC C 10 11847 12080 8971 5215 -744 2254 O ATOM 1840 O5' DC C 10 7.671 22.984 -23.260 1.00 83.04 O ANISOU 1840 O5' DC C 10 11447 11687 8417 5279 -664 2066 O ATOM 1841 C5' DC C 10 7.141 23.874 -22.318 1.00 80.19 C ANISOU 1841 C5' DC C 10 11077 11240 8150 5257 -748 2042 C ATOM 1842 C4' DC C 10 6.521 23.129 -21.166 1.00 77.66 C ANISOU 1842 C4' DC C 10 10778 10929 7799 5277 -691 1920 C ATOM 1843 O4' DC C 10 7.495 23.010 -20.107 1.00 74.58 O ANISOU 1843 O4' DC C 10 10381 10540 7418 5260 -640 1912 O ATOM 1844 C3' DC C 10 5.322 23.834 -20.564 1.00 81.68 C ANISOU 1844 C3' DC C 10 11290 11361 8385 5272 -781 1872 C ATOM 1845 O3' DC C 10 4.113 23.265 -21.039 1.00 90.73 O ANISOU 1845 O3' DC C 10 12458 12531 9484 5305 -776 1809 O ATOM 1846 C2' DC C 10 5.477 23.657 -19.058 1.00 77.27 C ANISOU 1846 C2' DC C 10 10738 10782 7841 5266 -744 1800 C ATOM 1847 C1' DC C 10 6.850 23.050 -18.859 1.00 74.23 C ANISOU 1847 C1' DC C 10 10348 10453 7403 5260 -651 1825 C ATOM 1848 N1 DC C 10 7.700 23.817 -17.893 1.00 72.60 N ANISOU 1848 N1 DC C 10 10121 10188 7274 5224 -683 1859 N ATOM 1849 C2 DC C 10 7.518 23.621 -16.518 1.00 71.09 C ANISOU 1849 C2 DC C 10 9943 9975 7092 5223 -659 1777 C ATOM 1850 O2 DC C 10 6.649 22.834 -16.134 1.00 70.44 O ANISOU 1850 O2 DC C 10 9890 9921 6954 5251 -613 1680 O ATOM 1851 N3 DC C 10 8.298 24.301 -15.648 1.00 71.17 N ANISOU 1851 N3 DC C 10 9937 9932 7173 5192 -690 1807 N ATOM 1852 C4 DC C 10 9.225 25.142 -16.097 1.00 71.90 C ANISOU 1852 C4 DC C 10 9999 9994 7327 5161 -744 1915 C ATOM 1853 N4 DC C 10 9.967 25.788 -15.192 1.00 71.97 N ANISOU 1853 N4 DC C 10 9992 9947 7406 5130 -776 1941 N ATOM 1854 C5 DC C 10 9.429 25.363 -17.498 1.00 72.62 C ANISOU 1854 C5 DC C 10 10076 10108 7408 5160 -769 2002 C ATOM 1855 C6 DC C 10 8.650 24.686 -18.353 1.00 72.53 C ANISOU 1855 C6 DC C 10 10083 10150 7326 5192 -737 1970 C ATOM 1856 H5' DC C 10 6.464 24.423 -22.743 1.00 96.22 H ATOM 1857 H5'' DC C 10 7.851 24.445 -21.983 1.00 96.22 H ATOM 1858 H4' DC C 10 6.258 22.243 -21.460 1.00 93.19 H ATOM 1859 H3' DC C 10 5.351 24.777 -20.787 1.00 98.02 H ATOM 1860 H2' DC C 10 5.422 24.517 -18.612 1.00 92.73 H ATOM 1861 H2'' DC C 10 4.793 23.058 -18.718 1.00 92.73 H ATOM 1862 H1' DC C 10 6.747 22.143 -18.531 1.00 89.07 H ATOM 1863 H41 DC C 10 10.575 26.339 -15.449 1.00 86.36 H ATOM 1864 H42 DC C 10 9.837 25.652 -14.353 1.00 86.36 H ATOM 1865 H5 DC C 10 10.080 25.953 -17.803 1.00 87.15 H ATOM 1866 H6 DC C 10 8.765 24.799 -19.269 1.00 87.04 H ATOM 1867 P DT C 11 2.709 23.969 -20.689 1.00 75.19 P ANISOU 1867 P DT C 11 10897 8796 8876 2802 -2088 -468 P ATOM 1868 OP1 DT C 11 1.641 23.174 -21.354 1.00 78.87 O ANISOU 1868 OP1 DT C 11 11338 9301 9328 2848 -2133 -563 O ATOM 1869 OP2 DT C 11 2.859 25.423 -20.955 1.00 75.48 O ANISOU 1869 OP2 DT C 11 10886 8881 8910 2858 -1939 -430 O ATOM 1870 O5' DT C 11 2.574 23.790 -19.099 1.00 75.39 O ANISOU 1870 O5' DT C 11 11011 8731 8903 2616 -2157 -451 O ATOM 1871 C5' DT C 11 2.279 22.506 -18.551 1.00 73.34 C ANISOU 1871 C5' DT C 11 10800 8423 8644 2496 -2278 -491 C ATOM 1872 C4' DT C 11 1.887 22.623 -17.090 1.00 69.06 C ANISOU 1872 C4' DT C 11 10309 7831 8101 2253 -2259 -492 C ATOM 1873 O4' DT C 11 3.003 23.145 -16.313 1.00 65.35 O ANISOU 1873 O4' DT C 11 9873 7313 7646 2164 -2228 -400 O ATOM 1874 C3' DT C 11 0.707 23.553 -16.832 1.00 66.44 C ANISOU 1874 C3' DT C 11 9950 7541 7753 2200 -2144 -541 C ATOM 1875 O3' DT C 11 -0.219 22.913 -15.957 1.00 67.56 O ANISOU 1875 O3' DT C 11 10131 7653 7888 2024 -2190 -601 O ATOM 1876 C2' DT C 11 1.353 24.808 -16.232 1.00 63.46 C ANISOU 1876 C2' DT C 11 9577 7153 7383 2143 -2031 -464 C ATOM 1877 C1' DT C 11 2.592 24.256 -15.542 1.00 60.20 C ANISOU 1877 C1' DT C 11 9220 6666 6987 2050 -2110 -390 C ATOM 1878 N1 DT C 11 3.759 25.213 -15.453 1.00 52.96 N ANISOU 1878 N1 DT C 11 8301 5740 6083 2082 -2037 -295 N ATOM 1879 C2 DT C 11 4.300 25.515 -14.220 1.00 47.85 C ANISOU 1879 C2 DT C 11 7703 5034 5443 1901 -2017 -237 C ATOM 1880 O2 DT C 11 3.874 25.071 -13.177 1.00 46.09 O ANISOU 1880 O2 DT C 11 7527 4765 5218 1713 -2053 -259 O ATOM 1881 N3 DT C 11 5.371 26.354 -14.256 1.00 46.83 N ANISOU 1881 N3 DT C 11 7567 4900 5325 1948 -1954 -152 N ATOM 1882 C4 DT C 11 5.957 26.916 -15.369 1.00 47.56 C ANISOU 1882 C4 DT C 11 7608 5040 5421 2153 -1909 -118 C ATOM 1883 O4 DT C 11 6.920 27.679 -15.293 1.00 45.98 O ANISOU 1883 O4 DT C 11 7406 4832 5231 2178 -1852 -39 O ATOM 1884 C5 DT C 11 5.357 26.560 -16.625 1.00 50.27 C ANISOU 1884 C5 DT C 11 7902 5444 5756 2336 -1934 -180 C ATOM 1885 C7 DT C 11 5.894 27.138 -17.906 1.00 51.11 C ANISOU 1885 C7 DT C 11 7950 5607 5865 2567 -1887 -151 C ATOM 1886 C6 DT C 11 4.300 25.733 -16.609 1.00 51.54 C ANISOU 1886 C6 DT C 11 8068 5609 5906 2292 -1996 -265 C ATOM 1887 H5' DT C 11 3.063 21.939 -18.626 1.00 88.01 H ATOM 1888 H5'' DT C 11 1.548 22.107 -19.047 1.00 88.01 H ATOM 1889 H4' DT C 11 1.664 21.739 -16.758 1.00 82.87 H ATOM 1890 H3' DT C 11 0.272 23.774 -17.670 1.00 79.73 H ATOM 1891 H2' DT C 11 1.599 25.435 -16.931 1.00 76.16 H ATOM 1892 H2'' DT C 11 0.759 25.225 -15.588 1.00 76.16 H ATOM 1893 H1' DT C 11 2.356 23.957 -14.651 1.00 72.24 H ATOM 1894 H3 DT C 11 5.719 26.560 -13.498 1.00 56.19 H ATOM 1895 H71 DT C 11 6.640 27.726 -17.707 1.00 61.34 H ATOM 1896 H72 DT C 11 6.195 26.419 -18.483 1.00 61.34 H ATOM 1897 H73 DT C 11 5.195 27.641 -18.352 1.00 61.34 H ATOM 1898 H6 DT C 11 3.909 25.502 -17.421 1.00 61.85 H ATOM 1899 P DT C 12 -1.505 23.698 -15.410 1.00 68.64 P ANISOU 1899 P DT C 12 10255 7818 8009 1920 -2087 -655 P ATOM 1900 OP1 DT C 12 -2.563 22.699 -15.138 1.00 69.20 O ANISOU 1900 OP1 DT C 12 10346 7878 8069 1831 -2166 -739 O ATOM 1901 OP2 DT C 12 -1.744 24.850 -16.312 1.00 68.65 O ANISOU 1901 OP2 DT C 12 10190 7893 8003 2082 -1968 -656 O ATOM 1902 O5' DT C 12 -1.002 24.288 -14.009 1.00 64.80 O ANISOU 1902 O5' DT C 12 9818 7272 7530 1716 -2037 -592 O ATOM 1903 C5' DT C 12 -0.506 23.411 -13.013 1.00 59.00 C ANISOU 1903 C5' DT C 12 9150 6461 6805 1550 -2133 -567 C ATOM 1904 C4' DT C 12 -0.207 24.165 -11.731 1.00 52.85 C ANISOU 1904 C4' DT C 12 8411 5638 6030 1364 -2063 -514 C ATOM 1905 O4' DT C 12 0.959 25.017 -11.913 1.00 51.03 O ANISOU 1905 O4' DT C 12 8168 5408 5812 1437 -2001 -425 O ATOM 1906 C3' DT C 12 -1.324 25.074 -11.239 1.00 50.08 C ANISOU 1906 C3' DT C 12 8046 5317 5666 1275 -1950 -557 C ATOM 1907 O3' DT C 12 -1.531 24.815 -9.858 1.00 51.96 O ANISOU 1907 O3' DT C 12 8343 5494 5904 1041 -1971 -557 O ATOM 1908 C2' DT C 12 -0.801 26.493 -11.538 1.00 49.14 C ANISOU 1908 C2' DT C 12 7889 5232 5550 1362 -1818 -497 C ATOM 1909 C1' DT C 12 0.707 26.308 -11.413 1.00 47.82 C ANISOU 1909 C1' DT C 12 7750 5018 5401 1374 -1866 -405 C ATOM 1910 N1 DT C 12 1.575 27.259 -12.198 1.00 43.78 N ANISOU 1910 N1 DT C 12 7197 4543 4896 1540 -1788 -341 N ATOM 1911 C2 DT C 12 2.571 27.957 -11.542 1.00 42.68 C ANISOU 1911 C2 DT C 12 7081 4368 4768 1470 -1738 -254 C ATOM 1912 O2 DT C 12 2.748 27.900 -10.340 1.00 42.91 O ANISOU 1912 O2 DT C 12 7163 4340 4801 1278 -1746 -228 O ATOM 1913 N3 DT C 12 3.348 28.750 -12.346 1.00 41.71 N ANISOU 1913 N3 DT C 12 6917 4280 4651 1634 -1674 -199 N ATOM 1914 C4 DT C 12 3.240 28.910 -13.714 1.00 41.71 C ANISOU 1914 C4 DT C 12 6856 4345 4647 1857 -1657 -220 C ATOM 1915 O4 DT C 12 3.991 29.645 -14.349 1.00 41.50 O ANISOU 1915 O4 DT C 12 6796 4345 4626 1992 -1598 -165 O ATOM 1916 C5 DT C 12 2.185 28.139 -14.346 1.00 41.98 C ANISOU 1916 C5 DT C 12 6868 4413 4669 1920 -1713 -312 C ATOM 1917 C7 DT C 12 1.971 28.236 -15.825 1.00 42.00 C ANISOU 1917 C7 DT C 12 6805 4488 4666 2157 -1701 -342 C ATOM 1918 C6 DT C 12 1.416 27.358 -13.571 1.00 42.20 C ANISOU 1918 C6 DT C 12 6935 4407 4691 1761 -1776 -367 C ATOM 1919 H5' DT C 12 0.308 22.992 -13.334 1.00 70.80 H ATOM 1920 H5'' DT C 12 -1.168 22.725 -12.833 1.00 70.80 H ATOM 1921 H4' DT C 12 -0.009 23.519 -11.035 1.00 63.41 H ATOM 1922 H3' DT C 12 -2.137 24.904 -11.739 1.00 60.10 H ATOM 1923 H2' DT C 12 -1.042 26.767 -12.436 1.00 58.97 H ATOM 1924 H2'' DT C 12 -1.127 27.126 -10.880 1.00 58.97 H ATOM 1925 H1' DT C 12 0.958 26.343 -10.477 1.00 57.38 H ATOM 1926 H3 DT C 12 3.964 29.205 -11.955 1.00 50.05 H ATOM 1927 H71 DT C 12 2.617 28.852 -16.206 1.00 50.41 H ATOM 1928 H72 DT C 12 2.084 27.361 -16.226 1.00 50.41 H ATOM 1929 H73 DT C 12 1.073 28.559 -16.001 1.00 50.41 H ATOM 1930 H6 DT C 12 0.748 26.854 -13.976 1.00 50.64 H ATOM 1931 P DT C 13 -2.587 25.650 -8.981 1.00 56.52 P ANISOU 1931 P DT C 13 8924 6080 6470 889 -1865 -592 P ATOM 1932 OP1 DT C 13 -3.112 24.687 -7.987 1.00 58.74 O ANISOU 1932 OP1 DT C 13 9261 6308 6748 697 -1951 -633 O ATOM 1933 OP2 DT C 13 -3.480 26.457 -9.852 1.00 57.70 O ANISOU 1933 OP2 DT C 13 9008 6309 6606 1025 -1767 -641 O ATOM 1934 O5' DT C 13 -1.664 26.670 -8.159 1.00 56.89 O ANISOU 1934 O5' DT C 13 8994 6094 6526 796 -1780 -501 O ATOM 1935 C5' DT C 13 -0.510 26.175 -7.493 1.00 55.37 C ANISOU 1935 C5' DT C 13 8855 5833 6349 705 -1853 -432 C ATOM 1936 C4' DT C 13 0.251 27.299 -6.832 1.00 52.45 C ANISOU 1936 C4' DT C 13 8499 5444 5987 636 -1754 -351 C ATOM 1937 O4' DT C 13 0.965 28.062 -7.835 1.00 50.34 O ANISOU 1937 O4' DT C 13 8182 5221 5725 830 -1693 -303 O ATOM 1938 C3' DT C 13 -0.621 28.292 -6.073 1.00 52.75 C ANISOU 1938 C3' DT C 13 8535 5495 6014 510 -1636 -373 C ATOM 1939 O3' DT C 13 -0.094 28.461 -4.779 1.00 53.84 O ANISOU 1939 O3' DT C 13 8730 5569 6158 314 -1628 -320 O ATOM 1940 C2' DT C 13 -0.577 29.576 -6.933 1.00 51.69 C ANISOU 1940 C2' DT C 13 8337 5427 5876 676 -1508 -353 C ATOM 1941 C1' DT C 13 0.761 29.448 -7.635 1.00 49.84 C ANISOU 1941 C1' DT C 13 8093 5188 5656 819 -1549 -282 C ATOM 1942 N1 DT C 13 0.877 30.105 -8.980 1.00 46.38 N ANISOU 1942 N1 DT C 13 7586 4820 5216 1053 -1486 -278 N ATOM 1943 C2 DT C 13 1.922 30.964 -9.196 1.00 44.02 C ANISOU 1943 C2 DT C 13 7272 4526 4927 1129 -1421 -197 C ATOM 1944 O2 DT C 13 2.710 31.285 -8.327 1.00 44.04 O ANISOU 1944 O2 DT C 13 7314 4480 4938 1011 -1403 -129 O ATOM 1945 N3 DT C 13 2.005 31.461 -10.461 1.00 42.67 N ANISOU 1945 N3 DT C 13 7039 4420 4754 1346 -1373 -197 N ATOM 1946 C4 DT C 13 1.174 31.189 -11.516 1.00 42.77 C ANISOU 1946 C4 DT C 13 7003 4491 4757 1494 -1385 -269 C ATOM 1947 O4 DT C 13 1.333 31.698 -12.612 1.00 43.13 O ANISOU 1947 O4 DT C 13 6994 4593 4802 1685 -1338 -262 O ATOM 1948 C5 DT C 13 0.103 30.268 -11.243 1.00 43.58 C ANISOU 1948 C5 DT C 13 7123 4586 4849 1407 -1456 -352 C ATOM 1949 C7 DT C 13 -0.868 29.908 -12.334 1.00 43.74 C ANISOU 1949 C7 DT C 13 7094 4669 4858 1555 -1474 -434 C ATOM 1950 C6 DT C 13 0.009 29.761 -10.001 1.00 45.26 C ANISOU 1950 C6 DT C 13 7399 4735 5064 1193 -1504 -353 C ATOM 1951 H5' DT C 13 0.066 25.734 -8.137 1.00 66.44 H ATOM 1952 H5'' DT C 13 -0.782 25.533 -6.817 1.00 66.44 H ATOM 1953 H4' DT C 13 0.895 26.917 -6.215 1.00 62.94 H ATOM 1954 H3' DT C 13 -1.531 27.960 -6.020 1.00 63.30 H ATOM 1955 H2' DT C 13 -1.304 29.586 -7.575 1.00 62.03 H ATOM 1956 H2'' DT C 13 -0.598 30.368 -6.372 1.00 62.03 H ATOM 1957 H1' DT C 13 1.459 29.790 -7.054 1.00 59.81 H ATOM 1958 H3 DT C 13 2.640 32.022 -10.611 1.00 51.20 H ATOM 1959 H71 DT C 13 -0.630 30.381 -13.148 1.00 52.49 H ATOM 1960 H72 DT C 13 -0.836 28.952 -12.494 1.00 52.49 H ATOM 1961 H73 DT C 13 -1.765 30.161 -12.065 1.00 52.49 H ATOM 1962 H6 DT C 13 -0.672 29.155 -9.818 1.00 54.32 H ATOM 1963 P DC C 14 -0.854 29.366 -3.699 1.00 55.52 P ANISOU 1963 P DC C 14 8958 5775 6361 137 -1520 -333 P ATOM 1964 OP1 DC C 14 -0.295 28.991 -2.374 1.00 55.92 O ANISOU 1964 OP1 DC C 14 9080 5747 6420 -75 -1568 -289 O ATOM 1965 OP2 DC C 14 -2.308 29.282 -3.985 1.00 55.10 O ANISOU 1965 OP2 DC C 14 8875 5767 6292 149 -1499 -429 O ATOM 1966 O5' DC C 14 -0.349 30.841 -4.039 1.00 56.00 O ANISOU 1966 O5' DC C 14 8979 5874 6424 231 -1382 -274 O ATOM 1967 C5' DC C 14 1.017 31.170 -3.830 1.00 56.69 C ANISOU 1967 C5' DC C 14 9086 5928 6527 234 -1376 -179 C ATOM 1968 C4' DC C 14 1.258 32.626 -4.128 1.00 57.46 C ANISOU 1968 C4' DC C 14 9143 6067 6623 315 -1234 -136 C ATOM 1969 O4' DC C 14 1.292 32.817 -5.570 1.00 56.60 O ANISOU 1969 O4' DC C 14 8969 6023 6513 556 -1217 -148 O ATOM 1970 C3' DC C 14 0.166 33.560 -3.603 1.00 60.18 C ANISOU 1970 C3' DC C 14 9475 6437 6954 222 -1116 -177 C ATOM 1971 O3' DC C 14 0.735 34.697 -2.982 1.00 63.31 O ANISOU 1971 O3' DC C 14 9881 6820 7355 153 -1011 -109 O ATOM 1972 C2' DC C 14 -0.622 33.918 -4.859 1.00 57.99 C ANISOU 1972 C2' DC C 14 9126 6240 6667 416 -1065 -234 C ATOM 1973 C1' DC C 14 0.488 33.924 -5.893 1.00 55.12 C ANISOU 1973 C1' DC C 14 8734 5896 6315 611 -1088 -178 C ATOM 1974 N1 DC C 14 0.052 33.818 -7.305 1.00 49.89 N ANISOU 1974 N1 DC C 14 8008 5302 5647 830 -1092 -226 N ATOM 1975 C2 DC C 14 0.822 34.434 -8.295 1.00 46.97 C ANISOU 1975 C2 DC C 14 7593 4970 5283 1021 -1046 -177 C ATOM 1976 O2 DC C 14 1.841 35.045 -7.968 1.00 47.43 O ANISOU 1976 O2 DC C 14 7665 5005 5351 1002 -1005 -96 O ATOM 1977 N3 DC C 14 0.437 34.336 -9.579 1.00 44.97 N ANISOU 1977 N3 DC C 14 7283 4780 5025 1220 -1050 -219 N ATOM 1978 C4 DC C 14 -0.659 33.661 -9.897 1.00 45.41 C ANISOU 1978 C4 DC C 14 7326 4860 5069 1234 -1096 -306 C ATOM 1979 N4 DC C 14 -1.000 33.603 -11.188 1.00 45.98 N ANISOU 1979 N4 DC C 14 7340 4994 5135 1435 -1097 -345 N ATOM 1980 C5 DC C 14 -1.463 33.024 -8.909 1.00 46.42 C ANISOU 1980 C5 DC C 14 7498 4949 5190 1042 -1143 -357 C ATOM 1981 C6 DC C 14 -1.072 33.127 -7.634 1.00 48.29 C ANISOU 1981 C6 DC C 14 7792 5124 5433 845 -1139 -315 C ATOM 1982 H5' DC C 14 1.570 30.628 -4.414 1.00 68.03 H ATOM 1983 H5'' DC C 14 1.252 30.988 -2.907 1.00 68.03 H ATOM 1984 H4' DC C 14 2.112 32.891 -3.751 1.00 68.95 H ATOM 1985 H3' DC C 14 -0.404 33.087 -2.977 1.00 72.22 H ATOM 1986 HO3' DC C 14 0.566 35.466 -3.276 1.00 75.98 H ATOM 1987 H2' DC C 14 -1.284 33.238 -5.062 1.00 69.59 H ATOM 1988 H2'' DC C 14 -1.029 34.795 -4.779 1.00 69.59 H ATOM 1989 H1' DC C 14 1.012 34.733 -5.786 1.00 66.15 H ATOM 1990 H41 DC C 14 -1.705 33.172 -11.428 1.00 55.17 H ATOM 1991 H42 DC C 14 -0.514 33.995 -11.779 1.00 55.17 H ATOM 1992 H5 DC C 14 -2.233 32.557 -9.142 1.00 55.70 H ATOM 1993 H6 DC C 14 -1.574 32.721 -6.965 1.00 57.95 H TER 1994 DC C 14 ATOM 1995 N GLY D 4 19.643 32.753 37.199 1.00 69.31 N ANISOU 1995 N GLY D 4 10933 7360 8042 221 -99 -1246 N ATOM 1996 CA GLY D 4 19.364 33.113 35.819 1.00 67.82 C ANISOU 1996 CA GLY D 4 10738 7172 7860 279 -75 -1194 C ATOM 1997 C GLY D 4 18.405 32.160 35.122 1.00 64.96 C ANISOU 1997 C GLY D 4 10318 6910 7455 311 -91 -1162 C ATOM 1998 O GLY D 4 18.285 30.993 35.499 1.00 65.36 O ANISOU 1998 O GLY D 4 10328 7027 7478 271 -129 -1175 O ATOM 1999 HA2 GLY D 4 18.979 34.003 35.793 1.00 81.39 H ATOM 2000 HA3 GLY D 4 20.195 33.127 35.319 1.00 81.39 H ATOM 2001 N ARG D 5 17.708 32.659 34.103 1.00 59.69 N ANISOU 2001 N ARG D 5 9645 6252 6781 384 -62 -1121 N ATOM 2002 CA ARG D 5 16.777 31.845 33.326 1.00 54.98 C ANISOU 2002 CA ARG D 5 8996 5748 6147 420 -73 -1087 C ATOM 2003 C ARG D 5 16.847 32.304 31.879 1.00 55.19 C ANISOU 2003 C ARG D 5 9023 5753 6192 468 -48 -1035 C ATOM 2004 O ARG D 5 16.480 33.435 31.555 1.00 52.41 O ANISOU 2004 O ARG D 5 8704 5359 5852 528 -7 -1022 O ATOM 2005 CB ARG D 5 15.346 31.936 33.864 1.00 52.33 C ANISOU 2005 CB ARG D 5 8648 5471 5766 475 -62 -1098 C ATOM 2006 CG ARG D 5 14.339 31.068 33.121 1.00 49.57 C ANISOU 2006 CG ARG D 5 8242 5218 5373 512 -74 -1065 C ATOM 2007 CD ARG D 5 12.911 31.311 33.623 1.00 49.76 C ANISOU 2007 CD ARG D 5 8258 5293 5355 572 -58 -1075 C ATOM 2008 NE ARG D 5 11.913 30.814 32.669 1.00 50.18 N ANISOU 2008 NE ARG D 5 8266 5424 5375 626 -58 -1034 N ATOM 2009 CZ ARG D 5 11.146 29.736 32.844 1.00 50.63 C ANISOU 2009 CZ ARG D 5 8274 5574 5389 623 -86 -1036 C ATOM 2010 NH1 ARG D 5 11.227 29.012 33.961 1.00 50.40 N ANISOU 2010 NH1 ARG D 5 8233 5575 5342 568 -118 -1076 N ATOM 2011 NH2 ARG D 5 10.285 29.381 31.892 1.00 50.53 N ANISOU 2011 NH2 ARG D 5 8224 5626 5350 675 -83 -996 N ATOM 2012 H ARG D 5 17.758 33.476 33.840 1.00 71.62 H ATOM 2013 HA ARG D 5 17.056 30.917 33.364 1.00 65.98 H ATOM 2014 HB2 ARG D 5 15.346 31.659 34.793 1.00 62.80 H ATOM 2015 HB3 ARG D 5 15.048 32.857 33.797 1.00 62.80 H ATOM 2016 HG2 ARG D 5 14.369 31.280 32.175 1.00 59.48 H ATOM 2017 HG3 ARG D 5 14.556 30.133 33.262 1.00 59.48 H ATOM 2018 HD2 ARG D 5 12.784 30.846 34.465 1.00 59.71 H ATOM 2019 HD3 ARG D 5 12.771 32.263 33.741 1.00 59.71 H ATOM 2020 HE ARG D 5 11.814 31.254 31.937 1.00 60.21 H ATOM 2021 HH11 ARG D 5 11.783 29.234 34.578 1.00 60.48 H ATOM 2022 HH12 ARG D 5 10.725 28.321 34.062 1.00 60.48 H ATOM 2023 HH21 ARG D 5 10.225 29.846 31.171 1.00 60.64 H ATOM 2024 HH22 ARG D 5 9.783 28.692 32.002 1.00 60.64 H ATOM 2025 N GLN D 6 17.338 31.430 31.015 1.00 55.42 N ANISOU 2025 N GLN D 6 9018 5812 6225 441 -74 -1007 N ATOM 2026 CA GLN D 6 17.327 31.691 29.587 1.00 56.18 C ANISOU 2026 CA GLN D 6 9108 5903 6335 486 -54 -955 C ATOM 2027 C GLN D 6 15.937 31.361 29.058 1.00 56.01 C ANISOU 2027 C GLN D 6 9047 5966 6268 553 -49 -927 C ATOM 2028 O GLN D 6 15.411 30.280 29.324 1.00 58.06 O ANISOU 2028 O GLN D 6 9263 6308 6491 537 -81 -934 O ATOM 2029 CB GLN D 6 18.413 30.847 28.907 1.00 55.31 C ANISOU 2029 CB GLN D 6 8976 5792 6246 428 -85 -936 C ATOM 2030 CG GLN D 6 18.472 30.929 27.366 1.00 56.13 C ANISOU 2030 CG GLN D 6 9067 5897 6362 468 -72 -881 C ATOM 2031 CD GLN D 6 19.709 30.240 26.772 1.00 55.06 C ANISOU 2031 CD GLN D 6 8918 5745 6255 406 -99 -866 C ATOM 2032 OE1 GLN D 6 20.540 29.685 27.495 1.00 53.34 O ANISOU 2032 OE1 GLN D 6 8702 5516 6049 332 -129 -897 O ATOM 2033 NE2 GLN D 6 19.822 30.272 25.444 1.00 55.66 N ANISOU 2033 NE2 GLN D 6 8983 5822 6344 436 -89 -819 N ATOM 2034 H GLN D 6 17.686 30.674 31.232 1.00 66.50 H ATOM 2035 HA GLN D 6 17.510 32.629 29.422 1.00 67.42 H ATOM 2036 HB2 GLN D 6 19.276 31.132 29.244 1.00 66.37 H ATOM 2037 HB3 GLN D 6 18.267 29.917 29.141 1.00 66.37 H ATOM 2038 HG2 GLN D 6 17.684 30.499 26.998 1.00 67.36 H ATOM 2039 HG3 GLN D 6 18.494 31.862 27.102 1.00 67.36 H ATOM 2040 HE21 GLN D 6 19.221 30.664 24.971 1.00 66.79 H ATOM 2041 HE22 GLN D 6 20.497 29.901 25.061 1.00 66.79 H ATOM 2042 N THR D 7 15.317 32.295 28.346 1.00 57.17 N ANISOU 2042 N THR D 7 9211 6095 6417 628 -9 -898 N ATOM 2043 CA THR D 7 14.129 31.954 27.578 1.00 56.12 C ANISOU 2043 CA THR D 7 9038 6039 6246 691 -4 -863 C ATOM 2044 C THR D 7 14.585 31.427 26.221 1.00 49.37 C ANISOU 2044 C THR D 7 8155 5198 5403 689 -14 -817 C ATOM 2045 O THR D 7 15.423 32.041 25.557 1.00 50.62 O ANISOU 2045 O THR D 7 8343 5289 5603 687 3 -798 O ATOM 2046 CB THR D 7 13.182 33.146 27.415 1.00 62.08 C ANISOU 2046 CB THR D 7 9820 6773 6994 775 43 -852 C ATOM 2047 OG1 THR D 7 12.034 32.737 26.644 1.00 63.70 O ANISOU 2047 OG1 THR D 7 9984 7058 7162 835 45 -818 O ATOM 2048 CG2 THR D 7 13.885 34.325 26.730 1.00 62.73 C ANISOU 2048 CG2 THR D 7 9949 6763 7124 797 79 -832 C ATOM 2049 H THR D 7 15.559 33.119 28.292 1.00 68.61 H ATOM 2050 HA THR D 7 13.647 31.245 28.032 1.00 67.34 H ATOM 2051 HB THR D 7 12.888 33.439 28.291 1.00 74.49 H ATOM 2052 HG1 THR D 7 11.508 33.385 26.549 1.00 76.44 H ATOM 2053 HG21 THR D 7 13.270 35.068 26.636 1.00 75.28 H ATOM 2054 HG22 THR D 7 14.646 34.610 27.259 1.00 75.28 H ATOM 2055 HG23 THR D 7 14.196 34.059 25.850 1.00 75.28 H ATOM 2056 N TYR D 8 14.086 30.262 25.841 1.00 46.60 N ANISOU 2056 N TYR D 8 7750 4936 5018 686 -44 -800 N ATOM 2057 CA TYR D 8 14.506 29.662 24.588 1.00 44.11 C ANISOU 2057 CA TYR D 8 7405 4641 4712 681 -57 -757 C ATOM 2058 C TYR D 8 13.727 30.278 23.439 1.00 44.42 C ANISOU 2058 C TYR D 8 7442 4688 4745 765 -23 -711 C ATOM 2059 O TYR D 8 12.545 30.602 23.580 1.00 44.71 O ANISOU 2059 O TYR D 8 7474 4761 4751 825 -4 -709 O ATOM 2060 CB TYR D 8 14.298 28.152 24.617 1.00 43.48 C ANISOU 2060 CB TYR D 8 7269 4654 4600 643 -104 -756 C ATOM 2061 CG TYR D 8 15.109 27.433 25.684 1.00 43.12 C ANISOU 2061 CG TYR D 8 7222 4604 4560 557 -141 -800 C ATOM 2062 CD1 TYR D 8 16.103 28.082 26.429 1.00 43.31 C ANISOU 2062 CD1 TYR D 8 7293 4543 4621 512 -135 -832 C ATOM 2063 CD2 TYR D 8 14.874 26.116 25.949 1.00 42.60 C ANISOU 2063 CD2 TYR D 8 7107 4619 4461 520 -183 -807 C ATOM 2064 CE1 TYR D 8 16.829 27.399 27.411 1.00 42.98 C ANISOU 2064 CE1 TYR D 8 7248 4499 4583 433 -170 -872 C ATOM 2065 CE2 TYR D 8 15.582 25.439 26.906 1.00 42.27 C ANISOU 2065 CE2 TYR D 8 7062 4575 4423 442 -218 -846 C ATOM 2066 CZ TYR D 8 16.556 26.059 27.627 1.00 42.45 C ANISOU 2066 CZ TYR D 8 7130 4516 4482 398 -212 -878 C ATOM 2067 OH TYR D 8 17.229 25.303 28.560 1.00 42.08 O ANISOU 2067 OH TYR D 8 7078 4475 4437 321 -248 -915 O ATOM 2068 H TYR D 8 13.509 29.803 26.285 1.00 55.91 H ATOM 2069 HA TYR D 8 15.450 29.838 24.447 1.00 52.93 H ATOM 2070 HB2 TYR D 8 13.360 27.971 24.787 1.00 52.18 H ATOM 2071 HB3 TYR D 8 14.551 27.786 23.756 1.00 52.18 H ATOM 2072 HD1 TYR D 8 16.281 28.981 26.271 1.00 51.98 H ATOM 2073 HD2 TYR D 8 14.218 25.666 25.466 1.00 51.12 H ATOM 2074 HE1 TYR D 8 17.494 27.831 27.897 1.00 51.57 H ATOM 2075 HE2 TYR D 8 15.404 24.539 27.056 1.00 50.72 H ATOM 2076 HH TYR D 8 17.803 25.774 28.952 1.00 50.50 H ATOM 2077 N THR D 9 14.400 30.443 22.305 1.00 44.35 N ANISOU 2077 N THR D 9 7438 4647 4767 769 -15 -674 N ATOM 2078 CA THR D 9 13.779 31.035 21.132 1.00 44.63 C ANISOU 2078 CA THR D 9 7473 4685 4801 847 18 -628 C ATOM 2079 C THR D 9 12.737 30.094 20.541 1.00 44.33 C ANISOU 2079 C THR D 9 7378 4748 4717 881 1 -601 C ATOM 2080 O THR D 9 12.694 28.893 20.835 1.00 43.83 O ANISOU 2080 O THR D 9 7273 4751 4630 838 -39 -611 O ATOM 2081 CB THR D 9 14.816 31.354 20.050 1.00 44.60 C ANISOU 2081 CB THR D 9 7484 4621 4839 838 27 -594 C ATOM 2082 OG1 THR D 9 15.413 30.132 19.581 1.00 43.98 O ANISOU 2082 OG1 THR D 9 7365 4584 4759 785 -13 -581 O ATOM 2083 CG2 THR D 9 15.898 32.277 20.573 1.00 44.88 C ANISOU 2083 CG2 THR D 9 7577 4555 4922 803 44 -619 C ATOM 2084 H THR D 9 15.223 30.219 22.190 1.00 53.22 H ATOM 2085 HA THR D 9 13.337 31.861 21.385 1.00 53.56 H ATOM 2086 HB THR D 9 14.374 31.797 19.308 1.00 53.51 H ATOM 2087 HG1 THR D 9 15.983 30.301 18.987 1.00 52.77 H ATOM 2088 HG21 THR D 9 16.541 32.464 19.871 1.00 53.86 H ATOM 2089 HG22 THR D 9 15.506 33.112 20.871 1.00 53.86 H ATOM 2090 HG23 THR D 9 16.357 31.860 21.318 1.00 53.86 H ATOM 2091 N ARG D 10 11.886 30.680 19.696 1.00 31.67 N ANISOU 2091 N ARG D 10 4796 3823 3416 1012 -367 -192 N ATOM 2092 CA ARG D 10 10.892 29.926 18.945 1.00 34.83 C ANISOU 2092 CA ARG D 10 5190 4209 3834 1067 -409 -229 C ATOM 2093 C ARG D 10 11.542 28.757 18.220 1.00 33.47 C ANISOU 2093 C ARG D 10 5011 4053 3654 1073 -394 -205 C ATOM 2094 O ARG D 10 11.058 27.620 18.279 1.00 32.19 O ANISOU 2094 O ARG D 10 4798 3908 3525 1086 -405 -224 O ATOM 2095 CB ARG D 10 10.203 30.857 17.938 1.00 41.66 C ANISOU 2095 CB ARG D 10 6129 5027 4674 1119 -451 -253 C ATOM 2096 CG ARG D 10 9.050 30.222 17.146 1.00 50.29 C ANISOU 2096 CG ARG D 10 7220 6101 5785 1179 -499 -295 C ATOM 2097 CD ARG D 10 8.635 31.061 15.902 1.00 59.67 C ANISOU 2097 CD ARG D 10 8492 7241 6938 1231 -536 -309 C ATOM 2098 NE ARG D 10 9.752 31.275 14.977 1.00 69.49 N ANISOU 2098 NE ARG D 10 9796 8475 8133 1228 -514 -267 N ATOM 2099 CZ ARG D 10 10.333 30.318 14.247 1.00 76.33 C ANISOU 2099 CZ ARG D 10 10662 9350 8988 1236 -502 -246 C ATOM 2100 NH1 ARG D 10 11.346 30.620 13.450 1.00 79.46 N ANISOU 2100 NH1 ARG D 10 11116 9737 9340 1233 -481 -209 N ATOM 2101 NH2 ARG D 10 9.925 29.055 14.317 1.00 77.69 N ANISOU 2101 NH2 ARG D 10 10779 9544 9194 1247 -510 -262 N ATOM 2102 H ARG D 10 11.868 31.525 19.541 1.00 38.01 H ATOM 2103 HA ARG D 10 10.221 29.578 19.553 1.00 41.79 H ATOM 2104 HB2 ARG D 10 9.843 31.619 18.419 1.00 50.00 H ATOM 2105 HB3 ARG D 10 10.865 31.162 17.297 1.00 50.00 H ATOM 2106 HG2 ARG D 10 9.326 29.344 16.837 1.00 60.34 H ATOM 2107 HG3 ARG D 10 8.276 30.142 17.725 1.00 60.34 H ATOM 2108 HD2 ARG D 10 7.934 30.592 15.423 1.00 71.60 H ATOM 2109 HD3 ARG D 10 8.317 31.928 16.196 1.00 71.60 H ATOM 2110 HE ARG D 10 10.055 32.076 14.897 1.00 83.39 H ATOM 2111 HH11 ARG D 10 11.621 31.433 13.395 1.00 95.36 H ATOM 2112 HH12 ARG D 10 11.720 30.006 12.979 1.00 95.36 H ATOM 2113 HH21 ARG D 10 9.271 28.843 14.834 1.00 93.22 H ATOM 2114 HH22 ARG D 10 10.311 28.451 13.842 1.00 93.22 H ATOM 2115 N TYR D 11 12.663 29.031 17.551 1.00 34.02 N ANISOU 2115 N TYR D 11 5132 4116 3680 1062 -368 -164 N ATOM 2116 CA TYR D 11 13.358 28.019 16.767 1.00 36.13 C ANISOU 2116 CA TYR D 11 5400 4394 3932 1068 -353 -139 C ATOM 2117 C TYR D 11 13.914 26.906 17.661 1.00 34.20 C ANISOU 2117 C TYR D 11 5079 4197 3717 1024 -317 -120 C ATOM 2118 O TYR D 11 13.792 25.720 17.335 1.00 36.68 O ANISOU 2118 O TYR D 11 5360 4526 4048 1040 -322 -125 O ATOM 2119 CB TYR D 11 14.465 28.704 15.952 1.00 38.15 C ANISOU 2119 CB TYR D 11 5730 4633 4134 1062 -332 -98 C ATOM 2120 CG TYR D 11 15.346 27.754 15.197 1.00 39.99 C ANISOU 2120 CG TYR D 11 5967 4878 4348 1062 -310 -66 C ATOM 2121 CD1 TYR D 11 14.919 27.185 14.017 1.00 41.74 C ANISOU 2121 CD1 TYR D 11 6215 5081 4562 1114 -341 -81 C ATOM 2122 CD2 TYR D 11 16.598 27.407 15.682 1.00 41.59 C ANISOU 2122 CD2 TYR D 11 6147 5113 4541 1010 -260 -21 C ATOM 2123 CE1 TYR D 11 15.713 26.298 13.327 1.00 44.35 C ANISOU 2123 CE1 TYR D 11 6549 5424 4877 1115 -322 -53 C ATOM 2124 CE2 TYR D 11 17.401 26.518 15.012 1.00 43.92 C ANISOU 2124 CE2 TYR D 11 6445 5422 4821 1010 -240 8 C ATOM 2125 CZ TYR D 11 16.956 25.961 13.827 1.00 45.78 C ANISOU 2125 CZ TYR D 11 6708 5638 5050 1063 -271 -8 C ATOM 2126 OH TYR D 11 17.759 25.076 13.143 1.00 47.58 O ANISOU 2126 OH TYR D 11 6939 5878 5261 1063 -252 21 O ATOM 2127 H TYR D 11 13.042 29.803 17.538 1.00 40.83 H ATOM 2128 HA TYR D 11 12.733 27.618 16.144 1.00 43.35 H ATOM 2129 HB2 TYR D 11 14.054 29.301 15.308 1.00 45.78 H ATOM 2130 HB3 TYR D 11 15.028 29.212 16.557 1.00 45.78 H ATOM 2131 HD1 TYR D 11 14.080 27.405 13.680 1.00 50.08 H ATOM 2132 HD2 TYR D 11 16.895 27.776 16.482 1.00 49.90 H ATOM 2133 HE1 TYR D 11 15.412 25.923 12.531 1.00 53.22 H ATOM 2134 HE2 TYR D 11 18.240 26.298 15.349 1.00 52.71 H ATOM 2135 HH TYR D 11 18.480 24.964 13.557 1.00 57.10 H ATOM 2136 N GLN D 12 14.512 27.257 18.797 1.00 31.76 N ANISOU 2136 N GLN D 12 4740 3913 3415 969 -281 -98 N ATOM 2137 CA GLN D 12 15.060 26.229 19.673 1.00 29.75 C ANISOU 2137 CA GLN D 12 4413 3704 3188 926 -245 -80 C ATOM 2138 C GLN D 12 13.973 25.288 20.149 1.00 26.54 C ANISOU 2138 C GLN D 12 3938 3313 2833 943 -270 -120 C ATOM 2139 O GLN D 12 14.099 24.066 20.021 1.00 25.64 O ANISOU 2139 O GLN D 12 3784 3222 2737 945 -264 -116 O ATOM 2140 CB GLN D 12 15.780 26.863 20.847 1.00 30.90 C ANISOU 2140 CB GLN D 12 4537 3870 3332 866 -205 -54 C ATOM 2141 CG GLN D 12 17.040 27.541 20.421 1.00 31.71 C ANISOU 2141 CG GLN D 12 4696 3966 3386 842 -172 -7 C ATOM 2142 CD GLN D 12 17.633 28.357 21.523 1.00 31.59 C ANISOU 2142 CD GLN D 12 4671 3965 3368 788 -139 14 C ATOM 2143 OE1 GLN D 12 16.916 29.021 22.284 1.00 32.24 O ANISOU 2143 OE1 GLN D 12 4738 4042 3470 783 -153 -12 O ATOM 2144 NE2 GLN D 12 18.949 28.275 21.660 1.00 31.68 N ANISOU 2144 NE2 GLN D 12 4685 3997 3356 745 -92 62 N ATOM 2145 H GLN D 12 14.612 28.064 19.076 1.00 38.12 H ATOM 2146 HA GLN D 12 15.708 25.706 19.176 1.00 35.70 H ATOM 2147 HB2 GLN D 12 15.202 27.525 21.256 1.00 37.08 H ATOM 2148 HB3 GLN D 12 16.009 26.174 21.491 1.00 37.08 H ATOM 2149 HG2 GLN D 12 17.689 26.871 20.157 1.00 38.05 H ATOM 2150 HG3 GLN D 12 16.847 28.132 19.676 1.00 38.05 H ATOM 2151 HE21 GLN D 12 19.407 27.774 21.131 1.00 38.02 H ATOM 2152 HE22 GLN D 12 19.346 28.723 22.278 1.00 38.02 H ATOM 2153 N THR D 13 12.865 25.848 20.642 1.00 26.42 N ANISOU 2153 N THR D 13 3912 3285 2842 958 -302 -160 N ATOM 2154 CA THR D 13 11.772 25.022 21.148 1.00 25.84 C ANISOU 2154 CA THR D 13 3774 3225 2819 975 -327 -200 C ATOM 2155 C THR D 13 11.160 24.184 20.047 1.00 27.66 C ANISOU 2155 C THR D 13 4015 3441 3054 1029 -362 -223 C ATOM 2156 O THR D 13 10.743 23.045 20.285 1.00 26.08 O ANISOU 2156 O THR D 13 3756 3263 2889 1035 -368 -239 O ATOM 2157 CB THR D 13 10.722 25.910 21.785 1.00 26.96 C ANISOU 2157 CB THR D 13 3912 3351 2981 983 -356 -238 C ATOM 2158 OG1 THR D 13 11.305 26.492 22.950 1.00 28.74 O ANISOU 2158 OG1 THR D 13 4114 3597 3209 928 -320 -217 O ATOM 2159 CG2 THR D 13 9.477 25.117 22.174 1.00 26.96 C ANISOU 2159 CG2 THR D 13 3852 3360 3032 1008 -388 -284 C ATOM 2160 H THR D 13 12.725 26.695 20.694 1.00 31.71 H ATOM 2161 HA THR D 13 12.115 24.423 21.829 1.00 31.01 H ATOM 2162 HB THR D 13 10.464 26.610 21.164 1.00 32.35 H ATOM 2163 HG1 THR D 13 11.540 25.889 23.485 1.00 34.49 H ATOM 2164 HG21 THR D 13 8.821 25.706 22.579 1.00 32.35 H ATOM 2165 HG22 THR D 13 9.087 24.705 21.387 1.00 32.35 H ATOM 2166 HG23 THR D 13 9.712 24.423 22.810 1.00 32.35 H ATOM 2167 N LEU D 14 11.078 24.741 18.841 1.00 32.38 N ANISOU 2167 N LEU D 14 4686 4001 3615 1070 -385 -225 N ATOM 2168 CA LEU D 14 10.543 24.001 17.705 1.00 37.36 C ANISOU 2168 CA LEU D 14 5334 4616 4246 1124 -418 -245 C ATOM 2169 C LEU D 14 11.417 22.797 17.384 1.00 33.98 C ANISOU 2169 C LEU D 14 4882 4215 3814 1111 -390 -213 C ATOM 2170 O LEU D 14 10.918 21.678 17.216 1.00 31.93 O ANISOU 2170 O LEU D 14 4581 3967 3582 1132 -405 -232 O ATOM 2171 CB LEU D 14 10.437 24.923 16.497 1.00 46.04 C ANISOU 2171 CB LEU D 14 6521 5670 5303 1166 -444 -247 C ATOM 2172 CG LEU D 14 9.832 24.304 15.235 1.00 54.89 C ANISOU 2172 CG LEU D 14 7667 6769 6419 1225 -481 -269 C ATOM 2173 CD1 LEU D 14 8.349 24.068 15.463 1.00 57.10 C ANISOU 2173 CD1 LEU D 14 7913 7040 6740 1261 -527 -324 C ATOM 2174 CD2 LEU D 14 10.087 25.172 13.985 1.00 58.11 C ANISOU 2174 CD2 LEU D 14 8166 7136 6776 1258 -496 -259 C ATOM 2175 H LEU D 14 11.326 25.544 18.656 1.00 38.86 H ATOM 2176 HA LEU D 14 9.653 23.681 17.922 1.00 44.84 H ATOM 2177 HB2 LEU D 14 9.886 25.683 16.739 1.00 55.25 H ATOM 2178 HB3 LEU D 14 11.329 25.231 16.269 1.00 55.25 H ATOM 2179 HG LEU D 14 10.248 23.440 15.082 1.00 65.87 H ATOM 2180 HD11 LEU D 14 7.965 23.675 14.663 1.00 68.52 H ATOM 2181 HD12 LEU D 14 8.237 23.465 16.214 1.00 68.52 H ATOM 2182 HD13 LEU D 14 7.920 24.917 15.654 1.00 68.52 H ATOM 2183 HD21 LEU D 14 9.687 24.741 13.214 1.00 69.73 H ATOM 2184 HD22 LEU D 14 9.687 26.045 14.121 1.00 69.73 H ATOM 2185 HD23 LEU D 14 11.044 25.263 13.854 1.00 69.73 H ATOM 2186 N GLU D 15 12.735 23.006 17.329 1.00 31.05 N ANISOU 2186 N GLU D 15 3885 4286 3627 1303 222 -245 N ATOM 2187 CA GLU D 15 13.649 21.910 17.039 1.00 29.11 C ANISOU 2187 CA GLU D 15 3688 3975 3398 1276 246 -256 C ATOM 2188 C GLU D 15 13.630 20.858 18.151 1.00 29.12 C ANISOU 2188 C GLU D 15 3635 3996 3434 1231 228 -250 C ATOM 2189 O GLU D 15 13.678 19.652 17.875 1.00 30.65 O ANISOU 2189 O GLU D 15 3858 4166 3623 1190 212 -254 O ATOM 2190 CB GLU D 15 15.057 22.463 16.829 1.00 30.49 C ANISOU 2190 CB GLU D 15 3902 4083 3601 1312 316 -269 C ATOM 2191 CG GLU D 15 15.235 23.257 15.541 1.00 35.01 C ANISOU 2191 CG GLU D 15 4544 4620 4137 1351 337 -278 C ATOM 2192 CD GLU D 15 15.025 22.423 14.279 1.00 40.85 C ANISOU 2192 CD GLU D 15 5360 5326 4836 1327 317 -286 C ATOM 2193 OE1 GLU D 15 14.323 22.929 13.376 1.00 43.68 O ANISOU 2193 OE1 GLU D 15 5749 5700 5148 1343 295 -285 O ATOM 2194 OE2 GLU D 15 15.557 21.278 14.178 1.00 41.42 O ANISOU 2194 OE2 GLU D 15 5461 5356 4919 1292 323 -293 O ATOM 2195 H GLU D 15 13.118 23.765 17.455 1.00 37.26 H ATOM 2196 HA GLU D 15 13.371 21.478 16.216 1.00 34.93 H ATOM 2197 HB2 GLU D 15 15.274 23.051 17.569 1.00 36.59 H ATOM 2198 HB3 GLU D 15 15.682 21.721 16.806 1.00 36.59 H ATOM 2199 HG2 GLU D 15 14.592 23.983 15.528 1.00 42.01 H ATOM 2200 HG3 GLU D 15 16.136 23.615 15.515 1.00 42.01 H ATOM 2201 N LEU D 16 13.583 21.289 19.411 1.00 28.11 N ANISOU 2201 N LEU D 16 3429 3909 3341 1238 231 -241 N ATOM 2202 CA LEU D 16 13.473 20.333 20.514 1.00 26.13 C ANISOU 2202 CA LEU D 16 3121 3683 3122 1195 210 -233 C ATOM 2203 C LEU D 16 12.193 19.506 20.412 1.00 26.50 C ANISOU 2203 C LEU D 16 3153 3780 3136 1153 142 -224 C ATOM 2204 O LEU D 16 12.215 18.282 20.610 1.00 25.19 O ANISOU 2204 O LEU D 16 2988 3604 2979 1108 124 -224 O ATOM 2205 CB LEU D 16 13.538 21.073 21.848 1.00 24.40 C ANISOU 2205 CB LEU D 16 2820 3507 2944 1214 222 -224 C ATOM 2206 CG LEU D 16 14.908 21.704 22.074 1.00 24.04 C ANISOU 2206 CG LEU D 16 2787 3408 2939 1250 292 -234 C ATOM 2207 CD1 LEU D 16 14.849 22.629 23.246 1.00 23.69 C ANISOU 2207 CD1 LEU D 16 2665 3410 2927 1275 301 -225 C ATOM 2208 CD2 LEU D 16 15.979 20.633 22.292 1.00 24.38 C ANISOU 2208 CD2 LEU D 16 2852 3394 3018 1222 322 -243 C ATOM 2209 H LEU D 16 13.613 22.114 19.652 1.00 33.73 H ATOM 2210 HA LEU D 16 14.225 19.722 20.476 1.00 31.35 H ATOM 2211 HB2 LEU D 16 12.874 21.779 21.855 1.00 29.28 H ATOM 2212 HB3 LEU D 16 13.370 20.447 22.569 1.00 29.28 H ATOM 2213 HG LEU D 16 15.153 22.222 21.291 1.00 28.85 H ATOM 2214 HD11 LEU D 16 15.724 23.024 23.381 1.00 28.43 H ATOM 2215 HD12 LEU D 16 14.195 23.323 23.067 1.00 28.43 H ATOM 2216 HD13 LEU D 16 14.589 22.124 24.033 1.00 28.43 H ATOM 2217 HD21 LEU D 16 16.835 21.067 22.432 1.00 29.26 H ATOM 2218 HD22 LEU D 16 15.744 20.106 23.072 1.00 29.26 H ATOM 2219 HD23 LEU D 16 16.021 20.064 21.508 1.00 29.26 H ATOM 2220 N GLU D 17 11.066 20.154 20.104 1.00 27.81 N ANISOU 2220 N GLU D 17 3304 3999 3262 1166 102 -215 N ATOM 2221 CA GLU D 17 9.804 19.429 19.979 1.00 30.82 C ANISOU 2221 CA GLU D 17 3671 4430 3610 1127 36 -206 C ATOM 2222 C GLU D 17 9.811 18.479 18.781 1.00 28.88 C ANISOU 2222 C GLU D 17 3503 4140 3330 1101 24 -215 C ATOM 2223 O GLU D 17 9.200 17.407 18.829 1.00 27.90 O ANISOU 2223 O GLU D 17 3372 4034 3194 1055 -19 -211 O ATOM 2224 CB GLU D 17 8.645 20.419 19.856 1.00 35.85 C ANISOU 2224 CB GLU D 17 4278 5131 4211 1151 1 -195 C ATOM 2225 CG GLU D 17 8.261 21.010 21.171 1.00 40.29 C ANISOU 2225 CG GLU D 17 4750 5755 4802 1160 -9 -182 C ATOM 2226 CD GLU D 17 7.531 20.004 22.048 1.00 45.45 C ANISOU 2226 CD GLU D 17 5346 6457 5466 1111 -57 -171 C ATOM 2227 OE1 GLU D 17 7.438 20.246 23.269 1.00 46.66 O ANISOU 2227 OE1 GLU D 17 5424 6651 5653 1111 -58 -161 O ATOM 2228 OE2 GLU D 17 7.021 18.986 21.507 1.00 47.15 O ANISOU 2228 OE2 GLU D 17 5590 6670 5654 1072 -94 -171 O ATOM 2229 H GLU D 17 11.008 21.000 19.964 1.00 33.37 H ATOM 2230 HA GLU D 17 9.664 18.900 20.780 1.00 36.99 H ATOM 2231 HB2 GLU D 17 8.907 21.142 19.266 1.00 43.02 H ATOM 2232 HB3 GLU D 17 7.872 19.958 19.495 1.00 43.02 H ATOM 2233 HG2 GLU D 17 9.061 21.297 21.639 1.00 48.35 H ATOM 2234 HG3 GLU D 17 7.671 21.766 21.021 1.00 48.35 H ATOM 2235 N LYS D 18 10.447 18.884 17.681 1.00 28.81 N ANISOU 2235 N LYS D 18 3569 4075 3304 1129 59 -228 N ATOM 2236 CA LYS D 18 10.587 18.008 16.524 1.00 28.33 C ANISOU 2236 CA LYS D 18 3585 3965 3212 1106 53 -239 C ATOM 2237 C LYS D 18 11.323 16.723 16.904 1.00 28.00 C ANISOU 2237 C LYS D 18 3552 3883 3204 1066 65 -244 C ATOM 2238 O LYS D 18 10.892 15.619 16.559 1.00 27.80 O ANISOU 2238 O LYS D 18 3548 3856 3160 1024 30 -244 O ATOM 2239 CB LYS D 18 11.321 18.774 15.418 1.00 32.41 C ANISOU 2239 CB LYS D 18 4176 4426 3714 1149 98 -251 C ATOM 2240 CG LYS D 18 11.830 17.951 14.232 1.00 37.90 C ANISOU 2240 CG LYS D 18 4959 5054 4387 1133 109 -265 C ATOM 2241 CD LYS D 18 12.513 18.800 13.139 1.00 41.78 C ANISOU 2241 CD LYS D 18 5521 5493 4861 1178 153 -277 C ATOM 2242 CE LYS D 18 13.096 17.894 12.025 1.00 47.44 C ANISOU 2242 CE LYS D 18 6324 6140 5560 1159 166 -292 C ATOM 2243 NZ LYS D 18 13.830 18.592 10.926 1.00 48.77 N ANISOU 2243 NZ LYS D 18 6566 6251 5713 1199 210 -304 N ATOM 2244 H LYS D 18 10.804 19.659 17.581 1.00 34.58 H ATOM 2245 HA LYS D 18 9.707 17.768 16.196 1.00 33.99 H ATOM 2246 HB2 LYS D 18 10.717 19.445 15.063 1.00 38.90 H ATOM 2247 HB3 LYS D 18 12.091 19.213 15.813 1.00 38.90 H ATOM 2248 HG2 LYS D 18 12.477 17.305 14.554 1.00 45.48 H ATOM 2249 HG3 LYS D 18 11.079 17.491 13.825 1.00 45.48 H ATOM 2250 HD2 LYS D 18 11.860 19.396 12.739 1.00 50.14 H ATOM 2251 HD3 LYS D 18 13.239 19.308 13.533 1.00 50.14 H ATOM 2252 HE2 LYS D 18 13.715 17.268 12.433 1.00 56.92 H ATOM 2253 HE3 LYS D 18 12.365 17.403 11.617 1.00 56.92 H ATOM 2254 HZ1 LYS D 18 14.128 17.998 10.334 1.00 58.53 H ATOM 2255 HZ2 LYS D 18 13.287 19.163 10.513 1.00 58.53 H ATOM 2256 HZ3 LYS D 18 14.522 19.040 11.260 1.00 58.53 H ATOM 2257 N GLU D 19 12.434 16.850 17.634 1.00 28.32 N ANISOU 2257 N GLU D 19 3575 3891 3294 1078 115 -249 N ATOM 2258 CA GLU D 19 13.198 15.676 18.020 1.00 28.88 C ANISOU 2258 CA GLU D 19 3653 3922 3398 1042 131 -254 C ATOM 2259 C GLU D 19 12.426 14.823 19.023 1.00 29.69 C ANISOU 2259 C GLU D 19 3689 4079 3514 997 83 -242 C ATOM 2260 O GLU D 19 12.417 13.583 18.928 1.00 27.64 O ANISOU 2260 O GLU D 19 3446 3802 3253 953 64 -244 O ATOM 2261 CB GLU D 19 14.541 16.111 18.592 1.00 30.40 C ANISOU 2261 CB GLU D 19 3840 4071 3642 1068 196 -261 C ATOM 2262 CG GLU D 19 15.410 14.970 19.040 1.00 35.61 C ANISOU 2262 CG GLU D 19 4504 4686 4338 1034 216 -267 C ATOM 2263 CD GLU D 19 15.848 14.073 17.876 1.00 41.93 C ANISOU 2263 CD GLU D 19 5392 5424 5117 1015 223 -280 C ATOM 2264 OE1 GLU D 19 15.893 14.568 16.733 1.00 44.20 O ANISOU 2264 OE1 GLU D 19 5741 5684 5371 1040 234 -288 O ATOM 2265 OE2 GLU D 19 16.132 12.875 18.097 1.00 45.18 O ANISOU 2265 OE2 GLU D 19 5809 5813 5545 974 218 -282 O ATOM 2266 H GLU D 19 12.759 17.596 17.912 1.00 33.98 H ATOM 2267 HA GLU D 19 13.367 15.135 17.232 1.00 34.66 H ATOM 2268 HB2 GLU D 19 15.026 16.603 17.910 1.00 36.48 H ATOM 2269 HB3 GLU D 19 14.383 16.682 19.359 1.00 36.48 H ATOM 2270 HG2 GLU D 19 16.208 15.326 19.462 1.00 42.73 H ATOM 2271 HG3 GLU D 19 14.916 14.423 19.671 1.00 42.73 H ATOM 2272 N PHE D 20 11.791 15.469 20.006 1.00 30.40 N ANISOU 2272 N PHE D 20 3700 4234 3615 1007 64 -228 N ATOM 2273 CA PHE D 20 11.019 14.728 20.992 1.00 31.61 C ANISOU 2273 CA PHE D 20 3786 4443 3781 966 18 -215 C ATOM 2274 C PHE D 20 9.972 13.845 20.325 1.00 30.34 C ANISOU 2274 C PHE D 20 3648 4304 3575 927 -41 -212 C ATOM 2275 O PHE D 20 9.600 12.793 20.865 1.00 30.76 O ANISOU 2275 O PHE D 20 3671 4377 3637 881 -73 -206 O ATOM 2276 CB PHE D 20 10.354 15.702 21.955 1.00 33.56 C ANISOU 2276 CB PHE D 20 3953 4761 4038 987 2 -202 C ATOM 2277 CG PHE D 20 9.640 15.032 23.080 1.00 34.98 C ANISOU 2277 CG PHE D 20 4057 4998 4234 949 -40 -188 C ATOM 2278 CD1 PHE D 20 10.340 14.581 24.190 1.00 34.09 C ANISOU 2278 CD1 PHE D 20 3902 4878 4174 933 -17 -187 C ATOM 2279 CD2 PHE D 20 8.269 14.849 23.027 1.00 34.60 C ANISOU 2279 CD2 PHE D 20 3983 5014 4152 927 -103 -177 C ATOM 2280 CE1 PHE D 20 9.685 13.977 25.237 1.00 35.11 C ANISOU 2280 CE1 PHE D 20 3961 5059 4319 898 -56 -174 C ATOM 2281 CE2 PHE D 20 7.606 14.240 24.069 1.00 35.10 C ANISOU 2281 CE2 PHE D 20 3977 5130 4230 892 -142 -164 C ATOM 2282 CZ PHE D 20 8.308 13.806 25.173 1.00 35.85 C ANISOU 2282 CZ PHE D 20 4028 5216 4377 878 -119 -163 C ATOM 2283 H PHE D 20 11.793 16.321 20.118 1.00 36.47 H ATOM 2284 HA PHE D 20 11.616 14.158 21.501 1.00 37.93 H ATOM 2285 HB2 PHE D 20 11.033 16.280 22.336 1.00 40.27 H ATOM 2286 HB3 PHE D 20 9.706 16.233 21.466 1.00 40.27 H ATOM 2287 HD1 PHE D 20 11.261 14.704 24.234 1.00 40.91 H ATOM 2288 HD2 PHE D 20 7.791 15.148 22.287 1.00 41.53 H ATOM 2289 HE1 PHE D 20 10.161 13.679 25.978 1.00 42.13 H ATOM 2290 HE2 PHE D 20 6.684 14.123 24.028 1.00 42.12 H ATOM 2291 HZ PHE D 20 7.860 13.389 25.874 1.00 43.02 H ATOM 2292 N HIS D 21 9.505 14.256 19.142 1.00 32.04 N ANISOU 2292 N HIS D 21 3835 4075 4264 580 81 -947 N ATOM 2293 CA HIS D 21 8.495 13.510 18.407 1.00 31.05 C ANISOU 2293 CA HIS D 21 3687 3944 4166 578 32 -932 C ATOM 2294 C HIS D 21 8.985 12.132 17.979 1.00 31.25 C ANISOU 2294 C HIS D 21 3725 3938 4210 587 -71 -965 C ATOM 2295 O HIS D 21 8.192 11.183 17.905 1.00 31.54 O ANISOU 2295 O HIS D 21 3756 3955 4273 566 -127 -944 O ATOM 2296 CB HIS D 21 8.090 14.306 17.181 1.00 30.91 C ANISOU 2296 CB HIS D 21 3636 3965 4144 619 71 -940 C ATOM 2297 CG HIS D 21 6.910 13.738 16.483 1.00 31.74 C ANISOU 2297 CG HIS D 21 3715 4070 4276 615 35 -917 C ATOM 2298 ND1 HIS D 21 5.622 13.974 16.914 1.00 34.01 N ANISOU 2298 ND1 HIS D 21 3987 4363 4574 582 70 -862 N ATOM 2299 CD2 HIS D 21 6.811 12.916 15.417 1.00 31.31 C ANISOU 2299 CD2 HIS D 21 3648 4009 4239 639 -34 -940 C ATOM 2300 CE1 HIS D 21 4.778 13.352 16.115 1.00 33.88 C ANISOU 2300 CE1 HIS D 21 3948 4344 4580 587 25 -853 C ATOM 2301 NE2 HIS D 21 5.473 12.689 15.209 1.00 32.99 N ANISOU 2301 NE2 HIS D 21 3838 4224 4473 621 -39 -899 N ATOM 2302 H HIS D 21 9.763 14.974 18.745 1.00 38.45 H ATOM 2303 HA HIS D 21 7.712 13.394 18.967 1.00 37.26 H ATOM 2304 HB2 HIS D 21 7.871 15.212 17.451 1.00 37.09 H ATOM 2305 HB3 HIS D 21 8.831 14.318 16.554 1.00 37.09 H ATOM 2306 HD1 HIS D 21 5.403 14.473 17.579 1.00 40.82 H ATOM 2307 HD2 HIS D 21 7.514 12.576 14.912 1.00 37.57 H ATOM 2308 HE1 HIS D 21 3.851 13.355 16.194 1.00 40.65 H ATOM 2309 N PHE D 22 10.272 12.013 17.663 1.00 31.10 N ANISOU 2309 N PHE D 22 3723 3916 4179 617 -96 -1016 N ATOM 2310 CA PHE D 22 10.866 10.760 17.237 1.00 31.61 C ANISOU 2310 CA PHE D 22 3801 3952 4259 628 -191 -1052 C ATOM 2311 C PHE D 22 11.588 10.018 18.361 1.00 34.01 C ANISOU 2311 C PHE D 22 4141 4218 4562 597 -231 -1056 C ATOM 2312 O PHE D 22 11.601 8.792 18.358 1.00 34.10 O ANISOU 2312 O PHE D 22 4163 4198 4594 586 -312 -1063 O ATOM 2313 CB PHE D 22 11.835 11.041 16.091 1.00 32.14 C ANISOU 2313 CB PHE D 22 3862 4037 4312 684 -198 -1108 C ATOM 2314 CG PHE D 22 11.169 11.716 14.911 1.00 31.34 C ANISOU 2314 CG PHE D 22 3725 3972 4212 717 -163 -1107 C ATOM 2315 CD1 PHE D 22 10.523 10.965 13.934 1.00 31.19 C ANISOU 2315 CD1 PHE D 22 3685 3949 4216 730 -220 -1109 C ATOM 2316 CD2 PHE D 22 11.165 13.088 14.797 1.00 30.70 C ANISOU 2316 CD2 PHE D 22 3630 3927 4108 735 -74 -1102 C ATOM 2317 CE1 PHE D 22 9.889 11.586 12.862 1.00 31.12 C ANISOU 2317 CE1 PHE D 22 3643 3973 4208 759 -188 -1107 C ATOM 2318 CE2 PHE D 22 10.527 13.699 13.740 1.00 30.63 C ANISOU 2318 CE2 PHE D 22 3588 3951 4100 764 -42 -1099 C ATOM 2319 CZ PHE D 22 9.891 12.943 12.783 1.00 30.84 C ANISOU 2319 CZ PHE D 22 3595 3974 4150 775 -100 -1102 C ATOM 2320 H PHE D 22 10.832 12.665 17.689 1.00 37.32 H ATOM 2321 HA PHE D 22 10.166 10.179 16.900 1.00 37.94 H ATOM 2322 HB2 PHE D 22 12.541 11.624 16.411 1.00 38.57 H ATOM 2323 HB3 PHE D 22 12.212 10.201 15.783 1.00 38.57 H ATOM 2324 HD1 PHE D 22 10.512 10.037 13.999 1.00 37.43 H ATOM 2325 HD2 PHE D 22 11.581 13.606 15.447 1.00 36.84 H ATOM 2326 HE1 PHE D 22 9.459 11.078 12.212 1.00 37.34 H ATOM 2327 HE2 PHE D 22 10.532 14.626 13.670 1.00 36.76 H ATOM 2328 HZ PHE D 22 9.478 13.363 12.063 1.00 37.01 H ATOM 2329 N ASN D 23 12.145 10.728 19.339 1.00 34.64 N ANISOU 2329 N ASN D 23 4240 4301 4620 583 -176 -1051 N ATOM 2330 CA ASN D 23 12.927 10.124 20.423 1.00 36.23 C ANISOU 2330 CA ASN D 23 4477 4469 4819 555 -208 -1058 C ATOM 2331 C ASN D 23 12.564 10.830 21.719 1.00 33.70 C ANISOU 2331 C ASN D 23 4166 4151 4486 514 -140 -1014 C ATOM 2332 O ASN D 23 12.961 11.977 21.925 1.00 32.26 O ANISOU 2332 O ASN D 23 3985 3994 4280 526 -65 -1017 O ATOM 2333 CB ASN D 23 14.438 10.258 20.194 1.00 38.94 C ANISOU 2333 CB ASN D 23 4839 4813 5142 590 -218 -1113 C ATOM 2334 CG ASN D 23 14.925 9.487 19.008 1.00 42.68 C ANISOU 2334 CG ASN D 23 5307 5281 5627 628 -290 -1159 C ATOM 2335 OD1 ASN D 23 14.891 8.251 18.992 1.00 44.51 O ANISOU 2335 OD1 ASN D 23 5549 5482 5881 616 -372 -1164 O ATOM 2336 ND2 ASN D 23 15.431 10.211 18.008 1.00 42.68 N ANISOU 2336 ND2 ASN D 23 5292 5311 5612 676 -261 -1194 N ATOM 2337 H ASN D 23 12.084 11.584 19.401 1.00 41.57 H ATOM 2338 HA ASN D 23 12.705 9.184 20.506 1.00 43.47 H ATOM 2339 HB2 ASN D 23 14.653 11.193 20.050 1.00 46.73 H ATOM 2340 HB3 ASN D 23 14.906 9.928 20.977 1.00 46.73 H ATOM 2341 HD21 ASN D 23 15.726 9.820 17.301 1.00 51.21 H ATOM 2342 HD22 ASN D 23 15.462 11.068 18.070 1.00 51.21 H ATOM 2343 N ARG D 24 11.861 10.150 22.613 1.00 35.10 N ANISOU 2343 N ARG D 24 4353 4301 4681 467 -165 -975 N ATOM 2344 CA ARG D 24 11.617 10.733 23.930 1.00 35.12 C ANISOU 2344 CA ARG D 24 4369 4302 4672 426 -106 -935 C ATOM 2345 C ARG D 24 12.852 10.693 24.829 1.00 32.03 C ANISOU 2345 C ARG D 24 4013 3893 4263 417 -108 -958 C ATOM 2346 O ARG D 24 12.915 11.449 25.816 1.00 31.10 O ANISOU 2346 O ARG D 24 3907 3781 4128 394 -45 -936 O ATOM 2347 CB ARG D 24 10.437 10.028 24.588 1.00 41.43 C ANISOU 2347 CB ARG D 24 5166 5079 5495 378 -131 -885 C ATOM 2348 CG ARG D 24 9.104 10.458 23.996 1.00 49.88 C ANISOU 2348 CG ARG D 24 6201 6173 6576 378 -98 -850 C ATOM 2349 CD ARG D 24 7.948 10.235 24.959 1.00 58.30 C ANISOU 2349 CD ARG D 24 7268 7226 7657 326 -87 -791 C ATOM 2350 NE ARG D 24 7.529 8.841 24.969 1.00 66.10 N ANISOU 2350 NE ARG D 24 8261 8180 8674 304 -175 -783 N ATOM 2351 CZ ARG D 24 6.696 8.307 24.077 1.00 71.77 C ANISOU 2351 CZ ARG D 24 8954 8900 9414 313 -215 -777 C ATOM 2352 NH1 ARG D 24 6.183 9.052 23.099 1.00 72.69 N ANISOU 2352 NH1 ARG D 24 9041 9051 9528 344 -174 -776 N ATOM 2353 NH2 ARG D 24 6.378 7.023 24.165 1.00 74.66 N ANISOU 2353 NH2 ARG D 24 9328 9233 9805 292 -296 -770 N ATOM 2354 H ARG D 24 11.520 9.370 22.491 1.00 42.12 H ATOM 2355 HA ARG D 24 11.372 11.665 23.813 1.00 42.14 H ATOM 2356 HB2 ARG D 24 10.529 9.070 24.461 1.00 49.71 H ATOM 2357 HB3 ARG D 24 10.429 10.239 25.535 1.00 49.71 H ATOM 2358 HG2 ARG D 24 9.141 11.404 23.783 1.00 59.85 H ATOM 2359 HG3 ARG D 24 8.932 9.942 23.193 1.00 59.85 H ATOM 2360 HD2 ARG D 24 8.227 10.475 25.856 1.00 69.96 H ATOM 2361 HD3 ARG D 24 7.193 10.778 24.684 1.00 69.96 H ATOM 2362 HE ARG D 24 7.887 8.317 25.549 1.00 79.32 H ATOM 2363 HH11 ARG D 24 6.389 9.884 23.039 1.00 87.23 H ATOM 2364 HH12 ARG D 24 5.645 8.700 22.528 1.00 87.23 H ATOM 2365 HH21 ARG D 24 6.707 6.540 24.796 1.00 89.59 H ATOM 2366 HH22 ARG D 24 5.838 6.674 23.593 1.00 89.59 H ATOM 2367 N TYR D 25 13.839 9.853 24.491 1.00 31.13 N ANISOU 2367 N TYR D 25 4426 3718 3683 949 28 250 N ATOM 2368 CA TYR D 25 15.129 9.780 25.173 1.00 31.10 C ANISOU 2368 CA TYR D 25 4391 3787 3638 965 71 190 C ATOM 2369 C TYR D 25 16.231 9.954 24.131 1.00 32.47 C ANISOU 2369 C TYR D 25 4613 3948 3777 1006 95 159 C ATOM 2370 O TYR D 25 16.075 9.544 22.979 1.00 33.97 O ANISOU 2370 O TYR D 25 4878 4078 3953 1031 48 191 O ATOM 2371 CB TYR D 25 15.324 8.427 25.915 1.00 31.12 C ANISOU 2371 CB TYR D 25 4408 3825 3590 976 9 200 C ATOM 2372 CG TYR D 25 14.300 8.157 26.979 1.00 31.87 C ANISOU 2372 CG TYR D 25 4457 3936 3714 937 -18 230 C ATOM 2373 CD1 TYR D 25 13.092 7.546 26.666 1.00 32.28 C ANISOU 2373 CD1 TYR D 25 4549 3932 3783 927 -92 295 C ATOM 2374 CD2 TYR D 25 14.526 8.523 28.293 1.00 33.35 C ANISOU 2374 CD2 TYR D 25 4563 4196 3912 911 32 193 C ATOM 2375 CE1 TYR D 25 12.147 7.307 27.632 1.00 32.17 C ANISOU 2375 CE1 TYR D 25 4494 3933 3796 891 -117 323 C ATOM 2376 CE2 TYR D 25 13.586 8.276 29.276 1.00 33.81 C ANISOU 2376 CE2 TYR D 25 4580 4270 3997 876 8 221 C ATOM 2377 CZ TYR D 25 12.398 7.664 28.932 1.00 33.28 C ANISOU 2377 CZ TYR D 25 4553 4145 3946 866 -67 286 C ATOM 2378 OH TYR D 25 11.435 7.438 29.884 1.00 34.68 O ANISOU 2378 OH TYR D 25 4690 4337 4151 830 -91 314 O ATOM 2379 H TYR D 25 13.775 9.294 23.841 1.00 37.36 H ATOM 2380 HA TYR D 25 15.197 10.500 25.819 1.00 37.32 H ATOM 2381 HB2 TYR D 25 15.273 7.706 25.268 1.00 37.34 H ATOM 2382 HB3 TYR D 25 16.196 8.427 26.339 1.00 37.34 H ATOM 2383 HD1 TYR D 25 12.919 7.298 25.786 1.00 38.73 H ATOM 2384 HD2 TYR D 25 15.330 8.931 28.522 1.00 40.02 H ATOM 2385 HE1 TYR D 25 11.343 6.897 27.407 1.00 38.60 H ATOM 2386 HE2 TYR D 25 13.748 8.528 30.156 1.00 40.57 H ATOM 2387 HH TYR D 25 11.707 7.699 30.635 1.00 41.62 H ATOM 2388 N LEU D 26 17.338 10.580 24.523 1.00 32.39 N ANISOU 2388 N LEU D 26 4558 3994 3755 1012 170 95 N ATOM 2389 CA LEU D 26 18.473 10.808 23.623 1.00 31.73 C ANISOU 2389 CA LEU D 26 4512 3905 3638 1050 201 59 C ATOM 2390 C LEU D 26 19.680 9.988 24.057 1.00 31.12 C ANISOU 2390 C LEU D 26 4445 3883 3495 1081 193 21 C ATOM 2391 O LEU D 26 20.075 10.032 25.225 1.00 31.07 O ANISOU 2391 O LEU D 26 4377 3946 3483 1066 226 -14 O ATOM 2392 CB LEU D 26 18.895 12.276 23.597 1.00 31.07 C ANISOU 2392 CB LEU D 26 4373 3839 3593 1037 299 12 C ATOM 2393 CG LEU D 26 17.877 13.329 23.152 1.00 31.81 C ANISOU 2393 CG LEU D 26 4448 3882 3755 1007 326 38 C ATOM 2394 CD1 LEU D 26 18.564 14.678 23.135 1.00 31.92 C ANISOU 2394 CD1 LEU D 26 4411 3922 3796 1001 426 -18 C ATOM 2395 CD2 LEU D 26 17.277 13.013 21.784 1.00 31.13 C ANISOU 2395 CD2 LEU D 26 4445 3713 3670 1026 268 91 C ATOM 2396 H LEU D 26 17.460 10.888 25.317 1.00 38.87 H ATOM 2397 HA LEU D 26 18.229 10.543 22.723 1.00 38.07 H ATOM 2398 HB2 LEU D 26 19.174 12.519 24.494 1.00 37.28 H ATOM 2399 HB3 LEU D 26 19.656 12.353 23.000 1.00 37.28 H ATOM 2400 HG LEU D 26 17.155 13.366 23.798 1.00 38.17 H ATOM 2401 HD11 LEU D 26 17.927 15.353 22.854 1.00 38.30 H ATOM 2402 HD12 LEU D 26 18.888 14.878 24.027 1.00 38.30 H ATOM 2403 HD13 LEU D 26 19.308 14.645 22.513 1.00 38.30 H ATOM 2404 HD21 LEU D 26 16.642 13.708 21.550 1.00 37.36 H ATOM 2405 HD22 LEU D 26 17.990 12.981 21.126 1.00 37.36 H ATOM 2406 HD23 LEU D 26 16.828 12.154 21.827 1.00 37.36 H ATOM 2407 N THR D 27 20.314 9.316 23.101 1.00 31.69 N ANISOU 2407 N THR D 27 4594 3929 3520 1123 156 25 N ATOM 2408 CA THR D 27 21.692 8.899 23.307 1.00 31.73 C ANISOU 2408 CA THR D 27 4604 3986 3466 1156 173 -25 C ATOM 2409 C THR D 27 22.565 10.124 23.554 1.00 31.13 C ANISOU 2409 C THR D 27 4468 3954 3405 1150 275 -90 C ATOM 2410 O THR D 27 22.221 11.252 23.180 1.00 31.11 O ANISOU 2410 O THR D 27 4440 3927 3452 1132 326 -94 O ATOM 2411 CB THR D 27 22.232 8.165 22.084 1.00 32.74 C ANISOU 2411 CB THR D 27 4823 4070 3545 1202 125 -12 C ATOM 2412 OG1 THR D 27 22.385 9.108 21.022 1.00 34.33 O ANISOU 2412 OG1 THR D 27 5044 4231 3769 1211 168 -22 O ATOM 2413 CG2 THR D 27 21.301 7.071 21.650 1.00 31.85 C ANISOU 2413 CG2 THR D 27 4775 3903 3423 1208 27 54 C ATOM 2414 H THR D 27 19.977 9.095 22.341 1.00 38.03 H ATOM 2415 HA THR D 27 21.748 8.312 24.077 1.00 38.08 H ATOM 2416 HB THR D 27 23.093 7.771 22.295 1.00 39.28 H ATOM 2417 HG1 THR D 27 22.682 8.724 20.337 1.00 41.20 H ATOM 2418 HG21 THR D 27 21.662 6.617 20.873 1.00 38.22 H ATOM 2419 HG22 THR D 27 21.190 6.427 22.367 1.00 38.22 H ATOM 2420 HG23 THR D 27 20.435 7.444 21.424 1.00 38.22 H ATOM 2421 N ARG D 28 23.744 9.894 24.135 1.00 31.63 N ANISOU 2421 N ARG D 28 4510 4082 3425 1168 304 -142 N ATOM 2422 CA ARG D 28 24.635 11.024 24.374 1.00 35.32 C ANISOU 2422 CA ARG D 28 4921 4594 3904 1164 400 -206 C ATOM 2423 C ARG D 28 25.151 11.608 23.065 1.00 35.83 C ANISOU 2423 C ARG D 28 5031 4615 3968 1191 428 -219 C ATOM 2424 O ARG D 28 25.371 12.823 22.961 1.00 33.61 O ANISOU 2424 O ARG D 28 4708 4340 3722 1178 505 -252 O ATOM 2425 CB ARG D 28 25.837 10.642 25.245 1.00 37.58 C ANISOU 2425 CB ARG D 28 5177 4960 4143 1180 425 -260 C ATOM 2426 CG ARG D 28 26.416 11.932 25.851 1.00 40.11 C ANISOU 2426 CG ARG D 28 5415 5333 4493 1160 528 -322 C ATOM 2427 CD ARG D 28 27.685 11.803 26.594 1.00 42.08 C ANISOU 2427 CD ARG D 28 5630 5659 4699 1175 568 -383 C ATOM 2428 NE ARG D 28 28.286 13.128 26.635 1.00 44.44 N ANISOU 2428 NE ARG D 28 5875 5985 5026 1165 665 -438 N ATOM 2429 CZ ARG D 28 29.509 13.379 27.073 1.00 48.14 C ANISOU 2429 CZ ARG D 28 6309 6515 5466 1179 722 -502 C ATOM 2430 NH1 ARG D 28 30.273 12.396 27.528 1.00 49.44 N ANISOU 2430 NH1 ARG D 28 6488 6724 5572 1203 692 -518 N ATOM 2431 NH2 ARG D 28 29.962 14.620 27.056 1.00 50.23 N ANISOU 2431 NH2 ARG D 28 6525 6797 5761 1168 809 -548 N ATOM 2432 H ARG D 28 24.039 9.128 24.390 1.00 37.96 H ATOM 2433 HA ARG D 28 24.142 11.719 24.836 1.00 42.38 H ATOM 2434 HB2 ARG D 28 25.551 10.057 25.965 1.00 45.10 H ATOM 2435 HB3 ARG D 28 26.518 10.216 24.702 1.00 45.10 H ATOM 2436 HG2 ARG D 28 26.568 12.563 25.130 1.00 48.14 H ATOM 2437 HG3 ARG D 28 25.760 12.299 26.464 1.00 48.14 H ATOM 2438 HD2 ARG D 28 27.514 11.503 27.500 1.00 50.50 H ATOM 2439 HD3 ARG D 28 28.284 11.196 26.131 1.00 50.50 H ATOM 2440 HE ARG D 28 27.816 13.792 26.356 1.00 53.33 H ATOM 2441 HH11 ARG D 28 29.977 11.589 27.536 1.00 59.32 H ATOM 2442 HH12 ARG D 28 31.067 12.566 27.814 1.00 59.32 H ATOM 2443 HH21 ARG D 28 29.463 15.256 26.763 1.00 60.27 H ATOM 2444 HH22 ARG D 28 30.754 14.792 27.344 1.00 60.27 H ATOM 2445 N ARG D 29 25.374 10.760 22.069 1.00 36.32 N ANISOU 2445 N ARG D 29 3697 6192 3912 1489 596 864 N ATOM 2446 CA AARG D 29 25.810 11.243 20.764 0.54 38.14 C ANISOU 2446 CA AARG D 29 3957 6421 4115 1474 597 851 C ATOM 2447 CA BARG D 29 25.829 11.279 20.787 0.46 38.14 C ANISOU 2447 CA BARG D 29 3957 6422 4115 1474 597 852 C ATOM 2448 C ARG D 29 24.763 12.180 20.166 1.00 35.49 C ANISOU 2448 C ARG D 29 3642 6072 3771 1459 570 850 C ATOM 2449 O ARG D 29 25.075 13.274 19.695 1.00 34.25 O ANISOU 2449 O ARG D 29 3499 5924 3591 1446 568 848 O ATOM 2450 CB AARG D 29 26.081 10.042 19.851 0.54 41.41 C ANISOU 2450 CB AARG D 29 4386 6821 4528 1478 606 839 C ATOM 2451 CB BARG D 29 26.226 10.125 19.860 0.46 41.39 C ANISOU 2451 CB BARG D 29 4383 6821 4522 1478 608 839 C ATOM 2452 CG AARG D 29 27.077 10.292 18.723 0.54 45.67 C ANISOU 2452 CG AARG D 29 4948 7366 5038 1468 619 826 C ATOM 2453 CG BARG D 29 25.072 9.362 19.255 0.46 44.26 C ANISOU 2453 CG BARG D 29 4761 7157 4898 1477 590 834 C ATOM 2454 CD AARG D 29 27.209 9.068 17.826 0.54 53.87 C ANISOU 2454 CD AARG D 29 6001 8389 6077 1472 626 814 C ATOM 2455 CD BARG D 29 25.451 7.932 18.933 0.46 50.05 C ANISOU 2455 CD BARG D 29 5496 7882 5641 1488 604 826 C ATOM 2456 NE AARG D 29 28.225 9.239 16.789 0.54 61.85 N ANISOU 2456 NE AARG D 29 7033 9407 7062 1464 640 802 N ATOM 2457 NE BARG D 29 24.291 7.186 18.458 0.46 55.93 N ANISOU 2457 NE BARG D 29 6253 8600 6400 1489 586 823 N ATOM 2458 CZ AARG D 29 28.060 9.959 15.681 0.54 68.15 C ANISOU 2458 CZ AARG D 29 7859 10198 7837 1448 629 794 C ATOM 2459 CZ BARG D 29 24.128 5.876 18.597 0.46 61.08 C ANISOU 2459 CZ BARG D 29 6896 9240 7070 1501 592 821 C ATOM 2460 NH1AARG D 29 26.921 10.601 15.454 0.54 70.08 N ANISOU 2460 NH1AARG D 29 8115 10429 8082 1438 604 796 N ATOM 2461 NH1BARG D 29 25.047 5.145 19.209 0.46 62.91 N ANISOU 2461 NH1BARG D 29 7108 9485 7309 1515 615 823 N ATOM 2462 NH2AARG D 29 29.046 10.047 14.797 0.54 70.32 N ANISOU 2462 NH2AARG D 29 8150 10479 8089 1442 644 783 N ATOM 2463 NH2BARG D 29 23.033 5.299 18.130 0.46 63.22 N ANISOU 2463 NH2BARG D 29 7180 9487 7353 1500 574 818 N ATOM 2464 H AARG D 29 25.281 9.907 22.120 0.54 43.59 H ATOM 2465 H BARG D 29 25.274 9.907 22.105 0.46 43.59 H ATOM 2466 HA AARG D 29 26.638 11.738 20.867 0.54 45.77 H ATOM 2467 HA BARG D 29 26.620 11.820 20.936 0.46 45.77 H ATOM 2468 HB2AARG D 29 26.429 9.316 20.392 0.54 49.70 H ATOM 2469 HB2BARG D 29 26.754 10.484 19.130 0.46 49.67 H ATOM 2470 HB3AARG D 29 25.243 9.769 19.445 0.54 49.70 H ATOM 2471 HB3BARG D 29 26.760 9.493 20.366 0.46 49.67 H ATOM 2472 HG2AARG D 29 26.770 11.036 18.182 0.54 54.80 H ATOM 2473 HG2BARG D 29 24.334 9.346 19.885 0.46 53.11 H ATOM 2474 HG3AARG D 29 27.949 10.489 19.102 0.54 54.80 H ATOM 2475 HG3BARG D 29 24.800 9.796 18.431 0.46 53.11 H ATOM 2476 HD2AARG D 29 27.460 8.304 18.369 0.54 64.64 H ATOM 2477 HD2BARG D 29 26.126 7.926 18.236 0.46 60.07 H ATOM 2478 HD3AARG D 29 26.359 8.902 17.390 0.54 64.64 H ATOM 2479 HD3BARG D 29 25.787 7.499 19.734 0.46 60.07 H ATOM 2480 HE AARG D 29 28.982 8.847 16.902 0.54 74.22 H ATOM 2481 HE BARG D 29 23.669 7.626 18.060 0.46 67.12 H ATOM 2482 HH11AARG D 29 26.277 10.548 16.022 0.54 84.09 H ATOM 2483 HH11BARG D 29 25.760 5.517 19.515 0.46 75.49 H ATOM 2484 HH12AARG D 29 26.824 11.065 14.736 0.54 84.09 H ATOM 2485 HH12BARG D 29 24.934 4.297 19.296 0.46 75.49 H ATOM 2486 HH21AARG D 29 29.788 9.636 14.939 0.54 84.38 H ATOM 2487 HH21BARG D 29 22.434 5.771 17.734 0.46 75.86 H ATOM 2488 HH22AARG D 29 28.943 10.515 14.083 0.54 84.38 H ATOM 2489 HH22BARG D 29 22.923 4.451 18.219 0.46 75.86 H ATOM 2490 N ARG D 30 23.491 11.775 20.216 1.00 32.15 N ANISOU 2490 N ARG D 30 3222 5629 3366 1460 550 853 N ATOM 2491 CA ARG D 30 22.427 12.657 19.745 1.00 31.86 C ANISOU 2491 CA ARG D 30 3203 5579 3324 1446 524 853 C ATOM 2492 C ARG D 30 22.353 13.947 20.571 1.00 30.46 C ANISOU 2492 C ARG D 30 3012 5418 3143 1442 517 864 C ATOM 2493 O ARG D 30 22.079 15.026 20.035 1.00 29.55 O ANISOU 2493 O ARG D 30 2914 5303 3010 1427 504 862 O ATOM 2494 CB ARG D 30 21.092 11.933 19.786 1.00 32.70 C ANISOU 2494 CB ARG D 30 3311 5661 3453 1451 504 854 C ATOM 2495 CG ARG D 30 19.965 12.717 19.105 1.00 35.77 C ANISOU 2495 CG ARG D 30 3722 6034 3834 1436 476 852 C ATOM 2496 CD ARG D 30 20.198 12.855 17.575 1.00 39.87 C ANISOU 2496 CD ARG D 30 4276 6544 4329 1422 475 837 C ATOM 2497 NE ARG D 30 19.176 13.723 16.984 1.00 44.72 N ANISOU 2497 NE ARG D 30 4910 7145 4935 1408 449 836 N ATOM 2498 CZ ARG D 30 19.411 14.879 16.369 1.00 48.79 C ANISOU 2498 CZ ARG D 30 5444 7668 5426 1393 444 832 C ATOM 2499 NH1 ARG D 30 20.653 15.327 16.197 1.00 49.85 N ANISOU 2499 NH1 ARG D 30 5579 7822 5540 1389 463 828 N ATOM 2500 NH2 ARG D 30 18.390 15.587 15.901 1.00 49.72 N ANISOU 2500 NH2 ARG D 30 5578 7772 5540 1380 419 831 N ATOM 2501 H ARG D 30 23.225 11.013 20.511 1.00 38.58 H ATOM 2502 HA ARG D 30 22.606 12.902 18.824 1.00 38.23 H ATOM 2503 HB2 ARG D 30 21.181 11.081 19.331 1.00 39.24 H ATOM 2504 HB3 ARG D 30 20.839 11.789 20.711 1.00 39.24 H ATOM 2505 HG2 ARG D 30 19.125 12.253 19.242 1.00 42.92 H ATOM 2506 HG3 ARG D 30 19.921 13.608 19.486 1.00 42.92 H ATOM 2507 HD2 ARG D 30 21.069 13.252 17.414 1.00 47.85 H ATOM 2508 HD3 ARG D 30 20.140 11.982 17.158 1.00 47.85 H ATOM 2509 HE ARG D 30 18.358 13.463 17.039 1.00 53.66 H ATOM 2510 HH11 ARG D 30 21.319 14.877 16.503 1.00 59.82 H ATOM 2511 HH12 ARG D 30 20.789 16.073 15.791 1.00 59.82 H ATOM 2512 HH21 ARG D 30 17.586 15.298 16.000 1.00 59.66 H ATOM 2513 HH22 ARG D 30 18.534 16.327 15.487 1.00 59.66 H ATOM 2514 N ARG D 31 22.599 13.855 21.882 1.00 30.47 N ANISOU 2514 N ARG D 31 2982 5434 3161 1454 526 876 N ATOM 2515 CA ARG D 31 22.505 15.041 22.721 1.00 29.83 C ANISOU 2515 CA ARG D 31 2888 5369 3079 1450 520 887 C ATOM 2516 C ARG D 31 23.585 16.056 22.357 1.00 31.11 C ANISOU 2516 C ARG D 31 3058 5551 3213 1440 532 884 C ATOM 2517 O ARG D 31 23.316 17.263 22.292 1.00 30.72 O ANISOU 2517 O ARG D 31 3015 5506 3151 1428 520 886 O ATOM 2518 CB ARG D 31 22.602 14.633 24.172 1.00 30.06 C ANISOU 2518 CB ARG D 31 2882 5409 3131 1466 529 900 C ATOM 2519 CG ARG D 31 22.353 15.735 25.139 1.00 31.52 C ANISOU 2519 CG ARG D 31 3051 5608 3319 1464 521 913 C ATOM 2520 CD ARG D 31 22.286 15.191 26.531 1.00 34.56 C ANISOU 2520 CD ARG D 31 3402 6000 3730 1481 528 925 C ATOM 2521 NE ARG D 31 23.632 15.015 27.047 1.00 39.08 N ANISOU 2521 NE ARG D 31 3957 6594 4297 1489 555 927 N ATOM 2522 CZ ARG D 31 23.938 14.297 28.126 1.00 40.20 C ANISOU 2522 CZ ARG D 31 4071 6744 4459 1505 568 935 C ATOM 2523 NH1 ARG D 31 22.989 13.666 28.788 1.00 39.49 N ANISOU 2523 NH1 ARG D 31 3967 6642 4395 1515 557 942 N ATOM 2524 NH2 ARG D 31 25.200 14.193 28.526 1.00 40.95 N ANISOU 2524 NH2 ARG D 31 4152 6860 4548 1512 593 935 N ATOM 2525 H ARG D 31 22.816 13.134 22.297 1.00 36.56 H ATOM 2526 HA ARG D 31 21.641 15.459 22.583 1.00 35.80 H ATOM 2527 HB2 ARG D 31 21.948 13.938 24.343 1.00 36.07 H ATOM 2528 HB3 ARG D 31 23.495 14.292 24.339 1.00 36.07 H ATOM 2529 HG2 ARG D 31 23.078 16.377 25.093 1.00 37.83 H ATOM 2530 HG3 ARG D 31 21.507 16.162 24.933 1.00 37.83 H ATOM 2531 HD2 ARG D 31 21.813 15.815 27.104 1.00 41.48 H ATOM 2532 HD3 ARG D 31 21.841 14.329 26.524 1.00 41.48 H ATOM 2533 HE ARG D 31 24.275 15.401 26.626 1.00 46.89 H ATOM 2534 HH11 ARG D 31 22.170 13.729 28.531 1.00 47.39 H ATOM 2535 HH12 ARG D 31 23.186 13.199 29.482 1.00 47.39 H ATOM 2536 HH21 ARG D 31 25.823 14.599 28.094 1.00 49.14 H ATOM 2537 HH22 ARG D 31 25.393 13.723 29.220 1.00 49.14 H ATOM 2538 N ILE D 32 24.803 15.580 22.099 1.00 31.94 N ANISOU 2538 N ILE D 32 3162 5667 3307 1445 556 877 N ATOM 2539 CA ILE D 32 25.904 16.448 21.685 1.00 32.92 C ANISOU 2539 CA ILE D 32 3294 5809 3404 1436 570 873 C ATOM 2540 C ILE D 32 25.571 17.165 20.378 1.00 34.70 C ANISOU 2540 C ILE D 32 3553 6024 3606 1417 555 862 C ATOM 2541 O ILE D 32 25.852 18.359 20.231 1.00 35.51 O ANISOU 2541 O ILE D 32 3663 6139 3691 1406 553 863 O ATOM 2542 CB ILE D 32 27.203 15.634 21.563 1.00 35.05 C ANISOU 2542 CB ILE D 32 3558 6090 3668 1444 598 866 C ATOM 2543 CG1 ILE D 32 27.670 15.158 22.939 1.00 37.86 C ANISOU 2543 CG1 ILE D 32 3880 6461 4044 1461 614 878 C ATOM 2544 CG2 ILE D 32 28.317 16.470 20.891 1.00 35.15 C ANISOU 2544 CG2 ILE D 32 3586 6119 3651 1433 611 859 C ATOM 2545 CD1 ILE D 32 28.696 14.053 22.887 1.00 38.97 C ANISOU 2545 CD1 ILE D 32 4013 6607 4186 1473 639 872 C ATOM 2546 H ILE D 32 25.019 14.749 22.158 1.00 38.33 H ATOM 2547 HA ILE D 32 26.042 17.125 22.367 1.00 39.50 H ATOM 2548 HB ILE D 32 27.028 14.856 21.011 1.00 42.06 H ATOM 2549 HG12 ILE D 32 28.065 15.907 23.412 1.00 45.43 H ATOM 2550 HG13 ILE D 32 26.903 14.826 23.432 1.00 45.43 H ATOM 2551 HG21 ILE D 32 29.121 15.931 20.828 1.00 42.18 H ATOM 2552 HG22 ILE D 32 28.024 16.732 20.004 1.00 42.18 H ATOM 2553 HG23 ILE D 32 28.488 17.258 21.429 1.00 42.18 H ATOM 2554 HD11 ILE D 32 28.940 13.807 23.793 1.00 46.76 H ATOM 2555 HD12 ILE D 32 28.314 13.289 22.428 1.00 46.76 H ATOM 2556 HD13 ILE D 32 29.477 14.371 22.408 1.00 46.76 H ATOM 2557 N GLU D 33 25.002 16.445 19.400 1.00 36.99 N ANISOU 2557 N GLU D 33 3865 6292 3898 1415 546 853 N ATOM 2558 CA GLU D 33 24.632 17.057 18.125 1.00 39.54 C ANISOU 2558 CA GLU D 33 4221 6603 4200 1398 532 843 C ATOM 2559 C GLU D 33 23.611 18.166 18.324 1.00 36.68 C ANISOU 2559 C GLU D 33 3862 6236 3838 1387 507 849 C ATOM 2560 O GLU D 33 23.721 19.243 17.726 1.00 36.91 O ANISOU 2560 O GLU D 33 3909 6270 3845 1373 500 846 O ATOM 2561 CB GLU D 33 24.048 16.015 17.168 1.00 48.80 C ANISOU 2561 CB GLU D 33 5414 7751 5378 1398 524 832 C ATOM 2562 CG GLU D 33 24.988 14.937 16.695 1.00 59.89 C ANISOU 2562 CG GLU D 33 6821 9156 6779 1405 546 823 C ATOM 2563 CD GLU D 33 24.243 13.785 15.996 1.00 68.85 C ANISOU 2563 CD GLU D 33 7970 10265 7925 1409 538 815 C ATOM 2564 OE1 GLU D 33 24.859 12.712 15.793 1.00 72.34 O ANISOU 2564 OE1 GLU D 33 8410 10706 8370 1418 555 809 O ATOM 2565 OE2 GLU D 33 23.042 13.954 15.665 1.00 70.56 O ANISOU 2565 OE2 GLU D 33 8199 10462 8147 1402 514 815 O ATOM 2566 H GLU D 33 24.823 15.605 19.454 1.00 44.39 H ATOM 2567 HA GLU D 33 25.421 17.441 17.713 1.00 47.45 H ATOM 2568 HB2 GLU D 33 23.307 15.575 17.614 1.00 58.56 H ATOM 2569 HB3 GLU D 33 23.720 16.477 16.380 1.00 58.56 H ATOM 2570 HG2 GLU D 33 25.617 15.318 16.062 1.00 71.87 H ATOM 2571 HG3 GLU D 33 25.463 14.571 17.458 1.00 71.87 H ATOM 2572 N ILE D 34 22.576 17.894 19.123 1.00 31.72 N ANISOU 2572 N ILE D 34 3632 4435 3986 395 -18 366 N ATOM 2573 CA ILE D 34 21.495 18.850 19.319 1.00 30.91 C ANISOU 2573 CA ILE D 34 3556 4312 3876 393 -68 345 C ATOM 2574 C ILE D 34 22.005 20.067 20.073 1.00 28.56 C ANISOU 2574 C ILE D 34 3271 4029 3549 379 -108 379 C ATOM 2575 O ILE D 34 21.682 21.216 19.727 1.00 27.88 O ANISOU 2575 O ILE D 34 3217 3941 3434 361 -159 373 O ATOM 2576 CB ILE D 34 20.328 18.176 20.066 1.00 35.70 C ANISOU 2576 CB ILE D 34 4149 4891 4526 422 -54 319 C ATOM 2577 CG1 ILE D 34 19.670 17.140 19.166 1.00 40.24 C ANISOU 2577 CG1 ILE D 34 4716 5447 5125 432 -23 281 C ATOM 2578 CG2 ILE D 34 19.277 19.205 20.503 1.00 37.90 C ANISOU 2578 CG2 ILE D 34 4452 5149 4798 422 -106 303 C ATOM 2579 CD1 ILE D 34 18.665 16.244 19.919 1.00 43.92 C ANISOU 2579 CD1 ILE D 34 5161 5887 5638 464 3 258 C ATOM 2580 H ILE D 34 22.481 17.161 19.562 1.00 38.07 H ATOM 2581 HA ILE D 34 21.170 19.144 18.454 1.00 37.09 H ATOM 2582 HB ILE D 34 20.677 17.730 20.854 1.00 42.84 H ATOM 2583 HG12 ILE D 34 19.191 17.597 18.457 1.00 48.29 H ATOM 2584 HG13 ILE D 34 20.357 16.569 18.788 1.00 48.29 H ATOM 2585 HG21 ILE D 34 18.560 18.746 20.968 1.00 45.48 H ATOM 2586 HG22 ILE D 34 19.695 19.851 21.094 1.00 45.48 H ATOM 2587 HG23 ILE D 34 18.928 19.653 19.716 1.00 45.48 H ATOM 2588 HD11 ILE D 34 18.281 15.607 19.295 1.00 52.70 H ATOM 2589 HD12 ILE D 34 19.132 15.773 20.627 1.00 52.70 H ATOM 2590 HD13 ILE D 34 17.967 16.801 20.296 1.00 52.70 H ATOM 2591 N ALA D 35 22.793 19.833 21.124 1.00 27.96 N ANISOU 2591 N ALA D 35 3171 3969 3482 388 -86 415 N ATOM 2592 CA ALA D 35 23.369 20.936 21.874 1.00 27.78 C ANISOU 2592 CA ALA D 35 3159 3962 3432 376 -121 449 C ATOM 2593 C ALA D 35 24.125 21.886 20.943 1.00 31.46 C ANISOU 2593 C ALA D 35 3651 4449 3852 343 -152 463 C ATOM 2594 O ALA D 35 23.941 23.110 20.995 1.00 28.86 O ANISOU 2594 O ALA D 35 3349 4120 3496 327 -203 466 O ATOM 2595 CB ALA D 35 24.283 20.385 22.959 1.00 27.74 C ANISOU 2595 CB ALA D 35 3122 3975 3443 389 -84 486 C ATOM 2596 H ALA D 35 23.003 19.052 21.417 1.00 33.55 H ATOM 2597 HA ALA D 35 22.657 21.436 22.303 1.00 33.33 H ATOM 2598 HB1 ALA D 35 24.664 21.126 23.456 1.00 33.29 H ATOM 2599 HB2 ALA D 35 23.763 19.821 23.553 1.00 33.29 H ATOM 2600 HB3 ALA D 35 24.989 19.866 22.543 1.00 33.29 H ATOM 2601 N AHIS D 36 24.976 21.333 20.079 0.50 34.11 N ANISOU 2601 N AHIS D 36 3978 4802 4179 333 -122 470 N ATOM 2602 N BHIS D 36 24.966 21.329 20.070 0.50 34.09 N ANISOU 2602 N BHIS D 36 3976 4799 4177 333 -122 470 N ATOM 2603 CA AHIS D 36 25.713 22.163 19.133 0.50 36.11 C ANISOU 2603 CA AHIS D 36 4256 5075 4389 303 -149 482 C ATOM 2604 CA BHIS D 36 25.730 22.158 19.145 0.50 36.13 C ANISOU 2604 CA BHIS D 36 4258 5078 4392 303 -149 483 C ATOM 2605 C AHIS D 36 24.769 22.854 18.159 0.50 35.46 C ANISOU 2605 C AHIS D 36 4208 4976 4291 289 -191 447 C ATOM 2606 C BHIS D 36 24.823 22.826 18.111 0.50 35.49 C ANISOU 2606 C BHIS D 36 4210 4980 4293 288 -190 448 C ATOM 2607 O AHIS D 36 24.878 24.063 17.925 0.50 35.73 O ANISOU 2607 O AHIS D 36 4270 5017 4290 267 -239 455 O ATOM 2608 O BHIS D 36 25.006 24.007 17.798 0.50 35.74 O ANISOU 2608 O BHIS D 36 4270 5020 4289 265 -235 456 O ATOM 2609 CB AHIS D 36 26.735 21.316 18.376 0.50 39.13 C ANISOU 2609 CB AHIS D 36 4620 5477 4769 297 -105 494 C ATOM 2610 CB BHIS D 36 26.816 21.311 18.468 0.50 39.13 C ANISOU 2610 CB BHIS D 36 4619 5480 4770 297 -103 498 C ATOM 2611 CG AHIS D 36 27.466 22.070 17.307 0.50 41.38 C ANISOU 2611 CG AHIS D 36 4929 5783 5012 266 -129 504 C ATOM 2612 CG BHIS D 36 28.006 21.026 19.342 0.50 41.15 C ANISOU 2612 CG BHIS D 36 4848 5759 5027 301 -75 541 C ATOM 2613 ND1AHIS D 36 27.148 21.963 15.970 0.50 43.42 N ANISOU 2613 ND1AHIS D 36 5203 6034 5259 254 -133 475 N ATOM 2614 ND1BHIS D 36 28.712 22.017 19.993 0.50 42.38 N ANISOU 2614 ND1BHIS D 36 5012 5934 5157 288 -104 577 N ATOM 2615 CD2AHIS D 36 28.493 22.950 17.381 0.50 43.31 C ANISOU 2615 CD2AHIS D 36 5184 6053 5221 244 -151 540 C ATOM 2616 CD2BHIS D 36 28.624 19.860 19.657 0.50 42.95 C ANISOU 2616 CD2BHIS D 36 5042 5997 5280 317 -20 555 C ATOM 2617 CE1AHIS D 36 27.952 22.739 15.266 0.50 44.95 C ANISOU 2617 CE1AHIS D 36 5416 6250 5414 227 -155 493 C ATOM 2618 CE1BHIS D 36 29.708 21.475 20.673 0.50 43.00 C ANISOU 2618 CE1BHIS D 36 5062 6032 5243 296 -68 611 C ATOM 2619 NE2AHIS D 36 28.777 23.350 16.098 0.50 44.94 N ANISOU 2619 NE2AHIS D 36 5411 6267 5396 220 -167 532 N ATOM 2620 NE2BHIS D 36 29.674 20.167 20.491 0.50 43.22 N ANISOU 2620 NE2BHIS D 36 5064 6054 5302 313 -16 598 N ATOM 2621 H AHIS D 36 25.142 20.491 20.023 0.50 40.93 H ATOM 2622 H BHIS D 36 25.109 20.485 19.996 0.50 40.90 H ATOM 2623 HA AHIS D 36 26.194 22.849 19.622 0.50 43.33 H ATOM 2624 HA BHIS D 36 26.173 22.860 19.647 0.50 43.36 H ATOM 2625 HB2AHIS D 36 27.393 20.981 19.006 0.50 46.95 H ATOM 2626 HB2BHIS D 36 26.430 20.460 18.208 0.50 46.96 H ATOM 2627 HB3AHIS D 36 26.276 20.573 17.954 0.50 46.95 H ATOM 2628 HB3BHIS D 36 27.133 21.782 17.682 0.50 46.96 H ATOM 2629 HD2AHIS D 36 28.927 23.228 18.155 0.50 51.98 H ATOM 2630 HD2BHIS D 36 28.379 19.011 19.369 0.50 51.54 H ATOM 2631 HE1AHIS D 36 27.938 22.841 14.341 0.50 53.94 H ATOM 2632 HE1BHIS D 36 30.323 21.936 21.197 0.50 51.60 H ATOM 2633 HE2AHIS D 36 29.392 23.907 15.873 0.50 53.93 H ATOM 2634 HE2BHIS D 36 30.222 19.600 20.833 0.50 51.86 H ATOM 2635 N ALA D 37 23.824 22.106 17.583 1.00 34.04 N ANISOU 2635 N ALA D 37 4026 4773 4135 302 -175 407 N ATOM 2636 CA ALA D 37 22.958 22.692 16.561 1.00 32.45 C ANISOU 2636 CA ALA D 37 3857 4556 3918 289 -212 372 C ATOM 2637 C ALA D 37 22.151 23.860 17.115 1.00 33.15 C ANISOU 2637 C ALA D 37 3970 4630 3995 285 -267 366 C ATOM 2638 O ALA D 37 21.834 24.805 16.378 1.00 34.59 O ANISOU 2638 O ALA D 37 4185 4810 4149 265 -311 353 O ATOM 2639 CB ALA D 37 22.007 21.642 15.978 1.00 32.38 C ANISOU 2639 CB ALA D 37 3839 4522 3941 306 -184 330 C ATOM 2640 H AALA D 37 23.668 21.279 17.761 0.50 40.85 H ATOM 2641 H BALA D 37 23.633 21.295 17.796 0.50 40.85 H ATOM 2642 HA ALA D 37 23.510 23.028 15.838 1.00 38.94 H ATOM 2643 HB1 ALA D 37 21.448 22.062 15.305 1.00 38.85 H ATOM 2644 HB2 ALA D 37 22.531 20.931 15.577 1.00 38.85 H ATOM 2645 HB3 ALA D 37 21.455 21.286 16.691 1.00 38.85 H ATOM 2646 N LEU D 38 21.800 23.817 18.399 1.00 30.92 N ANISOU 2646 N LEU D 38 3674 4339 3735 305 -266 374 N ATOM 2647 CA LEU D 38 20.928 24.831 18.976 1.00 29.04 C ANISOU 2647 CA LEU D 38 3458 4085 3492 305 -316 365 C ATOM 2648 C LEU D 38 21.657 25.800 19.886 1.00 29.19 C ANISOU 2648 C LEU D 38 3481 4122 3487 295 -343 405 C ATOM 2649 O LEU D 38 21.004 26.661 20.486 1.00 29.53 O ANISOU 2649 O LEU D 38 3540 4153 3525 295 -383 401 O ATOM 2650 CB LEU D 38 19.785 24.161 19.751 1.00 29.60 C ANISOU 2650 CB LEU D 38 3514 4128 3605 334 -301 340 C ATOM 2651 CG LEU D 38 18.871 23.230 18.962 1.00 30.09 C ANISOU 2651 CG LEU D 38 3572 4167 3693 347 -277 297 C ATOM 2652 CD1 LEU D 38 17.822 22.600 19.933 1.00 30.23 C ANISOU 2652 CD1 LEU D 38 3573 4160 3754 378 -262 277 C ATOM 2653 CD2 LEU D 38 18.212 23.942 17.778 1.00 29.94 C ANISOU 2653 CD2 LEU D 38 3589 4137 3650 328 -317 266 C ATOM 2654 H LEU D 38 22.053 23.211 18.954 1.00 37.10 H ATOM 2655 HA LEU D 38 20.533 25.346 18.255 1.00 34.85 H ATOM 2656 HB2 LEU D 38 20.173 23.639 20.470 1.00 35.52 H ATOM 2657 HB3 LEU D 38 19.226 24.859 20.127 1.00 35.52 H ATOM 2658 HG LEU D 38 19.407 22.506 18.604 1.00 36.11 H ATOM 2659 HD11 LEU D 38 17.242 22.008 19.429 1.00 36.28 H ATOM 2660 HD12 LEU D 38 18.289 22.099 20.620 1.00 36.28 H ATOM 2661 HD13 LEU D 38 17.300 23.310 20.338 1.00 36.28 H ATOM 2662 HD21 LEU D 38 17.643 23.312 17.309 1.00 35.93 H ATOM 2663 HD22 LEU D 38 17.683 24.683 18.111 1.00 35.93 H ATOM 2664 HD23 LEU D 38 18.904 24.270 17.182 1.00 35.93 H ATOM 2665 N SER D 39 22.978 25.683 20.012 1.00 34.79 N ANISOU 2665 N SER D 39 4764 5206 3250 -966 553 -325 N ATOM 2666 CA SER D 39 23.778 26.542 20.906 1.00 35.95 C ANISOU 2666 CA SER D 39 4882 5422 3355 -1023 557 -314 C ATOM 2667 C SER D 39 23.261 26.501 22.343 1.00 36.08 C ANISOU 2667 C SER D 39 4826 5511 3373 -1014 504 -269 C ATOM 2668 O SER D 39 23.160 27.521 23.024 1.00 37.03 O ANISOU 2668 O SER D 39 4976 5668 3427 -1045 484 -275 O ATOM 2669 CB SER D 39 23.822 27.982 20.383 1.00 36.84 C ANISOU 2669 CB SER D 39 5121 5505 3372 -1063 572 -370 C ATOM 2670 OG SER D 39 24.470 28.011 19.125 1.00 38.20 O ANISOU 2670 OG SER D 39 5350 5619 3547 -1077 626 -409 O ATOM 2671 H SER D 39 23.448 25.103 19.585 1.00 41.75 H ATOM 2672 HA SER D 39 24.689 26.208 20.916 1.00 43.14 H ATOM 2673 HB2 SER D 39 22.916 28.314 20.284 1.00 44.21 H ATOM 2674 HB3 SER D 39 24.316 28.534 21.009 1.00 44.21 H ATOM 2675 HG SER D 39 24.497 28.799 18.834 1.00 45.84 H ATOM 2676 N LEU D 40 22.933 25.301 22.810 1.00 35.57 N ANISOU 2676 N LEU D 40 4666 5466 3384 -971 480 -223 N ATOM 2677 CA LEU D 40 22.569 25.032 24.192 1.00 34.55 C ANISOU 2677 CA LEU D 40 4447 5409 3273 -961 433 -172 C ATOM 2678 C LEU D 40 23.598 24.057 24.761 1.00 34.83 C ANISOU 2678 C LEU D 40 4346 5500 3389 -970 451 -121 C ATOM 2679 O LEU D 40 24.270 23.349 24.000 1.00 35.05 O ANISOU 2679 O LEU D 40 4349 5497 3471 -966 492 -123 O ATOM 2680 CB LEU D 40 21.154 24.438 24.274 1.00 34.15 C ANISOU 2680 CB LEU D 40 4403 5331 3240 -898 385 -162 C ATOM 2681 CG LEU D 40 19.971 25.318 23.853 1.00 33.82 C ANISOU 2681 CG LEU D 40 4488 5240 3123 -882 357 -207 C ATOM 2682 CD1 LEU D 40 18.698 24.514 23.774 1.00 33.46 C ANISOU 2682 CD1 LEU D 40 4441 5161 3112 -816 317 -196 C ATOM 2683 CD2 LEU D 40 19.781 26.461 24.859 1.00 34.29 C ANISOU 2683 CD2 LEU D 40 4568 5353 3108 -916 327 -207 C ATOM 2684 H LEU D 40 22.914 24.595 22.318 1.00 42.69 H ATOM 2685 HA LEU D 40 22.596 25.854 24.706 1.00 41.46 H ATOM 2686 HB2 LEU D 40 21.131 23.648 23.713 1.00 40.98 H ATOM 2687 HB3 LEU D 40 20.996 24.176 25.195 1.00 40.98 H ATOM 2688 HG LEU D 40 20.147 25.702 22.980 1.00 40.58 H ATOM 2689 HD11 LEU D 40 17.971 25.098 23.506 1.00 40.15 H ATOM 2690 HD12 LEU D 40 18.812 23.806 23.120 1.00 40.15 H ATOM 2691 HD13 LEU D 40 18.511 24.132 24.646 1.00 40.15 H ATOM 2692 HD21 LEU D 40 19.030 27.007 24.578 1.00 41.15 H ATOM 2693 HD22 LEU D 40 19.607 26.084 25.736 1.00 41.15 H ATOM 2694 HD23 LEU D 40 20.589 26.997 24.883 1.00 41.15 H ATOM 2695 N THR D 41 23.738 24.015 26.100 1.00 34.84 N ANISOU 2695 N THR D 41 4257 5581 3399 -983 422 -74 N ATOM 2696 CA THR D 41 24.650 23.033 26.681 1.00 35.09 C ANISOU 2696 CA THR D 41 4155 5666 3511 -988 436 -23 C ATOM 2697 C THR D 41 23.994 21.651 26.704 1.00 34.90 C ANISOU 2697 C THR D 41 4063 5629 3569 -927 413 12 C ATOM 2698 O THR D 41 22.766 21.522 26.681 1.00 34.55 O ANISOU 2698 O THR D 41 4056 5556 3515 -883 373 7 O ATOM 2699 CB THR D 41 25.070 23.380 28.116 1.00 35.17 C ANISOU 2699 CB THR D 41 4085 5769 3510 -1023 413 18 C ATOM 2700 OG1 THR D 41 23.950 23.238 28.985 1.00 34.83 O ANISOU 2700 OG1 THR D 41 4020 5752 3462 -988 354 44 O ATOM 2701 CG2 THR D 41 25.653 24.810 28.245 1.00 35.33 C ANISOU 2701 CG2 THR D 41 4170 5810 3444 -1084 430 -13 C ATOM 2702 H THR D 41 23.333 24.523 26.664 1.00 41.81 H ATOM 2703 HA THR D 41 25.450 22.980 26.135 1.00 42.11 H ATOM 2704 HB THR D 41 25.759 22.756 28.395 1.00 42.21 H ATOM 2705 HG1 THR D 41 24.173 23.426 29.773 1.00 41.79 H ATOM 2706 HG21 THR D 41 25.904 24.983 29.166 1.00 42.40 H ATOM 2707 HG22 THR D 41 26.438 24.900 27.682 1.00 42.40 H ATOM 2708 HG23 THR D 41 24.991 25.463 27.970 1.00 42.40 H ATOM 2709 N GLU D 42 24.831 20.612 26.790 1.00 35.15 N ANISOU 2709 N GLU D 42 3990 5682 3682 -925 436 48 N ATOM 2710 CA GLU D 42 24.297 19.260 26.954 1.00 36.37 C ANISOU 2710 CA GLU D 42 4065 5834 3918 -869 414 88 C ATOM 2711 C GLU D 42 23.365 19.186 28.163 1.00 37.26 C ANISOU 2711 C GLU D 42 4133 5997 4026 -845 352 124 C ATOM 2712 O GLU D 42 22.309 18.547 28.104 1.00 35.55 O ANISOU 2712 O GLU D 42 3916 5754 3836 -792 319 133 O ATOM 2713 CB GLU D 42 25.426 18.227 27.091 1.00 38.70 C ANISOU 2713 CB GLU D 42 4243 6162 4300 -877 446 128 C ATOM 2714 CG GLU D 42 25.956 17.696 25.764 1.00 41.92 C ANISOU 2714 CG GLU D 42 4677 6503 4747 -869 497 101 C ATOM 2715 CD GLU D 42 26.845 16.447 25.916 1.00 46.64 C ANISOU 2715 CD GLU D 42 5150 7128 5442 -863 520 146 C ATOM 2716 OE1 GLU D 42 28.085 16.575 25.775 1.00 49.08 O ANISOU 2716 OE1 GLU D 42 5431 7456 5762 -906 564 145 O ATOM 2717 OE2 GLU D 42 26.310 15.335 26.169 1.00 48.03 O ANISOU 2717 OE2 GLU D 42 5257 7306 5685 -814 495 181 O ATOM 2718 H GLU D 42 25.689 20.662 26.756 1.00 42.18 H ATOM 2719 HA GLU D 42 23.780 19.031 26.166 1.00 43.64 H ATOM 2720 HB2 GLU D 42 26.168 18.638 27.561 1.00 46.44 H ATOM 2721 HB3 GLU D 42 25.094 17.471 27.600 1.00 46.44 H ATOM 2722 HG2 GLU D 42 25.204 17.459 25.198 1.00 50.30 H ATOM 2723 HG3 GLU D 42 26.484 18.388 25.337 1.00 50.30 H ATOM 2724 N ARG D 43 23.735 19.846 29.263 1.00 29.38 N ANISOU 2724 N ARG D 43 3095 4621 3446 798 -91 -85 N ATOM 2725 CA ARG D 43 22.917 19.781 30.471 1.00 32.24 C ANISOU 2725 CA ARG D 43 3461 4947 3840 826 -72 -90 C ATOM 2726 C ARG D 43 21.528 20.345 30.217 1.00 29.55 C ANISOU 2726 C ARG D 43 3104 4577 3549 803 -87 -62 C ATOM 2727 O ARG D 43 20.524 19.737 30.606 1.00 28.76 O ANISOU 2727 O ARG D 43 3011 4449 3466 812 -74 -61 O ATOM 2728 CB ARG D 43 23.606 20.526 31.622 1.00 37.35 C ANISOU 2728 CB ARG D 43 4104 5592 4494 855 -63 -104 C ATOM 2729 CG ARG D 43 22.738 20.658 32.851 1.00 45.63 C ANISOU 2729 CG ARG D 43 5153 6603 5581 881 -46 -107 C ATOM 2730 CD ARG D 43 23.534 20.984 34.123 1.00 55.23 C ANISOU 2730 CD ARG D 43 6373 7819 6793 918 -29 -129 C ATOM 2731 NE ARG D 43 22.649 21.299 35.247 1.00 63.64 N ANISOU 2731 NE ARG D 43 7435 8846 7899 939 -17 -128 N ATOM 2732 CZ ARG D 43 21.975 20.396 35.965 1.00 70.32 C ANISOU 2732 CZ ARG D 43 8298 9669 8750 962 6 -139 C ATOM 2733 NH1 ARG D 43 22.067 19.097 35.685 1.00 71.74 N ANISOU 2733 NH1 ARG D 43 8500 9859 8897 968 20 -151 N ATOM 2734 NH2 ARG D 43 21.183 20.794 36.958 1.00 72.57 N ANISOU 2734 NH2 ARG D 43 8579 9920 9075 980 16 -136 N ATOM 2735 H ARG D 43 24.442 20.330 29.333 1.00 35.25 H ATOM 2736 HA ARG D 43 22.818 18.852 30.733 1.00 38.68 H ATOM 2737 HB2 ARG D 43 24.409 20.043 31.874 1.00 44.82 H ATOM 2738 HB3 ARG D 43 23.838 21.420 31.324 1.00 44.82 H ATOM 2739 HG2 ARG D 43 22.097 21.373 32.709 1.00 54.75 H ATOM 2740 HG3 ARG D 43 22.271 19.820 32.998 1.00 54.75 H ATOM 2741 HD2 ARG D 43 24.074 20.216 34.368 1.00 66.28 H ATOM 2742 HD3 ARG D 43 24.101 21.754 33.957 1.00 66.28 H ATOM 2743 HE ARG D 43 22.555 22.127 35.460 1.00 76.37 H ATOM 2744 HH11 ARG D 43 22.572 18.831 35.041 1.00 86.08 H ATOM 2745 HH12 ARG D 43 21.628 18.524 36.152 1.00 86.08 H ATOM 2746 HH21 ARG D 43 21.116 21.631 37.146 1.00 87.09 H ATOM 2747 HH22 ARG D 43 20.750 20.213 37.422 1.00 87.09 H ATOM 2748 N GLN D 44 21.454 21.486 29.525 1.00 27.57 N ANISOU 2748 N GLN D 44 2828 4330 3318 774 -114 -39 N ATOM 2749 CA GLN D 44 20.167 22.094 29.209 1.00 27.19 C ANISOU 2749 CA GLN D 44 2761 4254 3315 750 -131 -11 C ATOM 2750 C GLN D 44 19.321 21.168 28.346 1.00 24.19 C ANISOU 2750 C GLN D 44 2389 3871 2931 729 -134 1 C ATOM 2751 O GLN D 44 18.098 21.110 28.512 1.00 23.89 O ANISOU 2751 O GLN D 44 2347 3803 2927 725 -133 14 O ATOM 2752 CB GLN D 44 20.375 23.430 28.494 1.00 28.77 C ANISOU 2752 CB GLN D 44 2935 4464 3531 720 -160 12 C ATOM 2753 CG GLN D 44 21.001 24.515 29.372 1.00 32.78 C ANISOU 2753 CG GLN D 44 3431 4970 4053 739 -159 5 C ATOM 2754 CD GLN D 44 21.196 25.844 28.599 1.00 36.00 C ANISOU 2754 CD GLN D 44 3813 5388 4477 707 -189 27 C ATOM 2755 OE1 GLN D 44 21.953 25.908 27.628 1.00 37.08 O ANISOU 2755 OE1 GLN D 44 3947 5555 4585 685 -204 30 O ATOM 2756 NE2 GLN D 44 20.492 26.892 29.028 1.00 35.46 N ANISOU 2756 NE2 GLN D 44 3725 5292 4455 705 -197 44 N ATOM 2757 H GLN D 44 22.133 21.923 29.230 1.00 33.09 H ATOM 2758 HA GLN D 44 19.684 22.264 30.033 1.00 32.62 H ATOM 2759 HB2 GLN D 44 20.962 23.289 27.735 1.00 34.52 H ATOM 2760 HB3 GLN D 44 19.515 23.757 28.188 1.00 34.52 H ATOM 2761 HG2 GLN D 44 20.419 24.687 30.129 1.00 39.33 H ATOM 2762 HG3 GLN D 44 21.870 24.214 29.681 1.00 39.33 H ATOM 2763 HE21 GLN D 44 19.963 26.809 29.701 1.00 42.55 H ATOM 2764 HE22 GLN D 44 20.566 27.651 28.631 1.00 42.55 H ATOM 2765 N ILE D 45 19.955 20.450 27.406 1.00 23.88 N ANISOU 2765 N ILE D 45 2361 3862 2849 714 -138 -5 N ATOM 2766 CA ILE D 45 19.223 19.480 26.589 1.00 22.64 C ANISOU 2766 CA ILE D 45 2214 3703 2683 694 -139 4 C ATOM 2767 C ILE D 45 18.728 18.349 27.467 1.00 24.19 C ANISOU 2767 C ILE D 45 2433 3880 2878 725 -109 -14 C ATOM 2768 O ILE D 45 17.565 17.940 27.392 1.00 25.88 O ANISOU 2768 O ILE D 45 2648 4071 3115 717 -107 -3 O ATOM 2769 CB ILE D 45 20.097 18.939 25.434 1.00 24.21 C ANISOU 2769 CB ILE D 45 2422 3940 2836 674 -148 0 C ATOM 2770 CG1 ILE D 45 20.630 20.045 24.530 1.00 28.96 C ANISOU 2770 CG1 ILE D 45 3002 4564 3438 643 -177 17 C ATOM 2771 CG2 ILE D 45 19.286 17.926 24.563 1.00 23.65 C ANISOU 2771 CG2 ILE D 45 2362 3868 2757 652 -149 9 C ATOM 2772 CD1 ILE D 45 19.550 20.867 23.831 1.00 31.65 C ANISOU 2772 CD1 ILE D 45 3319 4888 3819 609 -203 51 C ATOM 2773 H ILE D 45 20.794 20.506 27.227 1.00 28.65 H ATOM 2774 HA ILE D 45 18.449 19.917 26.199 1.00 27.16 H ATOM 2775 HB ILE D 45 20.854 18.471 25.819 1.00 29.05 H ATOM 2776 HG12 ILE D 45 21.162 20.653 25.066 1.00 34.75 H ATOM 2777 HG13 ILE D 45 21.184 19.643 23.843 1.00 34.75 H ATOM 2778 HG21 ILE D 45 19.854 17.601 23.846 1.00 28.38 H ATOM 2779 HG22 ILE D 45 19.002 17.186 25.122 1.00 28.38 H ATOM 2780 HG23 ILE D 45 18.512 18.378 24.192 1.00 28.38 H ATOM 2781 HD11 ILE D 45 19.975 21.543 23.281 1.00 37.98 H ATOM 2782 HD12 ILE D 45 19.014 20.279 23.278 1.00 37.98 H ATOM 2783 HD13 ILE D 45 18.992 21.290 24.503 1.00 37.98 H ATOM 2784 N LYS D 46 19.604 17.820 28.319 1.00 27.41 N ANISOU 2784 N LYS D 46 2859 4297 3258 760 -86 -43 N ATOM 2785 CA ALYS D 46 19.185 16.775 29.244 0.53 29.85 C ANISOU 2785 CA ALYS D 46 3190 4586 3565 791 -56 -61 C ATOM 2786 CA BLYS D 46 19.183 16.775 29.246 0.47 29.83 C ANISOU 2786 CA BLYS D 46 3187 4583 3562 791 -56 -61 C ATOM 2787 C LYS D 46 17.975 17.238 30.037 1.00 27.09 C ANISOU 2787 C LYS D 46 2830 4197 3267 800 -52 -50 C ATOM 2788 O LYS D 46 16.964 16.540 30.123 1.00 25.40 O ANISOU 2788 O LYS D 46 2624 3961 3067 800 -43 -46 O ATOM 2789 CB ALYS D 46 20.341 16.388 30.187 0.53 30.84 C ANISOU 2789 CB ALYS D 46 3333 4726 3659 830 -32 -92 C ATOM 2790 CB BLYS D 46 20.317 16.389 30.209 0.47 30.83 C ANISOU 2790 CB BLYS D 46 3332 4724 3659 830 -32 -92 C ATOM 2791 CG ALYS D 46 19.957 15.350 31.252 0.53 31.57 C ANISOU 2791 CG ALYS D 46 3449 4797 3750 866 0 -113 C ATOM 2792 CG BLYS D 46 19.916 15.270 31.188 0.47 31.59 C ANISOU 2792 CG BLYS D 46 3453 4800 3751 864 0 -112 C ATOM 2793 CD ALYS D 46 21.161 14.858 32.077 0.53 32.86 C ANISOU 2793 CD ALYS D 46 3631 4978 3876 903 23 -144 C ATOM 2794 CD BLYS D 46 20.526 15.414 32.576 0.47 32.91 C ANISOU 2794 CD BLYS D 46 3626 4960 3916 906 21 -135 C ATOM 2795 CE ALYS D 46 21.526 15.855 33.180 0.53 33.89 C ANISOU 2795 CE ALYS D 46 3750 5098 4027 927 26 -150 C ATOM 2796 CE BLYS D 46 20.004 14.321 33.502 0.47 33.88 C ANISOU 2796 CE BLYS D 46 3773 5062 4039 938 52 -153 C ATOM 2797 NZ ALYS D 46 22.595 15.355 34.093 0.53 35.90 N ANISOU 2797 NZ ALYS D 46 4024 5367 4250 965 50 -180 N ATOM 2798 NZ BLYS D 46 20.578 14.325 34.890 0.47 34.73 N ANISOU 2798 NZ BLYS D 46 3891 5163 4143 981 75 -176 N ATOM 2799 H ALYS D 46 20.432 18.044 28.380 0.53 32.89 H ATOM 2800 H BLYS D 46 20.432 18.043 28.380 0.47 32.89 H ATOM 2801 HA ALYS D 46 18.931 15.986 28.739 0.53 35.82 H ATOM 2802 HA BLYS D 46 18.931 15.985 28.743 0.47 35.79 H ATOM 2803 HB2ALYS D 46 21.064 16.016 29.658 0.53 37.01 H ATOM 2804 HB2BLYS D 46 21.077 16.078 29.694 0.47 37.00 H ATOM 2805 HB3ALYS D 46 20.648 17.185 30.647 0.53 37.01 H ATOM 2806 HB3BLYS D 46 20.566 17.168 30.731 0.47 37.00 H ATOM 2807 HG2ALYS D 46 19.318 15.748 31.863 0.53 37.89 H ATOM 2808 HG2BLYS D 46 18.951 15.272 31.286 0.47 37.91 H ATOM 2809 HG3ALYS D 46 19.561 14.581 30.813 0.53 37.89 H ATOM 2810 HG3BLYS D 46 20.206 14.419 30.824 0.47 37.91 H ATOM 2811 HD2ALYS D 46 20.939 14.011 32.493 0.53 39.43 H ATOM 2812 HD2BLYS D 46 21.490 15.333 32.515 0.47 39.49 H ATOM 2813 HD3ALYS D 46 21.929 14.756 31.493 0.53 39.43 H ATOM 2814 HD3BLYS D 46 20.281 16.276 32.948 0.47 39.49 H ATOM 2815 HE2ALYS D 46 21.842 16.675 32.771 0.53 40.66 H ATOM 2816 HE2BLYS D 46 19.043 14.419 33.583 0.47 40.66 H ATOM 2817 HE3ALYS D 46 20.737 16.035 33.715 0.53 40.66 H ATOM 2818 HE3BLYS D 46 20.209 13.459 33.105 0.47 40.66 H ATOM 2819 HZ1ALYS D 46 22.773 15.965 34.716 0.53 43.08 H ATOM 2820 HZ1BLYS D 46 20.226 13.661 35.366 0.47 41.68 H ATOM 2821 HZ2ALYS D 46 22.328 14.605 34.491 0.53 43.08 H ATOM 2822 HZ2BLYS D 46 21.461 14.220 34.854 0.47 41.68 H ATOM 2823 HZ3ALYS D 46 23.337 15.189 33.630 0.53 43.08 H ATOM 2824 HZ3BLYS D 46 20.394 15.098 35.292 0.47 41.68 H ATOM 2825 N ILE D 47 18.060 18.440 30.600 1.00 25.21 N ANISOU 2825 N ILE D 47 2573 3948 3058 805 -60 -43 N ATOM 2826 CA ILE D 47 16.978 18.933 31.424 1.00 24.30 C ANISOU 2826 CA ILE D 47 2447 3794 2991 816 -56 -33 C ATOM 2827 C ILE D 47 15.729 19.181 30.585 1.00 23.08 C ANISOU 2827 C ILE D 47 2277 3623 2868 781 -76 -3 C ATOM 2828 O ILE D 47 14.613 18.852 31.008 1.00 22.94 O ANISOU 2828 O ILE D 47 2261 3575 2879 787 -66 2 O ATOM 2829 CB ILE D 47 17.448 20.189 32.182 1.00 26.68 C ANISOU 2829 CB ILE D 47 2732 4091 3312 829 -60 -34 C ATOM 2830 CG1 ILE D 47 18.539 19.811 33.168 1.00 29.30 C ANISOU 2830 CG1 ILE D 47 3082 4435 3615 867 -37 -65 C ATOM 2831 CG2 ILE D 47 16.298 20.819 32.909 1.00 26.89 C ANISOU 2831 CG2 ILE D 47 2746 4078 3392 835 -59 -20 C ATOM 2832 CD1 ILE D 47 19.319 21.017 33.682 1.00 32.76 C ANISOU 2832 CD1 ILE D 47 3506 4880 4062 876 -44 -68 C ATOM 2833 H ILE D 47 18.726 18.978 30.519 1.00 30.25 H ATOM 2834 HA ILE D 47 16.758 18.257 32.083 1.00 29.16 H ATOM 2835 HB ILE D 47 17.806 20.827 31.545 1.00 32.01 H ATOM 2836 HG12 ILE D 47 18.136 19.368 33.931 1.00 35.16 H ATOM 2837 HG13 ILE D 47 19.166 19.214 32.731 1.00 35.16 H ATOM 2838 HG21 ILE D 47 16.615 21.606 33.380 1.00 32.27 H ATOM 2839 HG22 ILE D 47 15.617 21.069 32.266 1.00 32.27 H ATOM 2840 HG23 ILE D 47 15.936 20.179 33.542 1.00 32.27 H ATOM 2841 HD11 ILE D 47 19.998 20.712 34.304 1.00 39.31 H ATOM 2842 HD12 ILE D 47 19.737 21.466 32.931 1.00 39.31 H ATOM 2843 HD13 ILE D 47 18.707 21.621 34.130 1.00 39.31 H ATOM 2844 N TRP D 48 15.868 19.784 29.398 1.00 22.32 N ANISOU 2844 N TRP D 48 2164 3545 2770 744 -104 17 N ATOM 2845 CA TRP D 48 14.667 20.021 28.591 1.00 20.61 C ANISOU 2845 CA TRP D 48 1932 3314 2585 711 -124 46 C ATOM 2846 C TRP D 48 13.913 18.714 28.345 1.00 22.31 C ANISOU 2846 C TRP D 48 2166 3521 2791 709 -111 43 C ATOM 2847 O TRP D 48 12.685 18.658 28.457 1.00 21.61 O ANISOU 2847 O TRP D 48 2071 3404 2736 704 -111 58 O ATOM 2848 CB TRP D 48 15.024 20.666 27.259 1.00 20.19 C ANISOU 2848 CB TRP D 48 1862 3286 2522 672 -154 66 C ATOM 2849 CG TRP D 48 13.854 21.120 26.500 1.00 21.32 C ANISOU 2849 CG TRP D 48 1986 3414 2701 639 -176 98 C ATOM 2850 CD1 TRP D 48 13.343 22.393 26.490 1.00 23.67 C ANISOU 2850 CD1 TRP D 48 2257 3696 3040 625 -195 121 C ATOM 2851 CD2 TRP D 48 13.001 20.347 25.644 1.00 23.22 C ANISOU 2851 CD2 TRP D 48 2231 3652 2940 615 -182 110 C ATOM 2852 NE1 TRP D 48 12.238 22.452 25.707 1.00 25.00 N ANISOU 2852 NE1 TRP D 48 2413 3852 3233 595 -212 147 N ATOM 2853 CE2 TRP D 48 12.009 21.218 25.157 1.00 24.61 C ANISOU 2853 CE2 TRP D 48 2381 3811 3157 587 -205 141 C ATOM 2854 CE3 TRP D 48 12.986 19.006 25.227 1.00 24.93 C ANISOU 2854 CE3 TRP D 48 2470 3880 3123 613 -170 99 C ATOM 2855 CZ2 TRP D 48 11.009 20.799 24.277 1.00 24.88 C ANISOU 2855 CZ2 TRP D 48 2413 3840 3202 559 -217 161 C ATOM 2856 CZ3 TRP D 48 11.978 18.588 24.382 1.00 24.27 C ANISOU 2856 CZ3 TRP D 48 2383 3789 3050 585 -182 118 C ATOM 2857 CH2 TRP D 48 11.018 19.487 23.897 1.00 25.49 C ANISOU 2857 CH2 TRP D 48 2513 3928 3246 558 -205 149 C ATOM 2858 H TRP D 48 16.609 20.052 29.052 1.00 26.78 H ATOM 2859 HA TRP D 48 14.077 20.624 29.070 1.00 24.73 H ATOM 2860 HB2 TRP D 48 15.589 21.437 27.425 1.00 24.23 H ATOM 2861 HB3 TRP D 48 15.500 20.019 26.714 1.00 24.23 H ATOM 2862 HD1 TRP D 48 13.692 23.109 26.971 1.00 28.41 H ATOM 2863 HE1 TRP D 48 11.774 23.160 25.553 1.00 30.00 H ATOM 2864 HE3 TRP D 48 13.625 18.405 25.537 1.00 29.92 H ATOM 2865 HZ2 TRP D 48 10.357 21.387 23.969 1.00 29.86 H ATOM 2866 HZ3 TRP D 48 11.963 17.705 24.091 1.00 29.13 H ATOM 2867 HH2 TRP D 48 10.356 19.177 23.321 1.00 30.59 H ATOM 2868 N PHE D 49 14.637 17.648 28.007 1.00 21.87 N ANISOU 2868 N PHE D 49 2132 3490 2688 714 -100 24 N ATOM 2869 CA PHE D 49 13.976 16.378 27.733 1.00 23.94 C ANISOU 2869 CA PHE D 49 2413 3745 2938 711 -87 21 C ATOM 2870 C PHE D 49 13.375 15.774 29.000 1.00 25.61 C ANISOU 2870 C PHE D 49 2638 3926 3165 747 -58 5 C ATOM 2871 O PHE D 49 12.323 15.124 28.921 1.00 25.87 O ANISOU 2871 O PHE D 49 2677 3939 3213 741 -52 12 O ATOM 2872 CB PHE D 49 14.959 15.396 27.041 1.00 24.45 C ANISOU 2872 CB PHE D 49 2498 3845 2947 708 -82 4 C ATOM 2873 CG PHE D 49 14.979 15.546 25.532 1.00 24.82 C ANISOU 2873 CG PHE D 49 2535 3915 2982 664 -109 24 C ATOM 2874 CD1 PHE D 49 15.714 16.538 24.942 1.00 26.24 C ANISOU 2874 CD1 PHE D 49 2697 4116 3156 645 -132 34 C ATOM 2875 CD2 PHE D 49 14.221 14.731 24.718 1.00 25.74 C ANISOU 2875 CD2 PHE D 49 2658 4028 3092 641 -113 34 C ATOM 2876 CE1 PHE D 49 15.694 16.727 23.572 1.00 26.76 C ANISOU 2876 CE1 PHE D 49 2753 4201 3213 605 -158 54 C ATOM 2877 CE2 PHE D 49 14.229 14.900 23.354 1.00 26.16 C ANISOU 2877 CE2 PHE D 49 2702 4103 3135 601 -138 53 C ATOM 2878 CZ PHE D 49 14.965 15.907 22.785 1.00 25.86 C ANISOU 2878 CZ PHE D 49 2646 4085 3093 584 -161 63 C ATOM 2879 H PHE D 49 15.494 17.634 27.931 1.00 26.24 H ATOM 2880 HA PHE D 49 13.246 16.540 27.115 1.00 28.73 H ATOM 2881 HB2 PHE D 49 15.856 15.564 27.370 1.00 29.34 H ATOM 2882 HB3 PHE D 49 14.695 14.486 27.248 1.00 29.34 H ATOM 2883 HD1 PHE D 49 16.212 17.115 25.474 1.00 31.49 H ATOM 2884 HD2 PHE D 49 13.712 14.050 25.094 1.00 30.88 H ATOM 2885 HE1 PHE D 49 16.210 17.400 23.188 1.00 32.11 H ATOM 2886 HE2 PHE D 49 13.718 14.340 22.815 1.00 31.39 H ATOM 2887 HZ PHE D 49 14.970 16.019 21.862 1.00 31.03 H ATOM 2888 N GLN D 50 14.021 15.959 30.166 1.00 26.74 N ANISOU 2888 N GLN D 50 2788 4065 3306 783 -40 -15 N ATOM 2889 CA AGLN D 50 13.458 15.531 31.451 0.54 28.94 C ANISOU 2889 CA AGLN D 50 3079 4313 3604 818 -13 -29 C ATOM 2890 CA BGLN D 50 13.414 15.458 31.389 0.46 28.93 C ANISOU 2890 CA BGLN D 50 3078 4312 3601 817 -13 -29 C ATOM 2891 C GLN D 50 12.109 16.187 31.705 1.00 28.29 C ANISOU 2891 C GLN D 50 2977 4195 3575 809 -21 -6 C ATOM 2892 O GLN D 50 11.109 15.534 32.032 1.00 27.50 O ANISOU 2892 O GLN D 50 2886 4071 3493 816 -7 -5 O ATOM 2893 CB AGLN D 50 14.400 15.919 32.605 0.54 30.45 C ANISOU 2893 CB AGLN D 50 3274 4507 3787 854 3 -51 C ATOM 2894 CB BGLN D 50 14.383 15.548 32.567 0.46 30.36 C ANISOU 2894 CB BGLN D 50 3270 4497 3768 856 8 -55 C ATOM 2895 CG AGLN D 50 15.348 14.864 33.139 0.54 32.57 C ANISOU 2895 CG AGLN D 50 3571 4792 4012 886 29 -82 C ATOM 2896 CG BGLN D 50 13.806 14.953 33.845 0.46 30.35 C ANISOU 2896 CG BGLN D 50 3284 4466 3783 892 37 -70 C ATOM 2897 CD AGLN D 50 16.187 15.374 34.344 0.54 37.52 C ANISOU 2897 CD AGLN D 50 4200 5419 4637 921 43 -102 C ATOM 2898 CD BGLN D 50 13.353 13.506 33.674 0.46 28.52 C ANISOU 2898 CD BGLN D 50 3076 4230 3530 896 55 -80 C ATOM 2899 OE1AGLN D 50 15.928 16.453 34.898 0.54 38.00 O ANISOU 2899 OE1AGLN D 50 4242 5462 4733 925 36 -93 O ATOM 2900 OE1BGLN D 50 12.180 13.167 33.881 0.46 26.36 O ANISOU 2900 OE1BGLN D 50 2804 3928 3285 895 62 -72 O ATOM 2901 NE2AGLN D 50 17.177 14.583 34.756 0.54 38.59 N ANISOU 2901 NE2AGLN D 50 4358 5574 4732 948 64 -129 N ATOM 2902 NE2BGLN D 50 14.289 12.644 33.312 0.46 28.04 N ANISOU 2902 NE2BGLN D 50 3035 4198 3421 901 64 -98 N ATOM 2903 H AGLN D 50 14.792 16.334 30.234 0.54 32.08 H ATOM 2904 H BGLN D 50 14.778 16.356 30.264 0.46 32.08 H ATOM 2905 HA AGLN D 50 13.341 14.568 31.454 0.54 34.73 H ATOM 2906 HA BGLN D 50 13.198 14.520 31.262 0.46 34.71 H ATOM 2907 HB2AGLN D 50 14.947 16.662 32.305 0.54 36.54 H ATOM 2908 HB2BGLN D 50 15.194 15.063 32.349 0.46 36.43 H ATOM 2909 HB3AGLN D 50 13.853 16.210 33.351 0.54 36.54 H ATOM 2910 HB3BGLN D 50 14.589 16.481 32.737 0.46 36.43 H ATOM 2911 HG2AGLN D 50 14.834 14.096 33.433 0.54 39.08 H ATOM 2912 HG2BGLN D 50 14.484 14.975 34.538 0.46 36.42 H ATOM 2913 HG3AGLN D 50 15.961 14.603 32.434 0.54 39.08 H ATOM 2914 HG3BGLN D 50 13.036 15.477 34.117 0.46 36.42 H ATOM 2915 HE21AGLN D 50 17.324 13.834 34.358 0.54 46.31 H ATOM 2916 HE21BGLN D 50 15.096 12.914 33.187 0.46 33.65 H ATOM 2917 HE22AGLN D 50 17.670 14.821 35.419 0.54 46.31 H ATOM 2918 HE22BGLN D 50 14.090 11.815 33.201 0.46 33.65 H ATOM 2919 N ASN D 51 12.088 17.523 31.636 1.00 26.49 N ANISOU 2919 N ASN D 51 2724 3964 3377 796 -41 12 N ATOM 2920 CA ASN D 51 10.827 18.223 31.854 1.00 26.60 C ANISOU 2920 CA ASN D 51 2719 3944 3444 787 -50 34 C ATOM 2921 C ASN D 51 9.792 17.797 30.815 1.00 27.62 C ANISOU 2921 C ASN D 51 2843 4068 3583 754 -64 56 C ATOM 2922 O ASN D 51 8.608 17.606 31.136 1.00 27.95 O ANISOU 2922 O ASN D 51 2883 4080 3658 755 -58 66 O ATOM 2923 CB ASN D 51 11.037 19.745 31.815 1.00 26.64 C ANISOU 2923 CB ASN D 51 2697 3949 3476 776 -72 51 C ATOM 2924 CG ASN D 51 11.884 20.264 32.975 1.00 25.59 C ANISOU 2924 CG ASN D 51 2566 3815 3341 810 -58 32 C ATOM 2925 OD1 ASN D 51 11.772 19.796 34.113 1.00 25.91 O ANISOU 2925 OD1 ASN D 51 2622 3838 3386 844 -32 13 O ATOM 2926 ND2 ASN D 51 12.733 21.255 32.689 1.00 25.39 N ANISOU 2926 ND2 ASN D 51 2527 3810 3311 800 -75 36 N ATOM 2927 H ASN D 51 12.765 18.028 31.470 1.00 31.79 H ATOM 2928 HA ASN D 51 10.484 17.990 32.731 1.00 31.92 H ATOM 2929 HB2 ASN D 51 11.487 19.979 30.988 1.00 31.97 H ATOM 2930 HB3 ASN D 51 10.173 20.183 31.857 1.00 31.97 H ATOM 2931 HD21 ASN D 51 13.234 21.584 33.306 1.00 30.47 H ATOM 2932 HD22 ASN D 51 12.779 21.564 31.888 1.00 30.47 H ATOM 2933 N ARG D 52 10.222 17.632 29.565 1.00 26.41 N ANISOU 2933 N ARG D 52 2688 3945 3402 723 -83 64 N ATOM 2934 CA ARG D 52 9.264 17.344 28.497 1.00 25.85 C ANISOU 2934 CA ARG D 52 2611 3871 3341 688 -99 87 C ATOM 2935 C ARG D 52 8.629 15.971 28.694 1.00 23.60 C ANISOU 2935 C ARG D 52 2348 3573 3045 699 -77 75 C ATOM 2936 O ARG D 52 7.437 15.795 28.416 1.00 23.41 O ANISOU 2936 O ARG D 52 2318 3529 3048 683 -82 92 O ATOM 2937 CB ARG D 52 9.934 17.426 27.119 1.00 27.04 C ANISOU 2937 CB ARG D 52 2756 4057 3460 654 -123 96 C ATOM 2938 CG ARG D 52 8.961 17.240 25.923 1.00 26.60 C ANISOU 2938 CG ARG D 52 2691 4000 3415 614 -143 122 C ATOM 2939 CD ARG D 52 8.029 18.429 25.806 1.00 27.63 C ANISOU 2939 CD ARG D 52 2792 4109 3597 596 -165 152 C ATOM 2940 NE ARG D 52 6.964 18.282 24.820 1.00 29.41 N ANISOU 2940 NE ARG D 52 3007 4328 3838 561 -183 177 N ATOM 2941 CZ ARG D 52 5.842 17.572 24.978 1.00 31.99 C ANISOU 2941 CZ ARG D 52 3340 4633 4183 561 -173 181 C ATOM 2942 NH1 ARG D 52 5.607 16.881 26.078 1.00 32.10 N ANISOU 2942 NH1 ARG D 52 3371 4625 4199 595 -144 161 N ATOM 2943 NH2 ARG D 52 4.937 17.550 24.006 1.00 33.75 N ANISOU 2943 NH2 ARG D 52 3551 4853 4420 527 -192 205 N ATOM 2944 H ARG D 52 11.042 17.680 29.312 1.00 31.69 H ATOM 2945 HA ARG D 52 8.556 18.006 28.524 1.00 31.02 H ATOM 2946 HB2 ARG D 52 10.351 18.298 27.028 1.00 32.45 H ATOM 2947 HB3 ARG D 52 10.610 16.733 27.060 1.00 32.45 H ATOM 2948 HG2 ARG D 52 9.470 17.167 25.101 1.00 31.92 H ATOM 2949 HG3 ARG D 52 8.427 16.443 26.063 1.00 31.92 H ATOM 2950 HD2 ARG D 52 7.610 18.579 26.669 1.00 33.15 H ATOM 2951 HD3 ARG D 52 8.551 19.208 25.559 1.00 33.15 H ATOM 2952 HE ARG D 52 7.067 18.689 24.069 1.00 35.29 H ATOM 2953 HH11 ARG D 52 6.178 16.890 26.721 1.00 38.51 H ATOM 2954 HH12 ARG D 52 4.881 16.428 26.154 1.00 38.51 H ATOM 2955 HH21 ARG D 52 5.077 17.988 23.279 1.00 40.50 H ATOM 2956 HH22 ARG D 52 4.221 17.083 24.096 1.00 40.50 H ATOM 2957 N ARG D 53 9.398 14.992 29.194 1.00 30.68 N ANISOU 2957 N ARG D 53 2826 4595 4237 312 250 519 N ATOM 2958 CA ARG D 53 8.797 13.698 29.508 1.00 29.91 C ANISOU 2958 CA ARG D 53 2756 4492 4115 298 318 488 C ATOM 2959 C ARG D 53 7.832 13.813 30.681 1.00 31.67 C ANISOU 2959 C ARG D 53 3015 4682 4338 293 362 442 C ATOM 2960 O ARG D 53 6.760 13.205 30.664 1.00 31.58 O ANISOU 2960 O ARG D 53 2997 4672 4332 280 415 404 O ATOM 2961 CB ARG D 53 9.881 12.644 29.790 1.00 29.04 C ANISOU 2961 CB ARG D 53 2696 4379 3960 299 326 514 C ATOM 2962 CG ARG D 53 10.597 12.151 28.542 1.00 28.78 C ANISOU 2962 CG ARG D 53 2629 4383 3924 300 301 550 C ATOM 2963 CD ARG D 53 11.550 10.968 28.835 1.00 28.67 C ANISOU 2963 CD ARG D 53 2665 4366 3864 299 318 571 C ATOM 2964 NE ARG D 53 12.610 11.272 29.791 1.00 28.68 N ANISOU 2964 NE ARG D 53 2718 4340 3837 311 291 596 N ATOM 2965 CZ ARG D 53 13.810 11.768 29.488 1.00 29.28 C ANISOU 2965 CZ ARG D 53 2790 4424 3909 323 233 641 C ATOM 2966 NH1 ARG D 53 14.157 12.068 28.234 1.00 30.29 N ANISOU 2966 NH1 ARG D 53 2863 4587 4060 327 192 670 N ATOM 2967 NH2 ARG D 53 14.681 11.989 30.454 1.00 30.42 N ANISOU 2967 NH2 ARG D 53 2986 4542 4029 333 214 659 N ATOM 2968 H ARG D 53 10.241 15.053 29.354 1.00 36.82 H ATOM 2969 HA ARG D 53 8.289 13.397 28.738 1.00 35.89 H ATOM 2970 HB2 ARG D 53 10.546 13.031 30.380 1.00 34.85 H ATOM 2971 HB3 ARG D 53 9.468 11.878 30.217 1.00 34.85 H ATOM 2972 HG2 ARG D 53 9.938 11.854 27.895 1.00 34.54 H ATOM 2973 HG3 ARG D 53 11.123 12.877 28.171 1.00 34.54 H ATOM 2974 HD2 ARG D 53 11.030 10.232 29.195 1.00 34.41 H ATOM 2975 HD3 ARG D 53 11.971 10.695 28.005 1.00 34.41 H ATOM 2976 HE ARG D 53 12.446 11.118 30.622 1.00 34.41 H ATOM 2977 HH11 ARG D 53 13.604 11.931 27.590 1.00 36.35 H ATOM 2978 HH12 ARG D 53 14.937 12.391 28.070 1.00 36.35 H ATOM 2979 HH21 ARG D 53 14.474 11.807 31.269 1.00 36.50 H ATOM 2980 HH22 ARG D 53 15.454 12.316 30.269 1.00 36.50 H ATOM 2981 N MET D 54 8.179 14.594 31.705 1.00 34.54 N ANISOU 2981 N MET D 54 3413 5014 4696 303 341 445 N ATOM 2982 CA MET D 54 7.227 14.845 32.793 1.00 39.61 C ANISOU 2982 CA MET D 54 4084 5625 5342 299 379 402 C ATOM 2983 C MET D 54 5.939 15.449 32.249 1.00 37.93 C ANISOU 2983 C MET D 54 3815 5423 5173 293 389 370 C ATOM 2984 O MET D 54 4.843 15.013 32.602 1.00 38.24 O ANISOU 2984 O MET D 54 3861 5454 5215 282 443 327 O ATOM 2985 CB MET D 54 7.841 15.760 33.860 1.00 46.40 C ANISOU 2985 CB MET D 54 4983 6452 6194 313 347 414 C ATOM 2986 CG MET D 54 8.951 15.133 34.717 1.00 53.54 C ANISOU 2986 CG MET D 54 5954 7335 7051 318 348 436 C ATOM 2987 SD MET D 54 8.562 13.504 35.410 1.00 59.36 S ANISOU 2987 SD MET D 54 6747 8058 7748 304 427 405 S ATOM 2988 CE MET D 54 9.014 12.401 34.048 1.00 59.74 C ANISOU 2988 CE MET D 54 6763 8149 7787 297 429 431 C ATOM 2989 H MET D 54 8.940 14.984 31.794 1.00 41.45 H ATOM 2990 HA MET D 54 7.016 14.000 33.219 1.00 47.54 H ATOM 2991 HB2 MET D 54 8.220 16.536 33.417 1.00 55.68 H ATOM 2992 HB3 MET D 54 7.136 16.045 34.461 1.00 55.68 H ATOM 2993 HG2 MET D 54 9.745 15.035 34.169 1.00 64.24 H ATOM 2994 HG3 MET D 54 9.140 15.728 35.459 1.00 64.24 H ATOM 2995 HE1 MET D 54 8.480 12.624 33.270 1.00 71.69 H ATOM 2996 HE2 MET D 54 9.956 12.517 33.847 1.00 71.69 H ATOM 2997 HE3 MET D 54 8.844 11.484 34.315 1.00 71.69 H ATOM 2998 N LYS D 55 6.052 16.440 31.362 1.00 36.79 N ANISOU 2998 N LYS D 55 3615 5300 5062 300 337 390 N ATOM 2999 CA LYS D 55 4.861 16.996 30.726 1.00 34.87 C ANISOU 2999 CA LYS D 55 3315 5073 4862 294 343 362 C ATOM 3000 C LYS D 55 4.116 15.937 29.925 1.00 34.54 C ANISOU 3000 C LYS D 55 3246 5055 4823 279 389 342 C ATOM 3001 O LYS D 55 2.885 15.858 29.971 1.00 35.07 O ANISOU 3001 O LYS D 55 3296 5120 4908 270 429 300 O ATOM 3002 CB LYS D 55 5.249 18.171 29.832 1.00 33.78 C ANISOU 3002 CB LYS D 55 3122 4955 4757 305 277 393 C ATOM 3003 CG LYS D 55 4.080 18.836 29.167 1.00 36.80 C ANISOU 3003 CG LYS D 55 3445 5353 5185 300 278 367 C ATOM 3004 CD LYS D 55 4.525 20.009 28.290 1.00 41.48 C ANISOU 3004 CD LYS D 55 3984 5965 5809 311 210 399 C ATOM 3005 CE LYS D 55 3.355 20.678 27.586 1.00 44.59 C ANISOU 3005 CE LYS D 55 4317 6376 6250 306 211 373 C ATOM 3006 NZ LYS D 55 3.840 21.429 26.392 1.00 46.98 N ANISOU 3006 NZ LYS D 55 4562 6710 6580 314 151 409 N ATOM 3007 H LYS D 55 6.793 16.801 31.116 1.00 44.14 H ATOM 3008 HA LYS D 55 4.263 17.328 31.414 1.00 41.85 H ATOM 3009 HB2 LYS D 55 5.702 18.838 30.371 1.00 40.53 H ATOM 3010 HB3 LYS D 55 5.843 17.851 29.136 1.00 40.53 H ATOM 3011 HG2 LYS D 55 3.624 18.191 28.604 1.00 44.16 H ATOM 3012 HG3 LYS D 55 3.477 19.175 29.846 1.00 44.16 H ATOM 3013 HD2 LYS D 55 4.962 20.673 28.846 1.00 49.77 H ATOM 3014 HD3 LYS D 55 5.139 19.684 27.613 1.00 49.77 H ATOM 3015 HE2 LYS D 55 2.725 20.002 27.290 1.00 53.51 H ATOM 3016 HE3 LYS D 55 2.926 21.303 28.190 1.00 53.51 H ATOM 3017 HZ1 LYS D 55 3.154 21.820 25.980 1.00 56.38 H ATOM 3018 HZ2 LYS D 55 4.422 22.054 26.641 1.00 56.38 H ATOM 3019 HZ3 LYS D 55 4.239 20.872 25.824 1.00 56.38 H ATOM 3020 N TRP D 56 4.840 15.090 29.204 1.00 37.28 N ANISOU 3020 N TRP D 56 3589 5426 5151 278 384 370 N ATOM 3021 CA TRP D 56 4.166 14.091 28.387 1.00 38.15 C ANISOU 3021 CA TRP D 56 3671 5561 5264 264 425 352 C ATOM 3022 C TRP D 56 3.398 13.092 29.255 1.00 36.37 C ANISOU 3022 C TRP D 56 3489 5313 5015 251 497 311 C ATOM 3023 O TRP D 56 2.273 12.698 28.918 1.00 38.19 O ANISOU 3023 O TRP D 56 3694 5554 5261 239 539 276 O ATOM 3024 CB TRP D 56 5.186 13.397 27.492 1.00 39.75 C ANISOU 3024 CB TRP D 56 3863 5791 5448 265 404 393 C ATOM 3025 CG TRP D 56 4.567 12.424 26.622 1.00 43.39 C ANISOU 3025 CG TRP D 56 4295 6279 5913 252 441 378 C ATOM 3026 CD1 TRP D 56 3.968 12.665 25.431 1.00 45.28 C ANISOU 3026 CD1 TRP D 56 4467 6549 6186 248 431 375 C ATOM 3027 CD2 TRP D 56 4.448 11.027 26.866 1.00 48.89 C ANISOU 3027 CD2 TRP D 56 5027 6974 6577 241 497 363 C ATOM 3028 NE1 TRP D 56 3.478 11.497 24.901 1.00 48.56 N ANISOU 3028 NE1 TRP D 56 4874 6983 6593 234 477 359 N ATOM 3029 CE2 TRP D 56 3.766 10.469 25.761 1.00 50.82 C ANISOU 3029 CE2 TRP D 56 5221 7249 6838 230 518 351 C ATOM 3030 CE3 TRP D 56 4.866 10.184 27.904 1.00 52.56 C ANISOU 3030 CE3 TRP D 56 5559 7412 6999 239 530 359 C ATOM 3031 CZ2 TRP D 56 3.482 9.102 25.664 1.00 53.99 C ANISOU 3031 CZ2 TRP D 56 5640 7657 7216 217 572 335 C ATOM 3032 CZ3 TRP D 56 4.590 8.818 27.809 1.00 55.29 C ANISOU 3032 CZ3 TRP D 56 5922 7765 7321 227 584 343 C ATOM 3033 CH2 TRP D 56 3.901 8.293 26.693 1.00 56.03 C ANISOU 3033 CH2 TRP D 56 5966 7890 7433 216 604 332 C ATOM 3034 H TRP D 56 5.700 15.071 29.170 1.00 44.74 H ATOM 3035 HA TRP D 56 3.524 14.539 27.813 1.00 45.78 H ATOM 3036 HB2 TRP D 56 5.627 14.060 26.939 1.00 47.70 H ATOM 3037 HB3 TRP D 56 5.835 12.938 28.046 1.00 47.70 H ATOM 3038 HD1 TRP D 56 3.891 13.503 25.035 1.00 54.33 H ATOM 3039 HE1 TRP D 56 3.065 11.421 24.151 1.00 58.27 H ATOM 3040 HE3 TRP D 56 5.321 10.527 28.639 1.00 63.07 H ATOM 3041 HZ2 TRP D 56 3.032 8.754 24.928 1.00 64.79 H ATOM 3042 HZ3 TRP D 56 4.857 8.248 28.493 1.00 66.35 H ATOM 3043 HH2 TRP D 56 3.725 7.380 26.655 1.00 67.24 H ATOM 3044 N LYS D 57 3.953 12.711 30.401 1.00 49.33 N ANISOU 3044 N LYS D 57 3359 9310 6074 -783 986 -1022 N ATOM 3045 CA LYS D 57 3.210 11.853 31.319 1.00 47.24 C ANISOU 3045 CA LYS D 57 3094 9059 5797 -812 998 -1045 C ATOM 3046 C LYS D 57 1.921 12.536 31.792 1.00 50.46 C ANISOU 3046 C LYS D 57 3485 9488 6200 -817 990 -1086 C ATOM 3047 O LYS D 57 0.828 11.964 31.697 1.00 49.11 O ANISOU 3047 O LYS D 57 3308 9332 6018 -826 998 -1116 O ATOM 3048 CB LYS D 57 4.111 11.465 32.499 1.00 45.08 C ANISOU 3048 CB LYS D 57 2828 8775 5524 -833 1003 -1021 C ATOM 3049 CG LYS D 57 3.447 10.488 33.485 1.00 45.14 C ANISOU 3049 CG LYS D 57 2836 8796 5519 -864 1016 -1041 C ATOM 3050 H LYS D 57 4.742 12.929 30.667 1.00 59.20 H ATOM 3051 HA LYS D 57 2.961 11.038 30.854 1.00 56.69 H ATOM 3052 HB2 LYS D 57 4.913 11.041 32.155 1.00 54.09 H ATOM 3053 HB3 LYS D 57 4.347 12.268 32.989 1.00 54.09 H ATOM 3054 N LYS D 58 2.023 13.776 32.276 1.00 53.74 N ANISOU 3054 N LYS D 58 3893 9903 6623 -810 976 -1088 N ATOM 3055 CA LYS D 58 0.844 14.488 32.783 1.00 59.83 C ANISOU 3055 CA LYS D 58 4649 10694 7389 -814 968 -1126 C ATOM 3056 C LYS D 58 -0.261 14.582 31.735 1.00 61.60 C ANISOU 3056 C LYS D 58 4864 10932 7610 -798 967 -1155 C ATOM 3057 O LYS D 58 -1.446 14.412 32.049 1.00 63.40 O ANISOU 3057 O LYS D 58 5082 11180 7828 -809 970 -1189 O ATOM 3058 CB LYS D 58 1.236 15.894 33.244 1.00 63.12 C ANISOU 3058 CB LYS D 58 5061 11106 7816 -803 951 -1120 C ATOM 3059 CG LYS D 58 1.337 16.077 34.738 1.00 66.51 C ANISOU 3059 CG LYS D 58 5489 11538 8242 -826 950 -1122 C ATOM 3060 CD LYS D 58 2.292 15.078 35.370 1.00 69.52 C ANISOU 3060 CD LYS D 58 5883 11907 8622 -846 962 -1093 C ATOM 3061 CE LYS D 58 2.439 15.335 36.864 1.00 70.72 C ANISOU 3061 CE LYS D 58 6036 12062 8774 -867 960 -1095 C ATOM 3062 H LYS D 58 2.756 14.225 32.323 1.00 64.49 H ATOM 3063 HA LYS D 58 0.491 14.008 33.549 1.00 71.79 H ATOM 3064 HB2 LYS D 58 2.101 16.112 32.864 1.00 75.74 H ATOM 3065 HB3 LYS D 58 0.571 16.521 32.918 1.00 75.74 H ATOM 3066 HG2 LYS D 58 1.663 16.970 34.929 1.00 79.81 H ATOM 3067 HG3 LYS D 58 0.461 15.950 35.135 1.00 79.81 H ATOM 3068 HD2 LYS D 58 1.947 14.180 35.247 1.00 83.42 H ATOM 3069 HD3 LYS D 58 3.166 15.164 34.958 1.00 83.42 H ATOM 3070 N GLU D 59 0.095 14.901 30.496 1.00 61.84 N ANISOU 3070 N GLU D 59 4897 10953 7647 -772 962 -1142 N ATOM 3071 CA GLU D 59 -0.893 14.956 29.431 1.00 63.82 C ANISOU 3071 CA GLU D 59 5139 11215 7894 -757 960 -1168 C ATOM 3072 C GLU D 59 -1.275 13.568 28.928 1.00 65.94 C ANISOU 3072 C GLU D 59 5414 11487 8153 -767 976 -1173 C ATOM 3073 O GLU D 59 -2.201 13.455 28.122 1.00 61.74 O ANISOU 3073 O GLU D 59 4875 10966 7616 -758 977 -1197 O ATOM 3074 CB GLU D 59 -0.364 15.834 28.287 1.00 65.49 C ANISOU 3074 CB GLU D 59 5351 11414 8117 -725 948 -1151 C ATOM 3075 CG GLU D 59 -0.147 17.294 28.726 1.00 68.45 C ANISOU 3075 CG GLU D 59 5719 11788 8502 -715 931 -1151 C ATOM 3076 CD GLU D 59 0.654 18.148 27.740 1.00 71.64 C ANISOU 3076 CD GLU D 59 6126 12177 8919 -686 918 -1127 C ATOM 3077 OE1 GLU D 59 1.315 17.608 26.813 1.00 71.64 O ANISOU 3077 OE1 GLU D 59 6134 12163 8921 -674 924 -1103 O ATOM 3078 OE2 GLU D 59 0.624 19.388 27.916 1.00 73.29 O ANISOU 3078 OE2 GLU D 59 6328 12386 9134 -674 903 -1132 O ATOM 3079 H GLU D 59 0.896 15.088 30.248 1.00 74.21 H ATOM 3080 HA GLU D 59 -1.697 15.374 29.776 1.00 76.58 H ATOM 3081 HB2 GLU D 59 0.487 15.481 27.982 1.00 78.58 H ATOM 3082 HB3 GLU D 59 -1.006 15.830 27.560 1.00 78.58 H ATOM 3083 HG2 GLU D 59 -1.014 17.714 28.842 1.00 82.14 H ATOM 3084 HG3 GLU D 59 0.330 17.295 29.570 1.00 82.14 H ATOM 3085 N ASN D 60 -0.623 12.522 29.434 1.00 71.44 N ANISOU 3085 N ASN D 60 6123 12175 8846 -786 989 -1153 N ATOM 3086 CA ASN D 60 -0.767 11.146 28.947 1.00 78.78 C ANISOU 3086 CA ASN D 60 7062 13104 9767 -795 1004 -1151 C ATOM 3087 C ASN D 60 -0.255 10.987 27.505 1.00 78.52 C ANISOU 3087 C ASN D 60 7038 13057 9739 -770 1004 -1132 C ATOM 3088 O ASN D 60 -0.886 11.365 26.516 1.00 79.16 O ANISOU 3088 O ASN D 60 7112 13144 9820 -751 999 -1148 O ATOM 3089 CB ASN D 60 -2.220 10.684 29.054 1.00 84.98 C ANISOU 3089 CB ASN D 60 7837 13911 10539 -808 1010 -1191 C ATOM 3090 CG ASN D 60 -2.598 10.281 30.466 1.00 90.18 C ANISOU 3090 CG ASN D 60 8493 14582 11190 -839 1016 -1205 C ATOM 3091 OD1 ASN D 60 -2.836 9.105 30.740 1.00 92.34 O ANISOU 3091 OD1 ASN D 60 8773 14859 11454 -859 1030 -1208 O ATOM 3092 ND2 ASN D 60 -2.640 11.254 31.374 1.00 91.61 N ANISOU 3092 ND2 ASN D 60 8665 14768 11375 -842 1007 -1211 N ATOM 3093 OXT ASN D 60 0.833 10.459 27.301 1.00 76.74 O ANISOU 3093 OXT ASN D 60 6826 12814 9516 -768 1010 -1099 O ATOM 3094 H ASN D 60 -0.068 12.587 30.087 1.00 85.73 H ATOM 3095 HA ASN D 60 -0.234 10.564 29.511 1.00 94.54 H ATOM 3096 HB2 ASN D 60 -2.804 11.409 28.782 1.00101.97 H ATOM 3097 HB3 ASN D 60 -2.351 9.916 28.477 1.00101.97 H ATOM 3098 HD21 ASN D 60 -2.849 11.074 32.188 1.00109.93 H ATOM 3099 HD22 ASN D 60 -2.458 12.063 31.146 1.00109.93 H TER 3100 ASN D 60 ATOM 3101 O5' DA E 1 31.269 -0.094 44.479 1.00 38.91 O ANISOU 3101 O5' DA E 1 4245 5565 4975 666 47 706 O ATOM 3102 C5' DA E 1 32.644 -0.276 44.825 1.00 38.50 C ANISOU 3102 C5' DA E 1 4194 5530 4905 614 27 770 C ATOM 3103 C4' DA E 1 33.515 0.645 44.003 1.00 38.95 C ANISOU 3103 C4' DA E 1 4269 5669 4861 536 -69 825 C ATOM 3104 O4' DA E 1 33.462 0.256 42.598 1.00 38.40 O ANISOU 3104 O4' DA E 1 4075 5714 4803 510 -55 761 O ATOM 3105 C3' DA E 1 33.074 2.099 44.047 1.00 39.91 C ANISOU 3105 C3' DA E 1 4516 5759 4890 532 -158 874 C ATOM 3106 O3' DA E 1 34.203 2.962 44.135 1.00 42.49 O ANISOU 3106 O3' DA E 1 4914 6104 5125 466 -248 967 O ATOM 3107 C2' DA E 1 32.302 2.277 42.750 1.00 38.48 C ANISOU 3107 C2' DA E 1 4268 5655 4698 532 -164 808 C ATOM 3108 C1' DA E 1 33.064 1.359 41.818 1.00 37.16 C ANISOU 3108 C1' DA E 1 3959 5596 4566 489 -130 770 C ATOM 3109 N9 DA E 1 32.289 0.872 40.690 1.00 33.19 N ANISOU 3109 N9 DA E 1 3345 5163 4103 504 -88 678 N ATOM 3110 C8 DA E 1 32.510 1.140 39.374 1.00 31.22 C ANISOU 3110 C8 DA E 1 3029 5023 3810 455 -126 659 C ATOM 3111 N7 DA E 1 31.654 0.564 38.567 1.00 31.17 N ANISOU 3111 N7 DA E 1 2926 5061 3857 484 -72 569 N ATOM 3112 C5 DA E 1 30.819 -0.138 39.420 1.00 31.18 C ANISOU 3112 C5 DA E 1 2930 4976 3942 557 8 526 C ATOM 3113 C6 DA E 1 29.717 -0.972 39.192 1.00 31.35 C ANISOU 3113 C6 DA E 1 2872 4991 4049 617 93 431 C ATOM 3114 N6 DA E 1 29.226 -1.225 37.986 1.00 31.93 N ANISOU 3114 N6 DA E 1 2847 5149 4137 612 111 360 N ATOM 3115 N1 DA E 1 29.103 -1.503 40.260 1.00 33.32 N ANISOU 3115 N1 DA E 1 3152 5142 4368 682 158 413 N ATOM 3116 C2 DA E 1 29.584 -1.242 41.477 1.00 33.92 C ANISOU 3116 C2 DA E 1 3328 5133 4429 687 140 484 C ATOM 3117 N3 DA E 1 30.624 -0.495 41.817 1.00 34.00 N ANISOU 3117 N3 DA E 1 3417 5139 4363 634 64 576 N ATOM 3118 C4 DA E 1 31.198 0.043 40.731 1.00 32.27 C ANISOU 3118 C4 DA E 1 3168 5019 4075 571 0 592 C ATOM 3119 H5' DA E 1 32.899 -1.196 44.654 1.00 46.20 H ATOM 3120 H5'' DA E 1 32.766 -0.079 45.767 1.00 46.20 H ATOM 3121 H4' DA E 1 34.430 0.581 44.317 1.00 46.74 H ATOM 3122 H3' DA E 1 32.485 2.244 44.804 1.00 47.90 H ATOM 3123 H2' DA E 1 31.383 1.983 42.851 1.00 46.18 H ATOM 3124 H2'' DA E 1 32.345 3.196 42.444 1.00 46.18 H ATOM 3125 H1' DA E 1 33.852 1.819 41.490 1.00 44.60 H ATOM 3126 H8 DA E 1 33.199 1.689 39.076 1.00 37.47 H ATOM 3127 H61 DA E 1 28.529 -1.721 37.901 1.00 38.32 H ATOM 3128 H62 DA E 1 29.606 -0.894 37.289 1.00 38.32 H ATOM 3129 H2 DA E 1 29.132 -1.646 42.182 1.00 40.71 H ATOM 3130 HO5' DA E 1 30.968 -0.425 43.768 1.00 46.69 H ATOM 3131 P DG E 2 34.029 4.413 44.808 1.00 44.87 P ANISOU 3131 P DG E 2 5382 6331 5334 465 -337 1048 P ATOM 3132 OP1 DG E 2 35.358 4.715 45.373 1.00 46.43 O ANISOU 3132 OP1 DG E 2 5636 6523 5482 412 -387 1139 O ATOM 3133 OP2 DG E 2 32.808 4.454 45.668 1.00 45.06 O ANISOU 3133 OP2 DG E 2 5473 6250 5400 544 -298 1022 O ATOM 3134 O5' DG E 2 33.676 5.358 43.559 1.00 41.81 O ANISOU 3134 O5' DG E 2 4992 6021 4871 433 -408 1037 O ATOM 3135 C5' DG E 2 34.594 5.467 42.529 1.00 38.65 C ANISOU 3135 C5' DG E 2 4529 5731 4425 362 -451 1051 C ATOM 3136 C4' DG E 2 33.988 6.150 41.335 1.00 35.89 C ANISOU 3136 C4' DG E 2 4160 5450 4026 348 -496 1020 C ATOM 3137 O4' DG E 2 32.946 5.316 40.764 1.00 34.96 O ANISOU 3137 O4' DG E 2 3940 5355 3989 397 -416 917 O ATOM 3138 C3' DG E 2 33.358 7.499 41.633 1.00 34.11 C ANISOU 3138 C3' DG E 2 4070 5167 3724 361 -570 1064 C ATOM 3139 O3' DG E 2 33.792 8.415 40.585 1.00 34.27 O ANISOU 3139 O3' DG E 2 4095 5273 3651 297 -658 1094 O ATOM 3140 C2' DG E 2 31.851 7.198 41.661 1.00 32.84 C ANISOU 3140 C2' DG E 2 3893 4960 3625 439 -509 984 C ATOM 3141 C1' DG E 2 31.727 6.034 40.682 1.00 34.13 C ANISOU 3141 C1' DG E 2 3895 5211 3863 440 -435 894 C ATOM 3142 N9 DG E 2 30.651 5.076 40.946 1.00 32.54 N ANISOU 3142 N9 DG E 2 3636 4967 3763 514 -336 810 N ATOM 3143 C8 DG E 2 30.107 4.721 42.153 1.00 29.84 C ANISOU 3143 C8 DG E 2 3347 4516 3477 577 -284 806 C ATOM 3144 N7 DG E 2 29.193 3.785 42.048 1.00 29.35 N ANISOU 3144 N7 DG E 2 3204 4444 3504 633 -195 719 N ATOM 3145 C5 DG E 2 29.145 3.481 40.699 1.00 29.95 C ANISOU 3145 C5 DG E 2 3165 4629 3585 606 -187 661 C ATOM 3146 C6 DG E 2 28.341 2.533 39.970 1.00 29.29 C ANISOU 3146 C6 DG E 2 2958 4590 3581 641 -108 559 C ATOM 3147 O6 DG E 2 27.482 1.738 40.401 1.00 30.75 O ANISOU 3147 O6 DG E 2 3109 4723 3851 705 -25 497 O ATOM 3148 N1 DG E 2 28.597 2.591 38.612 1.00 26.81 N ANISOU 3148 N1 DG E 2 2557 4392 3237 592 -133 531 N ATOM 3149 C2 DG E 2 29.524 3.415 38.033 1.00 27.70 C ANISOU 3149 C2 DG E 2 2696 4570 3259 520 -222 593 C ATOM 3150 N2 DG E 2 29.662 3.320 36.714 1.00 28.32 N ANISOU 3150 N2 DG E 2 2678 4759 3322 480 -233 554 N ATOM 3151 N3 DG E 2 30.284 4.268 38.698 1.00 29.50 N ANISOU 3151 N3 DG E 2 3035 4758 3414 487 -294 687 N ATOM 3152 C4 DG E 2 30.039 4.260 40.007 1.00 31.02 C ANISOU 3152 C4 DG E 2 3315 4839 3632 533 -273 716 C ATOM 3153 H5' DG E 2 34.890 4.580 42.271 1.00 46.38 H ATOM 3154 H5'' DG E 2 35.357 5.981 42.836 1.00 46.38 H ATOM 3155 H4' DG E 2 34.682 6.275 40.669 1.00 43.06 H ATOM 3156 H3' DG E 2 33.652 7.819 42.501 1.00 40.93 H ATOM 3157 H2' DG E 2 31.570 6.932 42.551 1.00 39.41 H ATOM 3158 H2'' DG E 2 31.342 7.964 41.352 1.00 39.41 H ATOM 3159 H1' DG E 2 31.625 6.385 39.784 1.00 40.96 H ATOM 3160 H8 DG E 2 30.361 5.101 42.962 1.00 35.81 H ATOM 3161 H1 DG E 2 28.167 2.051 38.100 1.00 32.17 H ATOM 3162 H21 DG E 2 30.239 3.810 36.306 1.00 33.98 H ATOM 3163 H22 DG E 2 29.173 2.770 36.270 1.00 33.98 H ATOM 3164 P DA E 3 33.081 9.812 40.274 1.00 35.03 P ANISOU 3164 P DA E 3 4291 5356 3662 298 -740 1118 P ATOM 3165 OP1 DA E 3 34.211 10.591 39.732 1.00 37.53 O ANISOU 3165 OP1 DA E 3 4633 5743 3885 216 -831 1188 O ATOM 3166 OP2 DA E 3 32.219 10.283 41.370 1.00 35.16 O ANISOU 3166 OP2 DA E 3 4424 5252 3682 359 -738 1135 O ATOM 3167 O5' DA E 3 32.226 9.530 38.979 1.00 34.84 O ANISOU 3167 O5' DA E 3 4161 5412 3663 310 -712 1028 O ATOM 3168 C5' DA E 3 32.850 8.829 37.886 1.00 35.11 C ANISOU 3168 C5' DA E 3 4061 5562 3717 264 -692 989 C ATOM 3169 C4' DA E 3 32.028 8.955 36.640 1.00 35.52 C ANISOU 3169 C4' DA E 3 4044 5688 3765 268 -693 921 C ATOM 3170 O4' DA E 3 30.928 8.015 36.689 1.00 35.09 O ANISOU 3170 O4' DA E 3 3919 5606 3808 339 -597 830 O ATOM 3171 C3' DA E 3 31.377 10.311 36.431 1.00 37.42 C ANISOU 3171 C3' DA E 3 4387 5909 3922 270 -773 950 C ATOM 3172 O3' DA E 3 31.232 10.537 35.029 1.00 43.11 O ANISOU 3172 O3' DA E 3 5033 6735 4611 236 -801 912 O ATOM 3173 C2' DA E 3 30.041 10.149 37.171 1.00 34.76 C ANISOU 3173 C2' DA E 3 4092 5473 3642 357 -718 906 C ATOM 3174 C1' DA E 3 29.689 8.703 36.845 1.00 33.83 C ANISOU 3174 C1' DA E 3 3832 5388 3633 390 -611 813 C ATOM 3175 N9 DA E 3 28.928 7.984 37.862 1.00 32.90 N ANISOU 3175 N9 DA E 3 3725 5173 3601 465 -529 776 N ATOM 3176 C8 DA E 3 28.990 8.126 39.224 1.00 32.34 C ANISOU 3176 C8 DA E 3 3757 4994 3537 495 -525 827 C ATOM 3177 N7 DA E 3 28.208 7.290 39.878 1.00 30.89 N ANISOU 3177 N7 DA E 3 3550 4744 3443 564 -438 773 N ATOM 3178 C5 DA E 3 27.631 6.521 38.876 1.00 31.14 C ANISOU 3178 C5 DA E 3 3453 4847 3531 578 -380 681 C ATOM 3179 C6 DA E 3 26.713 5.455 38.903 1.00 33.18 C ANISOU 3179 C6 DA E 3 3628 5088 3890 640 -281 592 C ATOM 3180 N6 DA E 3 26.219 4.932 40.025 1.00 34.63 N ANISOU 3180 N6 DA E 3 3845 5174 4140 701 -219 580 N ATOM 3181 N1 DA E 3 26.329 4.931 37.721 1.00 34.04 N ANISOU 3181 N1 DA E 3 3617 5286 4031 636 -247 514 N ATOM 3182 C2 DA E 3 26.867 5.419 36.596 1.00 33.07 C ANISOU 3182 C2 DA E 3 3458 5265 3844 572 -308 527 C ATOM 3183 N3 DA E 3 27.733 6.418 36.448 1.00 31.41 N ANISOU 3183 N3 DA E 3 3317 5081 3537 511 -403 607 N ATOM 3184 C4 DA E 3 28.065 6.937 37.633 1.00 31.67 C ANISOU 3184 C4 DA E 3 3470 5022 3540 518 -435 682 C ATOM 3185 H5' DA E 3 32.938 7.891 38.117 1.00 42.14 H ATOM 3186 H5'' DA E 3 33.731 9.203 37.727 1.00 42.14 H ATOM 3187 H4' DA E 3 32.585 8.750 35.872 1.00 42.63 H ATOM 3188 H3' DA E 3 31.911 11.010 36.839 1.00 44.90 H ATOM 3189 H2' DA E 3 30.156 10.271 38.126 1.00 41.71 H ATOM 3190 H2'' DA E 3 29.373 10.757 36.817 1.00 41.71 H ATOM 3191 H1' DA E 3 29.203 8.676 36.006 1.00 40.60 H ATOM 3192 H8 DA E 3 29.508 8.773 39.645 1.00 38.81 H ATOM 3193 H61 DA E 3 25.667 4.274 39.986 1.00 41.56 H ATOM 3194 H62 DA E 3 26.452 5.253 40.788 1.00 41.56 H ATOM 3195 H2 DA E 3 26.574 5.022 35.808 1.00 39.69 H ATOM 3196 P DA E 4 30.644 11.913 34.444 1.00 49.26 P ANISOU 3196 P DA E 4 5891 7526 5298 225 -889 934 P ATOM 3197 OP1 DA E 4 31.449 12.116 33.222 1.00 51.36 O ANISOU 3197 OP1 DA E 4 6089 7914 5511 150 -938 942 O ATOM 3198 OP2 DA E 4 30.495 12.934 35.502 1.00 48.89 O ANISOU 3198 OP2 DA E 4 6002 7378 5197 242 -945 1007 O ATOM 3199 O5' DA E 4 29.175 11.522 33.970 1.00 49.60 O ANISOU 3199 O5' DA E 4 5875 7568 5402 289 -827 837 O ATOM 3200 C5' DA E 4 29.014 10.335 33.225 1.00 50.48 C ANISOU 3200 C5' DA E 4 5838 7749 5592 297 -748 751 C ATOM 3201 C4' DA E 4 27.570 9.942 33.164 1.00 51.34 C ANISOU 3201 C4' DA E 4 5916 7824 5767 371 -683 668 C ATOM 3202 O4' DA E 4 27.189 9.286 34.409 1.00 49.62 O ANISOU 3202 O4' DA E 4 5728 7502 5623 434 -612 657 O ATOM 3203 C3' DA E 4 26.589 11.103 33.006 1.00 54.55 C ANISOU 3203 C3' DA E 4 6412 8200 6113 395 -740 676 C ATOM 3204 O3' DA E 4 25.563 10.710 32.136 1.00 61.68 O ANISOU 3204 O3' DA E 4 7228 9148 7059 427 -695 586 O ATOM 3205 C2' DA E 4 26.074 11.284 34.420 1.00 50.09 C ANISOU 3205 C2' DA E 4 5959 7504 5569 454 -723 704 C ATOM 3206 C1' DA E 4 25.965 9.827 34.811 1.00 46.03 C ANISOU 3206 C1' DA E 4 5349 6972 5167 494 -614 642 C ATOM 3207 N9 DA E 4 25.746 9.564 36.214 1.00 38.04 N ANISOU 3207 N9 DA E 4 4411 5844 4200 546 -573 662 N ATOM 3208 C8 DA E 4 26.284 10.215 37.274 1.00 36.86 C ANISOU 3208 C8 DA E 4 4384 5617 4003 538 -622 748 C ATOM 3209 N7 DA E 4 25.891 9.747 38.427 1.00 34.75 N ANISOU 3209 N7 DA E 4 4156 5251 3796 595 -565 743 N ATOM 3210 C5 DA E 4 25.042 8.706 38.090 1.00 32.77 C ANISOU 3210 C5 DA E 4 3798 5014 3637 644 -474 647 C ATOM 3211 C6 DA E 4 24.289 7.795 38.863 1.00 29.39 C ANISOU 3211 C6 DA E 4 3349 4513 3304 715 -381 594 C ATOM 3212 N6 DA E 4 24.276 7.798 40.195 1.00 29.00 N ANISOU 3212 N6 DA E 4 3389 4357 3273 750 -366 634 N ATOM 3213 N1 DA E 4 23.536 6.898 38.208 1.00 27.95 N ANISOU 3213 N1 DA E 4 3051 4372 3197 748 -306 500 N ATOM 3214 C2 DA E 4 23.540 6.898 36.884 1.00 28.39 C ANISOU 3214 C2 DA E 4 3018 4534 3234 713 -321 460 C ATOM 3215 N3 DA E 4 24.203 7.694 36.055 1.00 31.71 N ANISOU 3215 N3 DA E 4 3447 5031 3569 646 -403 502 N ATOM 3216 C4 DA E 4 24.941 8.588 36.734 1.00 33.97 C ANISOU 3216 C4 DA E 4 3851 5275 3782 615 -478 596 C ATOM 3217 H5' DA E 4 29.521 9.623 33.644 1.00 60.57 H ATOM 3218 H5'' DA E 4 29.345 10.476 32.324 1.00 60.57 H ATOM 3219 H4' DA E 4 27.444 9.321 32.429 1.00 61.61 H ATOM 3220 H3' DA E 4 27.038 11.903 32.688 1.00 65.46 H ATOM 3221 H2' DA E 4 26.718 11.753 34.975 1.00 60.11 H ATOM 3222 H2'' DA E 4 25.207 11.719 34.429 1.00 60.11 H ATOM 3223 H1' DA E 4 25.253 9.415 34.298 1.00 55.23 H ATOM 3224 H8 DA E 4 26.874 10.929 37.188 1.00 44.23 H ATOM 3225 H61 DA E 4 23.790 7.231 40.622 1.00 34.80 H ATOM 3226 H62 DA E 4 24.753 8.367 40.629 1.00 34.80 H ATOM 3227 H2 DA E 4 23.008 6.251 36.480 1.00 34.06 H ATOM 3228 P DA E 5 25.012 11.634 30.935 1.00 63.23 P ANISOU 3228 P DA E 5 7422 9414 7187 405 -759 571 P ATOM 3229 OP1 DA E 5 25.796 11.264 29.733 1.00 60.66 O ANISOU 3229 OP1 DA E 5 6983 9215 6851 341 -768 552 O ATOM 3230 OP2 DA E 5 24.858 13.050 31.385 1.00 64.52 O ANISOU 3230 OP2 DA E 5 7735 9519 7259 402 -850 645 O ATOM 3231 O5' DA E 5 23.526 11.062 30.795 1.00 59.93 O ANISOU 3231 O5' DA E 5 6953 8972 6847 482 -681 475 O ATOM 3232 C5' DA E 5 23.351 9.662 30.673 1.00 53.31 C ANISOU 3232 C5' DA E 5 5989 8154 6111 510 -579 397 C ATOM 3233 C4' DA E 5 22.148 9.197 31.451 1.00 45.65 C ANISOU 3233 C4' DA E 5 5036 7092 5215 595 -506 346 C ATOM 3234 O4' DA E 5 22.497 9.013 32.850 1.00 40.56 O ANISOU 3234 O4' DA E 5 4469 6346 4595 620 -486 394 O ATOM 3235 C3' DA E 5 20.970 10.180 31.420 1.00 41.97 C ANISOU 3235 C3' DA E 5 4654 6583 4709 635 -544 341 C ATOM 3236 O3' DA E 5 19.869 9.644 30.702 1.00 36.93 O ANISOU 3236 O3' DA E 5 3927 5979 4128 676 -485 247 O ATOM 3237 C2' DA E 5 20.619 10.412 32.875 1.00 41.42 C ANISOU 3237 C2' DA E 5 4702 6383 4653 688 -535 380 C ATOM 3238 C1' DA E 5 21.361 9.314 33.618 1.00 39.43 C ANISOU 3238 C1' DA E 5 4406 6105 4470 690 -469 382 C ATOM 3239 N9 DA E 5 21.741 9.749 34.946 1.00 35.28 N ANISOU 3239 N9 DA E 5 4005 5478 3923 701 -494 459 N ATOM 3240 C8 DA E 5 22.552 10.803 35.272 1.00 33.52 C ANISOU 3240 C8 DA E 5 3889 5239 3608 654 -586 553 C ATOM 3241 N7 DA E 5 22.682 10.994 36.561 1.00 32.47 N ANISOU 3241 N7 DA E 5 3858 5003 3475 679 -589 606 N ATOM 3242 C5 DA E 5 21.872 9.995 37.113 1.00 31.94 C ANISOU 3242 C5 DA E 5 3747 4881 3509 748 -491 540 C ATOM 3243 C6 DA E 5 21.565 9.654 38.429 1.00 28.95 C ANISOU 3243 C6 DA E 5 3428 4391 3180 803 -444 550 C ATOM 3244 N6 DA E 5 22.076 10.290 39.480 1.00 30.21 N ANISOU 3244 N6 DA E 5 3710 4474 3296 796 -490 633 N ATOM 3245 N1 DA E 5 20.725 8.630 38.631 1.00 27.82 N ANISOU 3245 N1 DA E 5 3216 4220 3134 865 -348 471 N ATOM 3246 C2 DA E 5 20.239 7.969 37.578 1.00 28.65 C ANISOU 3246 C2 DA E 5 3197 4404 3284 870 -300 388 C ATOM 3247 N3 DA E 5 20.462 8.181 36.290 1.00 30.46 N ANISOU 3247 N3 DA E 5 3357 4741 3475 822 -336 369 N ATOM 3248 C4 DA E 5 21.285 9.232 36.125 1.00 32.75 C ANISOU 3248 C4 DA E 5 3722 5056 3667 762 -433 449 C ATOM 3249 H5' DA E 5 24.141 9.211 31.011 1.00 63.97 H ATOM 3250 H5'' DA E 5 23.231 9.436 29.738 1.00 63.97 H ATOM 3251 H4' DA E 5 21.853 8.347 31.089 1.00 54.77 H ATOM 3252 H3' DA E 5 21.251 11.015 31.013 1.00 50.36 H ATOM 3253 H2' DA E 5 20.927 11.285 33.163 1.00 49.70 H ATOM 3254 H2'' DA E 5 19.662 10.326 33.010 1.00 49.70 H ATOM 3255 H1' DA E 5 20.797 8.528 33.682 1.00 47.32 H ATOM 3256 H8 DA E 5 22.985 11.326 34.636 1.00 40.22 H ATOM 3257 H61 DA E 5 21.866 10.042 40.276 1.00 36.26 H ATOM 3258 H62 DA E 5 22.616 10.949 39.363 1.00 36.26 H ATOM 3259 H2 DA E 5 19.669 7.261 37.775 1.00 34.38 H ATOM 3260 P DG E 6 18.556 10.528 30.486 1.00 35.01 P ANISOU 3260 P DG E 6 3746 5705 3852 719 -515 227 P ATOM 3261 OP1 DG E 6 17.957 10.151 29.192 1.00 36.18 O ANISOU 3261 OP1 DG E 6 3777 5947 4023 718 -488 145 O ATOM 3262 OP2 DG E 6 18.829 11.953 30.758 1.00 32.22 O ANISOU 3262 OP2 DG E 6 3529 5320 3395 692 -620 315 O ATOM 3263 O5' DG E 6 17.577 10.023 31.637 1.00 35.02 O ANISOU 3263 O5' DG E 6 3785 5592 3930 805 -441 195 O ATOM 3264 C5' DG E 6 17.100 8.662 31.621 1.00 34.90 C ANISOU 3264 C5' DG E 6 3656 5580 4022 848 -333 109 C ATOM 3265 C4' DG E 6 16.440 8.330 32.924 1.00 34.97 C ANISOU 3265 C4' DG E 6 3726 5469 4090 920 -277 103 C ATOM 3266 O4' DG E 6 17.399 8.527 33.967 1.00 35.37 O ANISOU 3266 O4' DG E 6 3862 5461 4118 900 -305 184 O ATOM 3267 C3' DG E 6 15.254 9.220 33.270 1.00 37.24 C ANISOU 3267 C3' DG E 6 4114 5685 4349 972 -304 105 C ATOM 3268 O3' DG E 6 14.053 8.551 33.049 1.00 37.19 O ANISOU 3268 O3' DG E 6 4040 5673 4417 1033 -228 15 O ATOM 3269 C2' DG E 6 15.429 9.559 34.743 1.00 38.68 C ANISOU 3269 C2' DG E 6 4423 5750 4524 999 -316 171 C ATOM 3270 C1' DG E 6 16.749 8.931 35.137 1.00 36.23 C ANISOU 3270 C1' DG E 6 4083 5451 4230 956 -303 210 C ATOM 3271 N9 DG E 6 17.587 9.875 35.827 1.00 33.93 N ANISOU 3271 N9 DG E 6 3914 5116 3860 921 -383 311 N ATOM 3272 C8 DG E 6 18.394 10.831 35.268 1.00 32.26 C ANISOU 3272 C8 DG E 6 3744 4961 3553 852 -478 374 C ATOM 3273 N7 DG E 6 18.991 11.575 36.146 1.00 32.34 N ANISOU 3273 N7 DG E 6 3873 4907 3507 836 -536 461 N ATOM 3274 C5 DG E 6 18.509 11.102 37.358 1.00 33.04 C ANISOU 3274 C5 DG E 6 4004 4891 3658 899 -476 453 C ATOM 3275 C6 DG E 6 18.805 11.508 38.664 1.00 33.21 C ANISOU 3275 C6 DG E 6 4146 4811 3661 913 -497 524 C ATOM 3276 O6 DG E 6 19.587 12.400 39.024 1.00 33.52 O ANISOU 3276 O6 DG E 6 4283 4833 3622 871 -577 610 O ATOM 3277 N1 DG E 6 18.109 10.743 39.605 1.00 33.80 N ANISOU 3277 N1 DG E 6 4221 4800 3820 983 -415 485 N ATOM 3278 C2 DG E 6 17.218 9.730 39.293 1.00 35.67 C ANISOU 3278 C2 DG E 6 4356 5050 4148 1033 -324 390 C ATOM 3279 N2 DG E 6 16.617 9.098 40.314 1.00 36.68 N ANISOU 3279 N2 DG E 6 4500 5087 4350 1098 -252 364 N ATOM 3280 N3 DG E 6 16.951 9.351 38.071 1.00 34.87 N ANISOU 3280 N3 DG E 6 4142 5044 4064 1019 -304 325 N ATOM 3281 C4 DG E 6 17.632 10.069 37.165 1.00 33.46 C ANISOU 3281 C4 DG E 6 3961 4949 3805 951 -383 361 C ATOM 3282 H5' DG E 6 17.848 8.062 31.477 1.00 41.88 H ATOM 3283 H5'' DG E 6 16.459 8.555 30.900 1.00 41.88 H ATOM 3284 H4' DG E 6 16.157 7.402 32.917 1.00 41.96 H ATOM 3285 H3' DG E 6 15.284 10.030 32.738 1.00 44.68 H ATOM 3286 H2' DG E 6 15.464 10.521 34.865 1.00 46.42 H ATOM 3287 H2'' DG E 6 14.706 9.178 35.265 1.00 46.42 H ATOM 3288 H1' DG E 6 16.588 8.161 35.704 1.00 43.47 H ATOM 3289 H8 DG E 6 18.527 10.915 34.351 1.00 38.71 H ATOM 3290 H1 DG E 6 18.217 10.936 40.436 1.00 40.56 H ATOM 3291 H21 DG E 6 16.069 8.454 40.158 1.00 44.02 H ATOM 3292 H22 DG E 6 16.782 9.336 41.124 1.00 44.02 H ATOM 3293 P DC E 7 12.666 9.348 33.094 1.00 37.25 P ANISOU 3293 P DC E 7 4120 5630 4403 1089 -247 -5 P ATOM 3294 OP1 DC E 7 11.765 8.462 32.334 1.00 37.27 O ANISOU 3294 OP1 DC E 7 4000 5681 4480 1124 -170 -108 O ATOM 3295 OP2 DC E 7 12.791 10.774 32.695 1.00 36.23 O ANISOU 3295 OP2 DC E 7 4082 5519 4165 1052 -355 56 O ATOM 3296 O5' DC E 7 12.264 9.385 34.629 1.00 37.72 O ANISOU 3296 O5' DC E 7 4286 5554 4491 1149 -221 24 O ATOM 3297 C5' DC E 7 12.199 8.187 35.379 1.00 37.69 C ANISOU 3297 C5' DC E 7 4233 5503 4584 1190 -127 -14 C ATOM 3298 C4' DC E 7 11.809 8.511 36.783 1.00 39.34 C ANISOU 3298 C4' DC E 7 4564 5585 4799 1242 -124 26 C ATOM 3299 O4' DC E 7 12.913 9.185 37.442 1.00 40.37 O ANISOU 3299 O4' DC E 7 4792 5683 4864 1197 -193 124 O ATOM 3300 C3' DC E 7 10.605 9.438 36.891 1.00 40.47 C ANISOU 3300 C3' DC E 7 4793 5676 4908 1289 -155 21 C ATOM 3301 O3' DC E 7 9.684 8.884 37.813 1.00 40.94 O ANISOU 3301 O3' DC E 7 4870 5644 5042 1365 -82 -18 O ATOM 3302 C2' DC E 7 11.194 10.774 37.352 1.00 40.51 C ANISOU 3302 C2' DC E 7 4939 5642 4811 1254 -259 123 C ATOM 3303 C1' DC E 7 12.465 10.355 38.083 1.00 39.69 C ANISOU 3303 C1' DC E 7 4847 5519 4715 1219 -255 179 C ATOM 3304 N1 DC E 7 13.583 11.346 38.023 1.00 41.07 N ANISOU 3304 N1 DC E 7 5098 5716 4791 1149 -355 272 N ATOM 3305 C2 DC E 7 14.197 11.786 39.195 1.00 41.09 C ANISOU 3305 C2 DC E 7 5213 5635 4763 1145 -388 353 C ATOM 3306 O2 DC E 7 13.792 11.375 40.281 1.00 42.41 O ANISOU 3306 O2 DC E 7 5419 5709 4983 1199 -336 347 O ATOM 3307 N3 DC E 7 15.227 12.674 39.104 1.00 40.89 N ANISOU 3307 N3 DC E 7 5255 5634 4648 1079 -479 436 N ATOM 3308 C4 DC E 7 15.648 13.098 37.912 1.00 39.89 C ANISOU 3308 C4 DC E 7 5083 5609 4465 1021 -533 440 C ATOM 3309 N4 DC E 7 16.670 13.961 37.879 1.00 38.52 N ANISOU 3309 N4 DC E 7 4977 5455 4203 958 -621 523 N ATOM 3310 C5 DC E 7 15.046 12.654 36.709 1.00 40.60 C ANISOU 3310 C5 DC E 7 5056 5785 4584 1025 -500 358 C ATOM 3311 C6 DC E 7 14.030 11.789 36.802 1.00 41.69 C ANISOU 3311 C6 DC E 7 5131 5899 4811 1089 -411 276 C ATOM 3312 H5' DC E 7 13.067 7.754 35.375 1.00 45.23 H ATOM 3313 H5'' DC E 7 11.539 7.594 34.987 1.00 45.23 H ATOM 3314 H4' DC E 7 11.616 7.687 37.255 1.00 47.21 H ATOM 3315 H3' DC E 7 10.186 9.541 36.022 1.00 48.56 H ATOM 3316 H2' DC E 7 11.407 11.336 36.590 1.00 48.61 H ATOM 3317 H2'' DC E 7 10.585 11.228 37.955 1.00 48.61 H ATOM 3318 H1' DC E 7 12.256 10.157 39.009 1.00 47.63 H ATOM 3319 H41 DC E 7 16.964 14.251 37.125 1.00 46.22 H ATOM 3320 H42 DC E 7 17.034 14.224 38.613 1.00 46.22 H ATOM 3321 H5 DC E 7 15.345 12.957 35.882 1.00 48.71 H ATOM 3322 H6 DC E 7 13.622 11.479 36.026 1.00 50.03 H HETATM 3323 P C7R E 8 8.170 9.303 38.012 1.00 59.55 P ANISOU 3323 P C7R E 8 7133 8102 7390 1387 3127 343 P HETATM 3324 C5' C7R E 8 8.562 10.076 40.416 1.00 60.17 C ANISOU 3324 C5' C7R E 8 7348 8078 7436 1461 3154 386 C HETATM 3325 O5' C7R E 8 8.238 10.437 39.111 1.00 57.56 O ANISOU 3325 O5' C7R E 8 6947 7813 7113 1478 3120 364 O HETATM 3326 C4' C7R E 8 8.830 11.296 41.256 1.00 62.39 C ANISOU 3326 C4' C7R E 8 7701 8307 7696 1559 3137 411 C HETATM 3327 O4' C7R E 8 10.019 11.950 40.773 1.00 61.01 O ANISOU 3327 O4' C7R E 8 7594 8029 7556 1610 3093 449 O HETATM 3328 C3' C7R E 8 7.727 12.351 41.222 1.00 64.79 C ANISOU 3328 C3' C7R E 8 7946 8714 7957 1631 3122 382 C HETATM 3329 O3' C7R E 8 7.116 12.444 42.510 1.00 68.80 O ANISOU 3329 O3' C7R E 8 8471 9246 8425 1645 3158 376 O HETATM 3330 C2' C7R E 8 8.450 13.643 40.793 1.00 62.62 C ANISOU 3330 C2' C7R E 8 7722 8377 7695 1728 3066 409 C HETATM 3331 C1' C7R E 8 9.913 13.309 41.043 1.00 59.92 C ANISOU 3331 C1' C7R E 8 7483 7891 7393 1712 3061 458 C HETATM 3332 N1 C7R E 8 10.919 14.030 40.180 1.00 56.86 N ANISOU 3332 N1 C7R E 8 7134 7429 7040 1763 3008 489 N HETATM 3333 C2 C7R E 8 11.991 14.679 40.794 1.00 54.67 C ANISOU 3333 C2 C7R E 8 6966 7031 6776 1820 2988 537 C HETATM 3334 O2 C7R E 8 12.057 14.696 42.031 1.00 55.69 O ANISOU 3334 O2 C7R E 8 7157 7117 6885 1833 3014 551 O HETATM 3335 N3 C7R E 8 12.914 15.290 40.028 1.00 51.57 N ANISOU 3335 N3 C7R E 8 6608 6571 6416 1861 2940 568 N HETATM 3336 C4 C7R E 8 12.815 15.261 38.706 1.00 50.46 C ANISOU 3336 C4 C7R E 8 6400 6478 6293 1847 2914 552 C HETATM 3337 N4 C7R E 8 13.756 15.898 38.007 1.00 48.26 N ANISOU 3337 N4 C7R E 8 6160 6131 6045 1889 2867 586 N HETATM 3338 C5 C7R E 8 11.738 14.590 38.047 1.00 52.43 C ANISOU 3338 C5 C7R E 8 6542 6850 6529 1789 2935 502 C HETATM 3339 C6 C7R E 8 10.828 13.985 38.815 1.00 54.83 C ANISOU 3339 C6 C7R E 8 6811 7220 6803 1748 2981 473 C HETATM 3340 OP1 C7R E 8 7.488 8.127 38.671 1.00 61.13 O ANISOU 3340 OP1 C7R E 8 7298 8353 7575 1300 3179 323 O HETATM 3341 SP2 C7R E 8 7.555 10.176 36.370 1.00 61.87 S ANISOU 3341 SP2 C7R E 8 7335 8493 7680 1439 3078 312 S HETATM 3342 H5'2 C7R E 8 9.354 9.515 40.405 1.00 72.21 H HETATM 3343 H5'1 C7R E 8 7.824 9.578 40.802 1.00 72.21 H HETATM 3344 H4' C7R E 8 8.973 11.020 42.174 1.00 74.87 H HETATM 3345 H3' C7R E 8 7.062 12.109 40.559 1.00 77.75 H HETATM 3346 H2'1 C7R E 8 8.171 14.392 41.342 1.00 75.15 H HETATM 3347 H2'2 C7R E 8 8.296 13.827 39.853 1.00 75.15 H HETATM 3348 H1' C7R E 8 10.121 13.466 41.977 1.00 71.90 H HETATM 3349 H42 C7R E 8 14.394 16.305 38.416 1.00 57.91 H HETATM 3350 H41 C7R E 8 13.726 15.902 37.148 1.00 57.91 H HETATM 3351 H5 C7R E 8 11.675 14.575 37.119 1.00 62.92 H HETATM 3352 H6 C7R E 8 10.119 13.533 38.417 1.00 65.80 H ATOM 3353 P DA E 9 5.834 13.355 42.787 1.00 73.45 P ANISOU 3353 P DA E 9 8999 9943 8964 1709 3159 343 P ATOM 3354 OP1 DA E 9 4.905 12.557 43.626 1.00 76.45 O ANISOU 3354 OP1 DA E 9 9338 10394 9314 1651 3215 318 O ATOM 3355 OP2 DA E 9 5.369 13.967 41.513 1.00 73.45 O ANISOU 3355 OP2 DA E 9 8922 10015 8970 1742 3119 319 O ATOM 3356 O5' DA E 9 6.455 14.533 43.683 1.00 71.26 O ANISOU 3356 O5' DA E 9 8826 9578 8672 1810 3136 378 O ATOM 3357 C5' DA E 9 7.452 14.240 44.664 1.00 67.99 C ANISOU 3357 C5' DA E 9 8521 9044 8266 1802 3152 418 C ATOM 3358 C4' DA E 9 8.114 15.515 45.141 1.00 65.68 C ANISOU 3358 C4' DA E 9 8321 8669 7964 1906 3115 451 C ATOM 3359 O4' DA E 9 9.148 15.926 44.191 1.00 63.28 O ANISOU 3359 O4' DA E 9 8049 8290 7703 1932 3064 480 O ATOM 3360 C3' DA E 9 7.166 16.708 45.267 1.00 66.56 C ANISOU 3360 C3' DA E 9 8397 8861 8033 1993 3095 428 C ATOM 3361 O3' DA E 9 7.438 17.395 46.447 1.00 68.22 O ANISOU 3361 O3' DA E 9 8698 9009 8214 2059 3097 451 O ATOM 3362 C2' DA E 9 7.472 17.544 44.021 1.00 64.04 C ANISOU 3362 C2' DA E 9 8053 8541 7737 2043 3034 432 C ATOM 3363 C1' DA E 9 8.958 17.279 43.829 1.00 60.59 C ANISOU 3363 C1' DA E 9 7704 7972 7347 2028 3014 479 C ATOM 3364 N9 DA E 9 9.458 17.475 42.466 1.00 54.88 N ANISOU 3364 N9 DA E 9 6953 7239 6662 2030 2969 486 N ATOM 3365 C8 DA E 9 8.888 17.051 41.291 1.00 53.89 C ANISOU 3365 C8 DA E 9 6727 7201 6549 1984 2965 453 C ATOM 3366 N7 DA E 9 9.598 17.354 40.214 1.00 51.89 N ANISOU 3366 N7 DA E 9 6476 6910 6330 1998 2921 471 N ATOM 3367 C5 DA E 9 10.711 18.009 40.725 1.00 49.51 C ANISOU 3367 C5 DA E 9 6283 6488 6041 2054 2893 519 C ATOM 3368 C6 DA E 9 11.846 18.598 40.114 1.00 46.09 C ANISOU 3368 C6 DA E 9 5905 5964 5642 2093 2843 560 C ATOM 3369 N6 DA E 9 12.058 18.615 38.796 1.00 44.84 N ANISOU 3369 N6 DA E 9 5700 5825 5512 2081 2811 557 N ATOM 3370 N1 DA E 9 12.761 19.177 40.921 1.00 45.92 N ANISOU 3370 N1 DA E 9 5991 5832 5624 2145 2825 604 N ATOM 3371 C2 DA E 9 12.549 19.174 42.247 1.00 47.00 C ANISOU 3371 C2 DA E 9 6179 5949 5730 2159 2857 607 C ATOM 3372 N3 DA E 9 11.525 18.662 42.933 1.00 48.27 N ANISOU 3372 N3 DA E 9 6298 6188 5856 2128 2907 571 N ATOM 3373 C4 DA E 9 10.631 18.096 42.111 1.00 50.64 C ANISOU 3373 C4 DA E 9 6488 6599 6155 2075 2922 528 C ATOM 3374 H5' DA E 9 8.122 13.657 44.275 1.00 81.58 H ATOM 3375 H5'' DA E 9 7.037 13.793 45.418 1.00 81.58 H ATOM 3376 H4' DA E 9 8.527 15.350 46.003 1.00 78.81 H ATOM 3377 H3' DA E 9 6.244 16.409 45.254 1.00 79.88 H ATOM 3378 H2' DA E 9 6.962 17.227 43.259 1.00 76.84 H ATOM 3379 H2'' DA E 9 7.306 18.485 44.186 1.00 76.84 H ATOM 3380 H1' DA E 9 9.462 17.843 44.436 1.00 72.71 H ATOM 3381 H8 DA E 9 8.081 16.592 41.254 1.00 64.67 H ATOM 3382 H61 DA E 9 12.765 18.988 38.478 1.00 53.81 H ATOM 3383 H62 DA E 9 11.488 18.252 38.264 1.00 53.81 H ATOM 3384 H2 DA E 9 13.209 19.584 42.759 1.00 56.40 H ATOM 3385 P DT E 10 6.539 18.633 46.901 1.00 71.57 P ANISOU 3385 P DT E 10 9107 9497 8589 2154 3082 432 P ATOM 3386 OP1 DT E 10 6.487 18.501 48.373 1.00 73.03 O ANISOU 3386 OP1 DT E 10 9362 9647 8737 2162 3123 441 O ATOM 3387 OP2 DT E 10 5.291 18.670 46.099 1.00 71.43 O ANISOU 3387 OP2 DT E 10 8962 9617 8560 2141 3084 384 O ATOM 3388 O5' DT E 10 7.411 19.910 46.496 1.00 71.60 O ANISOU 3388 O5' DT E 10 9178 9421 8605 2248 3013 465 O ATOM 3389 C5' DT E 10 8.779 19.969 46.851 1.00 70.13 C ANISOU 3389 C5' DT E 10 9106 9095 8444 2262 2995 515 C ATOM 3390 C4' DT E 10 9.496 21.087 46.105 1.00 67.71 C ANISOU 3390 C4' DT E 10 8834 8736 8157 2336 2923 541 C ATOM 3391 O4' DT E 10 9.701 20.725 44.722 1.00 63.48 O ANISOU 3391 O4' DT E 10 8232 8223 7664 2292 2901 535 O ATOM 3392 C3' DT E 10 8.751 22.418 46.057 1.00 69.88 C ANISOU 3392 C3' DT E 10 9084 9073 8395 2429 2885 523 C ATOM 3393 O3' DT E 10 9.314 23.306 46.994 1.00 74.64 O ANISOU 3393 O3' DT E 10 9795 9590 8975 2506 2860 555 O ATOM 3394 C2' DT E 10 8.918 22.912 44.604 1.00 65.62 C ANISOU 3394 C2' DT E 10 8491 8556 7886 2444 2829 522 C ATOM 3395 C1' DT E 10 9.898 21.917 44.003 1.00 60.06 C ANISOU 3395 C1' DT E 10 7800 7784 7234 2368 2836 546 C ATOM 3396 N1 DT E 10 9.698 21.642 42.560 1.00 52.92 N ANISOU 3396 N1 DT E 10 6805 6942 6359 2330 2818 526 N ATOM 3397 C2 DT E 10 10.671 22.018 41.673 1.00 50.87 C ANISOU 3397 C2 DT E 10 6574 6617 6138 2346 2767 558 C ATOM 3398 O2 DT E 10 11.689 22.594 42.013 1.00 51.20 O ANISOU 3398 O2 DT E 10 6709 6552 6191 2391 2734 601 O ATOM 3399 N3 DT E 10 10.417 21.695 40.363 1.00 48.06 N ANISOU 3399 N3 DT E 10 6132 6323 5805 2308 2756 536 N ATOM 3400 C4 DT E 10 9.301 21.052 39.868 1.00 46.84 C ANISOU 3400 C4 DT E 10 5870 6287 5641 2255 2788 488 C ATOM 3401 O4 DT E 10 9.153 20.815 38.671 1.00 46.03 O ANISOU 3401 O4 DT E 10 5698 6231 5559 2224 2773 471 O ATOM 3402 C5 DT E 10 8.315 20.686 40.862 1.00 48.22 C ANISOU 3402 C5 DT E 10 6019 6526 5778 2238 2840 457 C ATOM 3403 C7 DT E 10 7.059 19.985 40.450 1.00 48.18 C ANISOU 3403 C7 DT E 10 5898 6649 5760 2179 2877 406 C ATOM 3404 C6 DT E 10 8.559 20.997 42.143 1.00 50.30 C ANISOU 3404 C6 DT E 10 6364 6730 6017 2276 2853 478 C ATOM 3405 H5' DT E 10 9.200 19.123 46.636 1.00 84.15 H ATOM 3406 H5'' DT E 10 8.853 20.127 47.806 1.00 84.15 H ATOM 3407 H4' DT E 10 10.361 21.231 46.519 1.00 81.25 H ATOM 3408 H3' DT E 10 7.811 22.278 46.254 1.00 83.86 H ATOM 3409 H2' DT E 10 8.070 22.883 44.134 1.00 78.75 H ATOM 3410 H2'' DT E 10 9.289 23.809 44.589 1.00 78.75 H ATOM 3411 H1' DT E 10 10.804 22.232 44.147 1.00 72.07 H ATOM 3412 H3 DT E 10 11.012 21.930 39.787 1.00 57.67 H ATOM 3413 H71 DT E 10 7.008 19.125 40.895 1.00 57.82 H ATOM 3414 H72 DT E 10 6.292 20.524 40.700 1.00 57.82 H ATOM 3415 H73 DT E 10 7.063 19.853 39.490 1.00 57.82 H ATOM 3416 H6 DT E 10 7.931 20.752 42.784 1.00 60.36 H ATOM 3417 P DT E 11 8.722 24.786 47.170 1.00 77.53 P ANISOU 3417 P DT E 11 10163 9995 9298 2613 2816 544 P ATOM 3418 OP1 DT E 11 8.860 25.102 48.615 1.00 78.60 O ANISOU 3418 OP1 DT E 11 10396 10073 9394 2657 2833 560 O ATOM 3419 OP2 DT E 11 7.399 24.825 46.499 1.00 79.65 O ANISOU 3419 OP2 DT E 11 10306 10404 9553 2604 2827 494 O ATOM 3420 O5' DT E 11 9.722 25.704 46.312 1.00 73.96 O ANISOU 3420 O5' DT E 11 9754 9470 8878 2663 2737 580 O ATOM 3421 C5' DT E 11 11.091 25.321 46.191 1.00 70.50 C ANISOU 3421 C5' DT E 11 9392 8912 8482 2634 2722 626 C ATOM 3422 C4' DT E 11 11.835 26.212 45.219 1.00 67.35 C ANISOU 3422 C4' DT E 11 9009 8469 8112 2676 2645 653 C ATOM 3423 O4' DT E 11 11.683 25.714 43.853 1.00 65.62 O ANISOU 3423 O4' DT E 11 8696 8308 7929 2624 2642 636 O ATOM 3424 C3' DT E 11 11.370 27.661 45.176 1.00 67.38 C ANISOU 3424 C3' DT E 11 9012 8508 8080 2770 2589 645 C ATOM 3425 O3' DT E 11 12.511 28.491 45.017 1.00 69.86 O ANISOU 3425 O3' DT E 11 9410 8721 8414 2812 2520 691 O ATOM 3426 C2' DT E 11 10.432 27.686 43.958 1.00 64.98 C ANISOU 3426 C2' DT E 11 8582 8324 7783 2756 2584 605 C ATOM 3427 C1' DT E 11 11.158 26.740 43.016 1.00 61.38 C ANISOU 3427 C1' DT E 11 8102 7837 7381 2679 2590 620 C ATOM 3428 N1 DT E 11 10.320 26.080 41.932 1.00 53.10 N ANISOU 3428 N1 DT E 11 6930 6899 6346 2622 2614 578 N ATOM 3429 C2 DT E 11 10.857 25.971 40.677 1.00 47.67 C ANISOU 3429 C2 DT E 11 6213 6201 5699 2597 2582 590 C ATOM 3430 O2 DT E 11 11.942 26.424 40.386 1.00 46.65 O ANISOU 3430 O2 DT E 11 6147 5982 5595 2619 2534 631 O ATOM 3431 N3 DT E 11 10.081 25.322 39.762 1.00 46.06 N ANISOU 3431 N3 DT E 11 5901 6096 5504 2543 2605 551 N ATOM 3432 C4 DT E 11 8.849 24.764 39.966 1.00 46.77 C ANISOU 3432 C4 DT E 11 5910 6291 5569 2509 2655 503 C ATOM 3433 O4 DT E 11 8.232 24.208 39.062 1.00 46.77 O ANISOU 3433 O4 DT E 11 5817 6374 5580 2459 2670 471 O ATOM 3434 C5 DT E 11 8.325 24.898 41.320 1.00 47.80 C ANISOU 3434 C5 DT E 11 6074 6430 5659 2536 2689 494 C ATOM 3435 C7 DT E 11 6.976 24.333 41.674 1.00 47.98 C ANISOU 3435 C7 DT E 11 6012 6567 5652 2500 2746 445 C ATOM 3436 C6 DT E 11 9.085 25.538 42.230 1.00 50.32 C ANISOU 3436 C6 DT E 11 6501 6653 5967 2592 2668 532 C ATOM 3437 H5' DT E 11 11.136 24.404 45.878 1.00 84.60 H ATOM 3438 H5'' DT E 11 11.514 25.379 47.062 1.00 84.60 H ATOM 3439 H4' DT E 11 12.777 26.198 45.449 1.00 80.82 H ATOM 3440 H3' DT E 11 10.888 27.890 45.986 1.00 80.85 H ATOM 3441 H2' DT E 11 9.554 27.344 44.188 1.00 77.97 H ATOM 3442 H2'' DT E 11 10.375 28.578 43.580 1.00 77.97 H ATOM 3443 H1' DT E 11 11.894 27.214 42.599 1.00 73.65 H ATOM 3444 H3 DT E 11 10.401 25.259 38.966 1.00 55.27 H ATOM 3445 H71 DT E 11 6.586 23.913 40.892 1.00 57.58 H ATOM 3446 H72 DT E 11 7.076 23.674 42.379 1.00 57.58 H ATOM 3447 H73 DT E 11 6.396 25.048 41.980 1.00 57.58 H ATOM 3448 H6 DT E 11 8.766 25.615 43.100 1.00 60.39 H ATOM 3449 P DA E 12 12.524 30.017 45.513 1.00 70.22 P ANISOU 3449 P DA E 12 9817 8565 8298 2296 -253 305 P ATOM 3450 OP1 DA E 12 13.859 30.238 46.122 1.00 72.80 O ANISOU 3450 OP1 DA E 12 10190 8900 8570 2196 -326 277 O ATOM 3451 OP2 DA E 12 11.267 30.343 46.236 1.00 71.35 O ANISOU 3451 OP2 DA E 12 10109 8513 8488 2342 -161 331 O ATOM 3452 O5' DA E 12 12.453 30.841 44.148 1.00 71.51 O ANISOU 3452 O5' DA E 12 9867 8841 8461 2280 -226 390 O ATOM 3453 C5' DA E 12 13.410 30.601 43.122 1.00 70.43 C ANISOU 3453 C5' DA E 12 9560 8910 8290 2251 -297 382 C ATOM 3454 C4' DA E 12 12.922 31.182 41.819 1.00 69.02 C ANISOU 3454 C4' DA E 12 9275 8822 8129 2271 -252 459 C ATOM 3455 O4' DA E 12 12.018 30.233 41.165 1.00 65.77 O ANISOU 3455 O4' DA E 12 8752 8478 7759 2383 -232 436 O ATOM 3456 C3' DA E 12 12.099 32.465 41.969 1.00 70.81 C ANISOU 3456 C3' DA E 12 9624 8899 8380 2251 -156 548 C ATOM 3457 O3' DA E 12 12.276 33.293 40.862 1.00 73.93 O ANISOU 3457 O3' DA E 12 9931 9395 8765 2215 -143 622 O ATOM 3458 C2' DA E 12 10.690 31.916 41.988 1.00 67.88 C ANISOU 3458 C2' DA E 12 9266 8456 8068 2362 -88 542 C ATOM 3459 C1' DA E 12 10.826 30.921 40.857 1.00 63.72 C ANISOU 3459 C1' DA E 12 8536 8133 7544 2423 -136 508 C ATOM 3460 N9 DA E 12 9.714 29.992 40.692 1.00 58.19 N ANISOU 3460 N9 DA E 12 7792 7425 6893 2539 -101 478 N ATOM 3461 C8 DA E 12 8.759 29.655 41.610 1.00 56.25 C ANISOU 3461 C8 DA E 12 7668 7019 6687 2598 -50 454 C ATOM 3462 N7 DA E 12 7.861 28.813 41.153 1.00 54.00 N ANISOU 3462 N7 DA E 12 7302 6772 6443 2702 -26 432 N ATOM 3463 C5 DA E 12 8.259 28.581 39.845 1.00 52.74 C ANISOU 3463 C5 DA E 12 6956 6812 6270 2710 -65 443 C ATOM 3464 C6 DA E 12 7.732 27.774 38.812 1.00 50.16 C ANISOU 3464 C6 DA E 12 6469 6618 5970 2798 -65 431 C ATOM 3465 N6 DA E 12 6.635 27.012 38.947 1.00 48.35 N ANISOU 3465 N6 DA E 12 6244 6338 5790 2900 -23 403 N ATOM 3466 N1 DA E 12 8.364 27.802 37.619 1.00 50.17 N ANISOU 3466 N1 DA E 12 6307 6807 5946 2777 -108 450 N ATOM 3467 C2 DA E 12 9.457 28.560 37.480 1.00 51.51 C ANISOU 3467 C2 DA E 12 6474 7030 6068 2676 -149 478 C ATOM 3468 N3 DA E 12 10.049 29.343 38.370 1.00 53.07 N ANISOU 3468 N3 DA E 12 6810 7118 6237 2587 -154 491 N ATOM 3469 C4 DA E 12 9.393 29.309 39.545 1.00 54.77 C ANISOU 3469 C4 DA E 12 7186 7146 6477 2610 -110 472 C ATOM 3470 H5' DA E 12 13.539 29.645 43.019 1.00 84.51 H ATOM 3471 H5'' DA E 12 14.253 31.015 43.364 1.00 84.51 H ATOM 3472 H4' DA E 12 13.681 31.354 41.240 1.00 82.83 H ATOM 3473 H3' DA E 12 12.309 32.925 42.797 1.00 84.97 H ATOM 3474 H2' DA E 12 10.492 31.473 42.828 1.00 81.45 H ATOM 3475 H2'' DA E 12 10.038 32.604 41.780 1.00 81.45 H ATOM 3476 H1' DA E 12 10.952 31.407 40.027 1.00 76.47 H ATOM 3477 H8 DA E 12 8.750 29.987 42.479 1.00 67.51 H ATOM 3478 H61 DA E 12 6.345 26.553 38.279 1.00 58.02 H ATOM 3479 H62 DA E 12 6.221 26.984 39.700 1.00 58.02 H ATOM 3480 H2 DA E 12 9.861 28.530 36.643 1.00 61.82 H ATOM 3481 P DG E 13 13.219 34.585 40.895 1.00 77.55 P ANISOU 3481 P DG E 13 10444 9844 9178 2093 -155 680 P ATOM 3482 OP1 DG E 13 14.551 34.174 41.416 1.00 74.78 O ANISOU 3482 OP1 DG E 13 10089 9548 8776 2027 -249 616 O ATOM 3483 OP2 DG E 13 12.440 35.681 41.528 1.00 76.40 O ANISOU 3483 OP2 DG E 13 10467 9504 9057 2073 -66 745 O ATOM 3484 O5' DG E 13 13.356 34.907 39.333 1.00 79.12 O ANISOU 3484 O5' DG E 13 10469 10223 9371 2092 -159 737 O ATOM 3485 C5' DG E 13 13.859 33.884 38.465 1.00 78.75 C ANISOU 3485 C5' DG E 13 10236 10374 9310 2128 -229 687 C ATOM 3486 C4' DG E 13 13.283 33.987 37.061 1.00 77.45 C ANISOU 3486 C4' DG E 13 9925 10332 9168 2178 -196 740 C ATOM 3487 O4' DG E 13 12.150 33.082 36.912 1.00 73.75 O ANISOU 3487 O4' DG E 13 9419 9853 8751 2293 -159 712 O ATOM 3488 C3' DG E 13 12.751 35.353 36.667 1.00 78.31 C ANISOU 3488 C3' DG E 13 10088 10374 9291 2145 -118 843 C ATOM 3489 O3' DG E 13 12.977 35.551 35.289 1.00 81.01 O ANISOU 3489 O3' DG E 13 10269 10889 9624 2142 -130 886 O ATOM 3490 C2' DG E 13 11.271 35.250 37.013 1.00 73.99 C ANISOU 3490 C2' DG E 13 9623 9686 8803 2233 -30 857 C ATOM 3491 C1' DG E 13 10.983 33.823 36.585 1.00 69.71 C ANISOU 3491 C1' DG E 13 8949 9256 8281 2329 -64 788 C ATOM 3492 N9 DG E 13 9.839 33.182 37.238 1.00 59.60 N ANISOU 3492 N9 DG E 13 7744 7851 7050 2420 -13 755 N ATOM 3493 C8 DG E 13 9.468 33.261 38.557 1.00 55.20 C ANISOU 3493 C8 DG E 13 7364 7103 6507 2418 18 734 C ATOM 3494 N7 DG E 13 8.409 32.543 38.839 1.00 51.14 N ANISOU 3494 N7 DG E 13 6872 6520 6039 2513 59 704 N ATOM 3495 C5 DG E 13 8.081 31.929 37.633 1.00 48.66 C ANISOU 3495 C5 DG E 13 6383 6362 5742 2582 52 704 C ATOM 3496 C6 DG E 13 7.037 31.029 37.315 1.00 47.40 C ANISOU 3496 C6 DG E 13 6161 6217 5629 2695 83 678 C ATOM 3497 O6 DG E 13 6.155 30.576 38.063 1.00 46.98 O ANISOU 3497 O6 DG E 13 6199 6037 5615 2759 125 649 O ATOM 3498 N1 DG E 13 7.067 30.666 35.965 1.00 47.24 N ANISOU 3498 N1 DG E 13 5954 6384 5611 2732 62 690 N ATOM 3499 C2 DG E 13 8.000 31.109 35.043 1.00 47.66 C ANISOU 3499 C2 DG E 13 5895 6591 5625 2668 17 722 C ATOM 3500 N2 DG E 13 7.886 30.648 33.780 1.00 47.43 N ANISOU 3500 N2 DG E 13 5687 6733 5602 2717 2 728 N ATOM 3501 N3 DG E 13 8.973 31.946 35.337 1.00 48.70 N ANISOU 3501 N3 DG E 13 6084 6709 5712 2563 -12 746 N ATOM 3502 C4 DG E 13 8.952 32.316 36.643 1.00 51.80 C ANISOU 3502 C4 DG E 13 6658 6921 6103 2526 8 735 C ATOM 3503 H5' DG E 13 13.631 33.017 38.836 1.00 94.50 H ATOM 3504 H5'' DG E 13 14.825 33.960 38.416 1.00 94.50 H ATOM 3505 H4' DG E 13 13.970 33.729 36.426 1.00 92.93 H ATOM 3506 H3' DG E 13 13.178 36.050 37.190 1.00 93.97 H ATOM 3507 H2' DG E 13 11.126 35.365 37.965 1.00 88.78 H ATOM 3508 H2'' DG E 13 10.747 35.882 36.497 1.00 88.78 H ATOM 3509 H1' DG E 13 10.852 33.801 35.624 1.00 83.65 H ATOM 3510 H8 DG E 13 9.911 33.788 39.183 1.00 66.24 H ATOM 3511 H1 DG E 13 6.463 30.120 35.687 1.00 56.69 H ATOM 3512 H21 DG E 13 8.446 30.902 33.178 1.00 56.92 H ATOM 3513 H22 DG E 13 7.255 30.101 33.576 1.00 56.92 H ATOM 3514 P DA E 14 12.850 37.006 34.638 1.00 84.36 P ANISOU 3514 P DA E 14 10708 11301 10045 2085 -75 993 P ATOM 3515 OP1 DA E 14 14.172 37.340 34.062 1.00 86.29 O ANISOU 3515 OP1 DA E 14 10862 11690 10235 1998 -146 1001 O ATOM 3516 OP2 DA E 14 12.185 37.892 35.634 1.00 85.08 O ANISOU 3516 OP2 DA E 14 10995 11173 10158 2064 1 1034 O ATOM 3517 O5' DA E 14 11.821 36.799 33.437 1.00 80.21 O ANISOU 3517 O5' DA E 14 10057 10859 9562 2174 -25 1032 O ATOM 3518 C5' DA E 14 11.654 35.528 32.825 1.00 74.64 C ANISOU 3518 C5' DA E 14 9203 10287 8869 2258 -62 973 C ATOM 3519 C4' DA E 14 10.295 35.446 32.153 1.00 69.79 C ANISOU 3519 C4' DA E 14 8545 9663 8310 2353 14 1013 C ATOM 3520 O4' DA E 14 9.364 34.741 33.020 1.00 64.19 O ANISOU 3520 O4' DA E 14 7926 8822 7643 2431 50 966 O ATOM 3521 C3' DA E 14 9.652 36.807 31.857 1.00 71.28 C ANISOU 3521 C3' DA E 14 8801 9764 8517 2326 99 1116 C ATOM 3522 O3' DA E 14 9.255 36.891 30.514 1.00 78.13 O ANISOU 3522 O3' DA E 14 9525 10762 9400 2364 119 1164 O ATOM 3523 C2' DA E 14 8.465 36.881 32.815 1.00 65.08 C ANISOU 3523 C2' DA E 14 8174 8774 7780 2378 178 1120 C ATOM 3524 C1' DA E 14 8.131 35.418 33.037 1.00 59.44 C ANISOU 3524 C1' DA E 14 7405 8091 7086 2469 148 1032 C ATOM 3525 N9 DA E 14 7.463 35.148 34.299 1.00 52.22 N ANISOU 3525 N9 DA E 14 6648 6992 6201 2504 185 996 N ATOM 3526 C8 DA E 14 7.738 35.717 35.510 1.00 50.76 C ANISOU 3526 C8 DA E 14 6637 6647 6002 2441 194 994 C ATOM 3527 N7 DA E 14 6.980 35.287 36.486 1.00 49.28 N ANISOU 3527 N7 DA E 14 6565 6312 5847 2493 230 958 N ATOM 3528 C5 DA E 14 6.146 34.366 35.877 1.00 48.66 C ANISOU 3528 C5 DA E 14 6381 6300 5808 2599 246 934 C ATOM 3529 C6 DA E 14 5.105 33.560 36.376 1.00 48.05 C ANISOU 3529 C6 DA E 14 6347 6133 5778 2694 284 893 C ATOM 3530 N6 DA E 14 4.728 33.565 37.660 1.00 47.97 N ANISOU 3530 N6 DA E 14 6504 5940 5782 2697 314 868 N ATOM 3531 N1 DA E 14 4.464 32.758 35.501 1.00 47.54 N ANISOU 3531 N1 DA E 14 6145 6174 5743 2786 290 880 N ATOM 3532 C2 DA E 14 4.850 32.762 34.213 1.00 47.63 C ANISOU 3532 C2 DA E 14 5990 6370 5739 2782 261 905 C ATOM 3533 N3 DA E 14 5.811 33.477 33.624 1.00 48.19 N ANISOU 3533 N3 DA E 14 6003 6540 5766 2697 224 945 N ATOM 3534 C4 DA E 14 6.427 34.268 34.523 1.00 48.69 C ANISOU 3534 C4 DA E 14 6206 6493 5800 2607 219 958 C ATOM 3535 H5' DA E 14 11.720 34.835 33.500 1.00 89.57 H ATOM 3536 H5'' DA E 14 12.349 35.398 32.161 1.00 89.57 H ATOM 3537 H4' DA E 14 10.385 34.954 31.322 1.00 83.75 H ATOM 3538 H3' DA E 14 10.281 37.518 32.058 1.00 85.53 H ATOM 3539 H2' DA E 14 8.721 37.306 33.649 1.00 78.09 H ATOM 3540 H2'' DA E 14 7.719 37.346 32.404 1.00 78.09 H ATOM 3541 H1' DA E 14 7.579 35.100 32.305 1.00 71.32 H ATOM 3542 H8 DA E 14 8.408 36.351 35.631 1.00 60.91 H ATOM 3543 H61 DA E 14 4.083 33.059 37.920 1.00 57.56 H ATOM 3544 H62 DA E 14 5.131 34.073 38.224 1.00 57.56 H ATOM 3545 H2 DA E 14 4.378 32.189 33.652 1.00 57.16 H ATOM 3546 P DG E 15 9.035 38.338 29.856 1.00 84.00 P ANISOU 3546 P DG E 15 10285 11487 10144 2313 179 1274 P ATOM 3547 OP1 DG E 15 10.227 38.607 29.019 1.00 87.45 O ANISOU 3547 OP1 DG E 15 10601 12096 10531 2241 113 1288 O ATOM 3548 OP2 DG E 15 8.644 39.284 30.934 1.00 85.04 O ANISOU 3548 OP2 DG E 15 10617 11406 10287 2272 241 1311 O ATOM 3549 O5' DG E 15 7.749 38.136 28.950 1.00 82.24 O ANISOU 3549 O5' DG E 15 9979 11295 9973 2413 245 1311 O ATOM 3550 C5' DG E 15 6.510 38.005 29.567 1.00 79.28 C ANISOU 3550 C5' DG E 15 9708 10763 9650 2484 318 1312 C ATOM 3551 C4' DG E 15 5.753 36.825 29.010 1.00 75.09 C ANISOU 3551 C4' DG E 15 9062 10314 9156 2597 320 1269 C ATOM 3552 O4' DG E 15 5.462 35.895 30.084 1.00 71.31 O ANISOU 3552 O4' DG E 15 8664 9737 8695 2646 311 1190 O ATOM 3553 C3' DG E 15 4.399 37.181 28.435 1.00 74.95 C ANISOU 3553 C3' DG E 15 9037 10249 9191 2667 410 1333 C ATOM 3554 O3' DG E 15 3.958 36.193 27.493 1.00 76.81 O ANISOU 3554 O3' DG E 15 9112 10624 9449 2757 397 1306 O ATOM 3555 C2' DG E 15 3.540 37.229 29.692 1.00 71.37 C ANISOU 3555 C2' DG E 15 8765 9579 8774 2698 470 1321 C ATOM 3556 C1' DG E 15 4.122 36.089 30.527 1.00 66.71 C ANISOU 3556 C1' DG E 15 8187 8993 8166 2709 400 1218 C ATOM 3557 N9 DG E 15 4.123 36.338 31.973 1.00 57.41 N ANISOU 3557 N9 DG E 15 7200 7625 6988 2676 416 1195 N ATOM 3558 C8 DG E 15 4.942 37.185 32.692 1.00 54.06 C ANISOU 3558 C8 DG E 15 6889 7124 6526 2573 400 1212 C ATOM 3559 N7 DG E 15 4.697 37.181 33.976 1.00 50.45 N ANISOU 3559 N7 DG E 15 6596 6494 6080 2569 422 1183 N ATOM 3560 C5 DG E 15 3.651 36.273 34.111 1.00 48.92 C ANISOU 3560 C5 DG E 15 6393 6260 5933 2675 454 1145 C ATOM 3561 C6 DG E 15 2.957 35.847 35.263 1.00 48.56 C ANISOU 3561 C6 DG E 15 6482 6049 5918 2721 488 1103 C ATOM 3562 O6 DG E 15 3.144 36.189 36.436 1.00 48.76 O ANISOU 3562 O6 DG E 15 6665 5926 5934 2675 495 1090 O ATOM 3563 N1 DG E 15 1.962 34.920 34.953 1.00 47.90 N ANISOU 3563 N1 DG E 15 6335 5985 5881 2832 514 1074 N ATOM 3564 C2 DG E 15 1.682 34.463 33.682 1.00 47.63 C ANISOU 3564 C2 DG E 15 6127 6111 5861 2891 508 1085 C ATOM 3565 N2 DG E 15 0.700 33.553 33.565 1.00 46.99 N ANISOU 3565 N2 DG E 15 6005 6025 5824 2997 536 1052 N ATOM 3566 N3 DG E 15 2.324 34.860 32.602 1.00 47.97 N ANISOU 3566 N3 DG E 15 6043 6308 5874 2848 477 1125 N ATOM 3567 C4 DG E 15 3.293 35.752 32.889 1.00 50.56 C ANISOU 3567 C4 DG E 15 6432 6621 6158 2741 451 1152 C ATOM 3568 H5' DG E 15 5.993 38.812 29.420 1.00 95.13 H ATOM 3569 H5'' DG E 15 6.640 37.879 30.520 1.00 95.13 H ATOM 3570 H4' DG E 15 6.289 36.383 28.333 1.00 90.11 H ATOM 3571 H3' DG E 15 4.431 38.056 28.017 1.00 89.94 H ATOM 3572 HO3' DG E 15 3.241 35.775 27.627 1.00 92.18 H ATOM 3573 H2' DG E 15 3.644 38.078 30.149 1.00 85.64 H ATOM 3574 H2'' DG E 15 2.609 37.060 29.480 1.00 85.64 H ATOM 3575 H1' DG E 15 3.615 35.281 30.350 1.00 80.05 H ATOM 3576 H8 DG E 15 5.605 37.707 32.301 1.00 64.87 H ATOM 3577 H1 DG E 15 1.495 34.605 35.603 1.00 57.48 H ATOM 3578 H21 DG E 15 0.497 33.236 32.792 1.00 56.39 H ATOM 3579 H22 DG E 15 0.275 33.287 34.264 1.00 56.39 H TER 3580 DG E 15 ATOM 3581 O5' DT F 1 -3.723 37.046 43.193 1.00 52.38 O ANISOU 3581 O5' DT F 1 5277 5455 9169 534 967 -1172 O ATOM 3582 C5' DT F 1 -5.150 37.010 42.991 1.00 49.77 C ANISOU 3582 C5' DT F 1 4899 5205 8809 494 1017 -1256 C ATOM 3583 C4' DT F 1 -5.511 36.108 41.819 1.00 49.22 C ANISOU 3583 C4' DT F 1 4779 5143 8781 499 1035 -1324 C ATOM 3584 O4' DT F 1 -4.841 36.582 40.607 1.00 48.70 O ANISOU 3584 O4' DT F 1 4663 5098 8743 595 1007 -1333 O ATOM 3585 C3' DT F 1 -5.084 34.645 41.977 1.00 49.71 C ANISOU 3585 C3' DT F 1 4886 5108 8894 448 1033 -1299 C ATOM 3586 O3' DT F 1 -6.052 33.779 41.345 1.00 50.14 O ANISOU 3586 O3' DT F 1 4899 5189 8963 410 1073 -1379 O ATOM 3587 C2' DT F 1 -3.717 34.640 41.296 1.00 49.30 C ANISOU 3587 C2' DT F 1 4839 5003 8891 524 984 -1253 C ATOM 3588 C1' DT F 1 -3.968 35.584 40.114 1.00 48.81 C ANISOU 3588 C1' DT F 1 4694 5031 8818 607 984 -1309 C ATOM 3589 N1 DT F 1 -2.756 36.257 39.567 1.00 48.20 N ANISOU 3589 N1 DT F 1 4612 4939 8764 698 936 -1263 N ATOM 3590 C2 DT F 1 -2.488 36.195 38.205 1.00 47.94 C ANISOU 3590 C2 DT F 1 4521 4927 8768 767 926 -1301 C ATOM 3591 O2 DT F 1 -3.186 35.599 37.404 1.00 48.19 O ANISOU 3591 O2 DT F 1 4505 4989 8816 756 954 -1372 O ATOM 3592 N3 DT F 1 -1.355 36.856 37.819 1.00 47.39 N ANISOU 3592 N3 DT F 1 4450 4840 8715 848 880 -1252 N ATOM 3593 C4 DT F 1 -0.488 37.565 38.633 1.00 47.07 C ANISOU 3593 C4 DT F 1 4460 4765 8659 868 845 -1172 C ATOM 3594 O4 DT F 1 0.503 38.123 38.200 1.00 46.58 O ANISOU 3594 O4 DT F 1 4393 4690 8614 942 806 -1133 O ATOM 3595 C5 DT F 1 -0.827 37.596 40.033 1.00 47.36 C ANISOU 3595 C5 DT F 1 4556 4782 8657 794 858 -1136 C ATOM 3596 C7 DT F 1 0.050 38.332 41.001 1.00 47.06 C ANISOU 3596 C7 DT F 1 4575 4705 8599 808 822 -1049 C ATOM 3597 C6 DT F 1 -1.934 36.953 40.429 1.00 47.90 C ANISOU 3597 C6 DT F 1 4626 4867 8709 714 902 -1183 C ATOM 3598 H5' DT F 1 -5.469 37.909 42.811 1.00 59.73 H ATOM 3599 H5'' DT F 1 -5.577 36.675 43.794 1.00 59.73 H ATOM 3600 H4' DT F 1 -6.470 36.142 41.682 1.00 59.07 H ATOM 3601 H3' DT F 1 -4.993 34.421 42.916 1.00 59.65 H ATOM 3602 H2' DT F 1 -3.034 34.996 41.886 1.00 59.17 H ATOM 3603 H2'' DT F 1 -3.486 33.750 40.987 1.00 59.17 H ATOM 3604 H1' DT F 1 -4.411 35.095 39.403 1.00 58.57 H ATOM 3605 H3 DT F 1 -1.162 36.830 36.982 1.00 56.87 H ATOM 3606 H71 DT F 1 0.797 38.728 40.525 1.00 56.47 H ATOM 3607 H72 DT F 1 -0.463 39.031 41.435 1.00 56.47 H ATOM 3608 H73 DT F 1 0.385 37.714 41.669 1.00 56.47 H ATOM 3609 H6 DT F 1 -2.155 36.970 41.333 1.00 57.49 H ATOM 3610 HO5' DT F 1 -3.407 37.367 43.902 1.00 62.85 H ATOM 3611 P DC F 2 -6.044 32.187 41.592 1.00 52.22 P ANISOU 3611 P DC F 2 5203 5368 9269 335 1085 -1374 P ATOM 3612 OP1 DC F 2 -7.464 31.797 41.818 1.00 52.06 O ANISOU 3612 OP1 DC F 2 5162 5398 9221 262 1138 -1442 O ATOM 3613 OP2 DC F 2 -4.965 31.862 42.552 1.00 52.40 O ANISOU 3613 OP2 DC F 2 5308 5292 9308 314 1052 -1280 O ATOM 3614 O5' DC F 2 -5.607 31.587 40.185 1.00 53.33 O ANISOU 3614 O5' DC F 2 5298 5496 9468 390 1073 -1407 O ATOM 3615 C5' DC F 2 -5.007 32.443 39.263 1.00 55.07 C ANISOU 3615 C5' DC F 2 5475 5752 9697 486 1045 -1409 C ATOM 3616 C4' DC F 2 -4.945 31.851 37.896 1.00 55.06 C ANISOU 3616 C4' DC F 2 5420 5757 9744 526 1045 -1461 C ATOM 3617 O4' DC F 2 -3.938 32.584 37.163 1.00 52.24 O ANISOU 3617 O4' DC F 2 5041 5403 9404 623 1004 -1433 O ATOM 3618 C3' DC F 2 -4.510 30.391 37.836 1.00 56.79 C ANISOU 3618 C3' DC F 2 5674 5885 10019 485 1042 -1445 C ATOM 3619 O3' DC F 2 -5.003 29.766 36.631 1.00 60.10 O ANISOU 3619 O3' DC F 2 6033 6334 10470 499 1062 -1522 O ATOM 3620 C2' DC F 2 -3.003 30.526 37.871 1.00 54.32 C ANISOU 3620 C2' DC F 2 5402 5499 9739 539 988 -1363 C ATOM 3621 C1' DC F 2 -2.767 31.820 37.071 1.00 51.65 C ANISOU 3621 C1' DC F 2 5008 5234 9384 635 969 -1377 C ATOM 3622 N1 DC F 2 -1.616 32.652 37.547 1.00 50.10 N ANISOU 3622 N1 DC F 2 4850 5003 9181 685 923 -1293 N ATOM 3623 C2 DC F 2 -0.773 33.247 36.601 1.00 48.43 C ANISOU 3623 C2 DC F 2 4605 4803 8993 780 888 -1282 C ATOM 3624 O2 DC F 2 -1.018 33.081 35.405 1.00 48.94 O ANISOU 3624 O2 DC F 2 4607 4906 9080 820 897 -1343 O ATOM 3625 N3 DC F 2 0.282 33.979 37.019 1.00 47.99 N ANISOU 3625 N3 DC F 2 4585 4716 8934 825 846 -1207 N ATOM 3626 C4 DC F 2 0.500 34.137 38.314 1.00 48.10 C ANISOU 3626 C4 DC F 2 4665 4689 8921 779 839 -1144 C ATOM 3627 N4 DC F 2 1.548 34.867 38.678 1.00 47.66 N ANISOU 3627 N4 DC F 2 4642 4603 8863 826 797 -1071 N ATOM 3628 C5 DC F 2 -0.346 33.543 39.305 1.00 48.67 C ANISOU 3628 C5 DC F 2 4773 4749 8969 682 874 -1153 C ATOM 3629 C6 DC F 2 -1.380 32.814 38.881 1.00 49.10 C ANISOU 3629 C6 DC F 2 4792 4834 9028 638 915 -1228 C ATOM 3630 H5' DC F 2 -4.105 32.642 39.560 1.00 66.09 H ATOM 3631 H5'' DC F 2 -5.515 33.268 39.225 1.00 66.09 H ATOM 3632 H4' DC F 2 -5.804 31.953 37.457 1.00 66.07 H ATOM 3633 H3' DC F 2 -4.825 29.914 38.620 1.00 68.15 H ATOM 3634 H2' DC F 2 -2.686 30.622 38.783 1.00 65.19 H ATOM 3635 H2'' DC F 2 -2.580 29.770 37.435 1.00 65.19 H ATOM 3636 H1' DC F 2 -2.619 31.588 36.141 1.00 61.98 H ATOM 3637 H41 DC F 2 1.718 34.989 39.512 1.00 57.19 H ATOM 3638 H42 DC F 2 2.056 35.218 38.080 1.00 57.19 H ATOM 3639 H5 DC F 2 -0.176 33.655 40.213 1.00 58.40 H ATOM 3640 H6 DC F 2 -1.944 32.410 39.500 1.00 58.92 H ATOM 3641 P DT F 3 -4.745 28.204 36.320 1.00 66.36 P ANISOU 3641 P DT F 3 6846 7046 11322 460 1065 -1526 P ATOM 3642 OP1 DT F 3 -5.924 27.785 35.528 1.00 67.38 O ANISOU 3642 OP1 DT F 3 6912 7239 11452 440 1107 -1622 O ATOM 3643 OP2 DT F 3 -4.342 27.492 37.559 1.00 72.67 O ANISOU 3643 OP2 DT F 3 7730 7755 12128 388 1058 -1458 O ATOM 3644 O5' DT F 3 -3.479 28.211 35.333 1.00 58.88 O ANISOU 3644 O5' DT F 3 5885 6061 10426 548 1019 -1497 O ATOM 3645 C5' DT F 3 -3.563 28.974 34.148 1.00 53.36 C ANISOU 3645 C5' DT F 3 5112 5437 9726 630 1015 -1545 C ATOM 3646 C4' DT F 3 -2.275 28.931 33.377 1.00 50.53 C ANISOU 3646 C4' DT F 3 4751 5031 9416 707 970 -1507 C ATOM 3647 O4' DT F 3 -1.297 29.804 33.999 1.00 49.44 O ANISOU 3647 O4' DT F 3 4654 4866 9263 745 930 -1426 O ATOM 3648 C3' DT F 3 -1.637 27.542 33.288 1.00 50.58 C ANISOU 3648 C3' DT F 3 4796 4939 9482 677 958 -1482 C ATOM 3649 O3' DT F 3 -1.459 27.209 31.925 1.00 54.75 O ANISOU 3649 O3' DT F 3 5269 5482 10053 733 953 -1528 O ATOM 3650 C2' DT F 3 -0.323 27.674 34.059 1.00 50.05 C ANISOU 3650 C2' DT F 3 4801 4789 9428 691 913 -1381 C ATOM 3651 C1' DT F 3 -0.039 29.163 33.987 1.00 49.41 C ANISOU 3651 C1' DT F 3 4696 4767 9311 762 892 -1362 C ATOM 3652 N1 DT F 3 0.746 29.728 35.110 1.00 49.20 N ANISOU 3652 N1 DT F 3 4736 4695 9264 759 862 -1273 N ATOM 3653 C2 DT F 3 1.838 30.507 34.828 1.00 48.63 C ANISOU 3653 C2 DT F 3 4665 4611 9201 839 817 -1222 C ATOM 3654 O2 DT F 3 2.237 30.704 33.698 1.00 48.29 O ANISOU 3654 O2 DT F 3 4573 4589 9185 913 801 -1244 O ATOM 3655 N3 DT F 3 2.464 31.037 35.920 1.00 48.47 N ANISOU 3655 N3 DT F 3 4705 4552 9158 831 793 -1144 N ATOM 3656 C4 DT F 3 2.116 30.872 37.237 1.00 48.82 C ANISOU 3656 C4 DT F 3 4807 4569 9172 752 808 -1112 C ATOM 3657 O4 DT F 3 2.756 31.380 38.148 1.00 48.63 O ANISOU 3657 O4 DT F 3 4837 4511 9131 752 782 -1040 O ATOM 3658 C5 DT F 3 0.948 30.047 37.466 1.00 49.42 C ANISOU 3658 C5 DT F 3 4878 4660 9239 670 855 -1169 C ATOM 3659 C7 DT F 3 0.467 29.785 38.859 1.00 49.85 C ANISOU 3659 C7 DT F 3 4992 4688 9261 580 875 -1141 C ATOM 3660 C6 DT F 3 0.322 29.530 36.400 1.00 49.58 C ANISOU 3660 C6 DT F 3 4838 4718 9281 678 879 -1246 C ATOM 3661 H5' DT F 3 -3.764 29.895 34.377 1.00 64.03 H ATOM 3662 H5'' DT F 3 -4.276 28.622 33.594 1.00 64.03 H ATOM 3663 H4' DT F 3 -2.444 29.250 32.477 1.00 60.63 H ATOM 3664 H3' DT F 3 -2.209 26.887 33.718 1.00 60.69 H ATOM 3665 H2' DT F 3 -0.435 27.390 34.980 1.00 60.06 H ATOM 3666 H2'' DT F 3 0.382 27.169 33.625 1.00 60.06 H ATOM 3667 H1' DT F 3 0.411 29.362 33.151 1.00 59.29 H ATOM 3668 H3 DT F 3 3.165 31.511 35.766 1.00 58.16 H ATOM 3669 H71 DT F 3 -0.440 30.115 38.956 1.00 59.82 H ATOM 3670 H72 DT F 3 0.483 28.830 39.033 1.00 59.82 H ATOM 3671 H73 DT F 3 1.046 30.238 39.492 1.00 59.82 H ATOM 3672 H6 DT F 3 -0.436 29.009 36.541 1.00 59.49 H ATOM 3673 P DC F 4 -0.932 25.764 31.457 1.00 58.98 P ANISOU 3673 P DC F 4 5822 5933 10654 715 945 -1525 P ATOM 3674 OP1 DC F 4 -1.678 25.466 30.212 1.00 60.16 O ANISOU 3674 OP1 DC F 4 5896 6142 10819 736 971 -1616 O ATOM 3675 OP2 DC F 4 -0.984 24.772 32.558 1.00 61.06 O ANISOU 3675 OP2 DC F 4 6156 6119 10925 623 955 -1488 O ATOM 3676 O5' DC F 4 0.600 26.057 31.109 1.00 57.40 O ANISOU 3676 O5' DC F 4 5642 5678 10491 794 889 -1455 O ATOM 3677 C5' DC F 4 0.905 27.009 30.113 1.00 54.06 C ANISOU 3677 C5' DC F 4 5160 5314 10065 888 871 -1473 C ATOM 3678 C4' DC F 4 2.381 27.367 30.124 1.00 52.09 C ANISOU 3678 C4' DC F 4 4945 5006 9841 951 817 -1392 C ATOM 3679 O4' DC F 4 2.713 27.989 31.383 1.00 50.93 O ANISOU 3679 O4' DC F 4 4858 4835 9659 928 803 -1321 O ATOM 3680 C3' DC F 4 3.350 26.183 29.956 1.00 51.70 C ANISOU 3680 C3' DC F 4 4935 4853 9855 945 792 -1352 C ATOM 3681 O3' DC F 4 4.215 26.442 28.852 1.00 54.23 O ANISOU 3681 O3' DC F 4 5220 5174 10210 1036 759 -1347 O ATOM 3682 C2' DC F 4 4.091 26.114 31.293 1.00 50.29 C ANISOU 3682 C2' DC F 4 4843 4594 9670 905 769 -1259 C ATOM 3683 C1' DC F 4 3.977 27.548 31.805 1.00 49.58 C ANISOU 3683 C1' DC F 4 4750 4565 9524 934 763 -1239 C ATOM 3684 N1 DC F 4 4.047 27.713 33.301 1.00 48.98 N ANISOU 3684 N1 DC F 4 4746 4450 9415 873 761 -1175 N ATOM 3685 C2 DC F 4 4.937 28.650 33.853 1.00 48.52 C ANISOU 3685 C2 DC F 4 4721 4375 9339 915 724 -1102 C ATOM 3686 O2 DC F 4 5.669 29.301 33.100 1.00 48.00 O ANISOU 3686 O2 DC F 4 4626 4324 9287 999 693 -1089 O ATOM 3687 N3 DC F 4 4.967 28.812 35.200 1.00 48.67 N ANISOU 3687 N3 DC F 4 4803 4361 9327 860 723 -1046 N ATOM 3688 C4 DC F 4 4.148 28.096 35.975 1.00 49.24 C ANISOU 3688 C4 DC F 4 4905 4419 9385 768 757 -1063 C ATOM 3689 N4 DC F 4 4.208 28.294 37.297 1.00 49.36 N ANISOU 3689 N4 DC F 4 4983 4403 9369 717 755 -1007 N ATOM 3690 C5 DC F 4 3.233 27.145 35.430 1.00 49.71 C ANISOU 3690 C5 DC F 4 4931 4496 9462 725 796 -1138 C ATOM 3691 C6 DC F 4 3.204 27.001 34.102 1.00 49.56 C ANISOU 3691 C6 DC F 4 4849 4509 9473 780 796 -1192 C ATOM 3692 H5' DC F 4 0.382 27.811 30.271 1.00 64.87 H ATOM 3693 H5'' DC F 4 0.673 26.645 29.245 1.00 64.87 H ATOM 3694 H4' DC F 4 2.547 28.004 29.412 1.00 62.51 H ATOM 3695 H3' DC F 4 2.852 25.363 29.807 1.00 62.04 H ATOM 3696 H2' DC F 4 3.653 25.496 31.899 1.00 60.34 H ATOM 3697 H2'' DC F 4 5.020 25.869 31.160 1.00 60.34 H ATOM 3698 H1' DC F 4 4.663 28.093 31.388 1.00 59.50 H ATOM 3699 H41 DC F 4 3.694 27.848 37.822 1.00 59.23 H ATOM 3700 H42 DC F 4 4.762 28.866 37.621 1.00 59.23 H ATOM 3701 H5 DC F 4 2.666 26.653 35.979 1.00 59.65 H ATOM 3702 H6 DC F 4 2.617 26.389 33.721 1.00 59.47 H ATOM 3703 P DT F 5 5.181 25.310 28.253 1.00 46.35 P ANISOU 3703 P DT F 5 5433 6457 5719 1537 124 -696 P ATOM 3704 OP1 DT F 5 5.374 25.674 26.822 1.00 46.60 O ANISOU 3704 OP1 DT F 5 5355 6578 5773 1433 73 -662 O ATOM 3705 OP2 DT F 5 4.650 23.977 28.626 1.00 47.66 O ANISOU 3705 OP2 DT F 5 5568 6644 5897 1590 238 -735 O ATOM 3706 O5' DT F 5 6.556 25.541 29.047 1.00 43.57 O ANISOU 3706 O5' DT F 5 5171 6061 5324 1527 46 -712 O ATOM 3707 C5' DT F 5 7.114 26.835 29.059 1.00 41.72 C ANISOU 3707 C5' DT F 5 5000 5779 5070 1498 -62 -681 C ATOM 3708 C4' DT F 5 8.429 26.856 29.791 1.00 39.54 C ANISOU 3708 C4' DT F 5 4799 5471 4754 1487 -125 -700 C ATOM 3709 O4' DT F 5 8.188 27.116 31.214 1.00 39.24 O ANISOU 3709 O4' DT F 5 4899 5318 4691 1588 -109 -718 O ATOM 3710 C3' DT F 5 9.210 25.546 29.762 1.00 38.25 C ANISOU 3710 C3' DT F 5 4576 5375 4582 1457 -89 -736 C ATOM 3711 O3' DT F 5 10.584 25.796 29.939 1.00 37.37 O ANISOU 3711 O3' DT F 5 4499 5262 4438 1407 -177 -739 O ATOM 3712 C2' DT F 5 8.643 24.857 30.968 1.00 38.99 C ANISOU 3712 C2' DT F 5 4743 5405 4668 1564 -1 -773 C ATOM 3713 C1' DT F 5 8.701 26.019 31.955 1.00 39.00 C ANISOU 3713 C1' DT F 5 4887 5289 4642 1619 -62 -762 C ATOM 3714 N1 DT F 5 7.942 25.831 33.227 1.00 37.98 N ANISOU 3714 N1 DT F 5 4859 5067 4504 1735 8 -786 N ATOM 3715 C2 DT F 5 8.265 26.626 34.310 1.00 38.95 C ANISOU 3715 C2 DT F 5 5119 5086 4596 1786 -44 -787 C ATOM 3716 O2 DT F 5 9.134 27.482 34.280 1.00 38.57 O ANISOU 3716 O2 DT F 5 5113 5017 4525 1741 -143 -768 O ATOM 3717 N3 DT F 5 7.524 26.391 35.436 1.00 39.93 N ANISOU 3717 N3 DT F 5 5329 5128 4713 1893 26 -810 N ATOM 3718 C4 DT F 5 6.518 25.461 35.590 1.00 40.57 C ANISOU 3718 C4 DT F 5 5376 5222 4818 1952 139 -832 C ATOM 3719 O4 DT F 5 5.926 25.303 36.643 1.00 41.41 O ANISOU 3719 O4 DT F 5 5566 5251 4916 2047 195 -852 O ATOM 3720 C5 DT F 5 6.236 24.659 34.441 1.00 39.85 C ANISOU 3720 C5 DT F 5 5141 5240 4759 1895 187 -830 C ATOM 3721 C7 DT F 5 5.161 23.616 34.525 1.00 40.48 C ANISOU 3721 C7 DT F 5 5174 5341 4865 1953 310 -853 C ATOM 3722 C6 DT F 5 6.952 24.873 33.317 1.00 38.46 C ANISOU 3722 C6 DT F 5 4878 5146 4590 1789 121 -808 C ATOM 3723 H5' DT F 5 6.498 27.443 29.496 1.00 50.06 H ATOM 3724 H5'' DT F 5 7.255 27.128 28.145 1.00 50.06 H ATOM 3725 H4' DT F 5 8.984 27.565 29.429 1.00 47.45 H ATOM 3726 H3' DT F 5 9.036 25.045 28.950 1.00 45.90 H ATOM 3727 H2' DT F 5 7.730 24.569 30.814 1.00 46.79 H ATOM 3728 H2'' DT F 5 9.208 24.122 31.254 1.00 46.79 H ATOM 3729 H1' DT F 5 9.630 26.197 32.171 1.00 46.80 H ATOM 3730 H3 DT F 5 7.708 26.873 36.124 1.00 47.91 H ATOM 3731 H71 DT F 5 4.770 23.625 35.413 1.00 48.57 H ATOM 3732 H72 DT F 5 4.474 23.807 33.868 1.00 48.57 H ATOM 3733 H73 DT F 5 5.543 22.742 34.349 1.00 48.57 H ATOM 3734 H6 DT F 5 6.765 24.356 32.566 1.00 46.15 H ATOM 3735 P DA F 6 11.709 25.325 28.898 1.00 34.86 P ANISOU 3735 P DA F 6 4072 5053 4120 1293 -222 -736 P ATOM 3736 OP1 DA F 6 11.516 26.013 27.605 1.00 34.42 O ANISOU 3736 OP1 DA F 6 3932 5057 4089 1215 -270 -695 O ATOM 3737 OP2 DA F 6 11.789 23.847 28.964 1.00 31.64 O ANISOU 3737 OP2 DA F 6 3602 4703 3718 1301 -136 -775 O ATOM 3738 O5' DA F 6 13.026 25.953 29.560 1.00 34.89 O ANISOU 3738 O5' DA F 6 4170 5004 4081 1275 -324 -737 O ATOM 3739 C5' DA F 6 13.124 27.377 29.689 1.00 34.39 C ANISOU 3739 C5' DA F 6 4185 4876 4006 1271 -414 -704 C ATOM 3740 C4' DA F 6 13.915 27.752 30.933 1.00 34.76 C ANISOU 3740 C4' DA F 6 4365 4832 4011 1314 -464 -720 C ATOM 3741 O4' DA F 6 13.103 27.504 32.115 1.00 34.99 O ANISOU 3741 O4' DA F 6 4484 4776 4033 1427 -390 -744 O ATOM 3742 C3' DA F 6 15.214 26.983 31.134 1.00 35.48 C ANISOU 3742 C3' DA F 6 4443 4961 4076 1274 -486 -747 C ATOM 3743 O3' DA F 6 16.230 27.888 31.591 1.00 38.06 O ANISOU 3743 O3' DA F 6 4858 5235 4369 1253 -591 -736 O ATOM 3744 C2' DA F 6 14.846 25.905 32.171 1.00 35.87 C ANISOU 3744 C2' DA F 6 4534 4977 4119 1362 -388 -791 C ATOM 3745 C1' DA F 6 13.760 26.598 32.998 1.00 35.92 C ANISOU 3745 C1' DA F 6 4642 4881 4126 1459 -361 -785 C ATOM 3746 N9 DA F 6 12.720 25.719 33.567 1.00 33.38 N ANISOU 3746 N9 DA F 6 4326 4539 3819 1546 -244 -813 N ATOM 3747 C8 DA F 6 11.966 24.779 32.903 1.00 32.45 C ANISOU 3747 C8 DA F 6 4100 4494 3734 1542 -154 -822 C ATOM 3748 N7 DA F 6 11.053 24.200 33.657 1.00 31.95 N ANISOU 3748 N7 DA F 6 4073 4389 3678 1634 -59 -847 N ATOM 3749 C5 DA F 6 11.223 24.813 34.891 1.00 32.34 C ANISOU 3749 C5 DA F 6 4263 4329 3696 1702 -90 -854 C ATOM 3750 C6 DA F 6 10.564 24.640 36.128 1.00 32.51 C ANISOU 3750 C6 DA F 6 4384 4260 3706 1811 -28 -878 C ATOM 3751 N6 DA F 6 9.562 23.761 36.303 1.00 32.28 N ANISOU 3751 N6 DA F 6 4325 4240 3700 1872 82 -899 N ATOM 3752 N1 DA F 6 10.973 25.419 37.177 1.00 32.93 N ANISOU 3752 N1 DA F 6 4571 4214 3725 1856 -85 -879 N ATOM 3753 C2 DA F 6 11.968 26.308 36.976 1.00 33.36 C ANISOU 3753 C2 DA F 6 4654 4262 3758 1793 -196 -857 C ATOM 3754 N3 DA F 6 12.664 26.553 35.851 1.00 33.01 N ANISOU 3754 N3 DA F 6 4523 4298 3722 1690 -263 -833 N ATOM 3755 C4 DA F 6 12.233 25.762 34.842 1.00 32.61 C ANISOU 3755 C4 DA F 6 4342 4343 3705 1649 -204 -833 C ATOM 3756 H5' DA F 6 12.232 27.754 29.752 1.00 41.27 H ATOM 3757 H5'' DA F 6 13.568 27.739 28.906 1.00 41.27 H ATOM 3758 H4' DA F 6 14.121 28.699 30.894 1.00 41.72 H ATOM 3759 H3' DA F 6 15.487 26.567 30.302 1.00 42.57 H ATOM 3760 H2' DA F 6 14.494 25.113 31.734 1.00 43.05 H ATOM 3761 H2'' DA F 6 15.612 25.684 32.724 1.00 43.05 H ATOM 3762 H1' DA F 6 14.178 27.101 33.714 1.00 43.11 H ATOM 3763 H8 DA F 6 12.087 24.573 32.004 1.00 38.93 H ATOM 3764 H61 DA F 6 9.181 23.690 37.070 1.00 38.74 H ATOM 3765 H62 DA F 6 9.302 23.270 35.646 1.00 38.74 H ATOM 3766 H2 DA F 6 12.210 26.815 37.718 1.00 40.03 H ATOM 3767 P DA F 7 17.776 27.471 31.681 1.00 40.07 P ANISOU 3767 P DA F 7 5108 5524 4594 1193 -650 -752 P ATOM 3768 OP1 DA F 7 18.547 28.730 31.608 1.00 39.54 O ANISOU 3768 OP1 DA F 7 5096 5422 4505 1147 -769 -722 O ATOM 3769 OP2 DA F 7 18.072 26.376 30.735 1.00 40.01 O ANISOU 3769 OP2 DA F 7 4964 5631 4606 1126 -610 -763 O ATOM 3770 O5' DA F 7 17.917 26.827 33.139 1.00 43.00 O ANISOU 3770 O5' DA F 7 5579 5822 4936 1283 -601 -794 O ATOM 3771 C5' DA F 7 17.657 27.622 34.296 1.00 41.78 C ANISOU 3771 C5' DA F 7 5565 5551 4758 1363 -622 -794 C ATOM 3772 C4' DA F 7 17.519 26.763 35.538 1.00 41.15 C ANISOU 3772 C4' DA F 7 5556 5419 4662 1453 -548 -836 C ATOM 3773 O4' DA F 7 16.220 26.130 35.555 1.00 40.64 O ANISOU 3773 O4' DA F 7 5457 5358 4626 1515 -437 -849 O ATOM 3774 C3' DA F 7 18.530 25.613 35.670 1.00 42.96 C ANISOU 3774 C3' DA F 7 5746 5703 4876 1423 -532 -869 C ATOM 3775 O3' DA F 7 19.606 25.985 36.577 1.00 48.08 O ANISOU 3775 O3' DA F 7 6497 6291 5482 1430 -604 -878 O ATOM 3776 C2' DA F 7 17.689 24.426 36.199 1.00 39.71 C ANISOU 3776 C2' DA F 7 5322 5290 4476 1501 -407 -905 C ATOM 3777 C1' DA F 7 16.301 25.016 36.412 1.00 38.16 C ANISOU 3777 C1' DA F 7 5168 5032 4299 1573 -364 -891 C ATOM 3778 N9 DA F 7 15.213 24.084 36.119 1.00 35.63 N ANISOU 3778 N9 DA F 7 4773 4753 4012 1608 -251 -906 N ATOM 3779 C8 DA F 7 14.918 23.495 34.932 1.00 33.86 C ANISOU 3779 C8 DA F 7 4412 4630 3821 1549 -213 -899 C ATOM 3780 N7 DA F 7 13.875 22.691 34.985 1.00 33.53 N ANISOU 3780 N7 DA F 7 4333 4602 3804 1603 -106 -917 N ATOM 3781 C5 DA F 7 13.482 22.746 36.306 1.00 34.12 C ANISOU 3781 C5 DA F 7 4528 4576 3859 1704 -72 -937 C ATOM 3782 C6 DA F 7 12.433 22.123 37.023 1.00 33.84 C ANISOU 3782 C6 DA F 7 4523 4501 3835 1800 32 -962 C ATOM 3783 N6 DA F 7 11.544 21.280 36.474 1.00 33.07 N ANISOU 3783 N6 DA F 7 4332 4461 3771 1809 126 -971 N ATOM 3784 N1 DA F 7 12.328 22.404 38.316 1.00 34.21 N ANISOU 3784 N1 DA F 7 4699 4444 3855 1886 37 -978 N ATOM 3785 C2 DA F 7 13.187 23.254 38.866 1.00 34.74 C ANISOU 3785 C2 DA F 7 4860 4452 3889 1877 -56 -969 C ATOM 3786 N3 DA F 7 14.208 23.891 38.310 1.00 35.47 N ANISOU 3786 N3 DA F 7 4936 4573 3968 1793 -158 -946 N ATOM 3787 C4 DA F 7 14.296 23.596 37.016 1.00 35.29 C ANISOU 3787 C4 DA F 7 4783 4653 3972 1709 -160 -931 C ATOM 3788 H5' DA F 7 16.835 28.118 34.161 1.00 50.13 H ATOM 3789 H5'' DA F 7 18.388 28.247 34.422 1.00 50.13 H ATOM 3790 H4' DA F 7 17.596 27.334 36.319 1.00 49.38 H ATOM 3791 H3' DA F 7 18.894 25.395 34.797 1.00 51.56 H ATOM 3792 H2' DA F 7 17.657 23.713 35.542 1.00 47.65 H ATOM 3793 H2'' DA F 7 18.051 24.100 37.038 1.00 47.65 H ATOM 3794 H1' DA F 7 16.222 25.317 37.331 1.00 45.79 H ATOM 3795 H8 DA F 7 15.395 23.657 34.151 1.00 40.63 H ATOM 3796 H61 DA F 7 10.923 20.935 36.959 1.00 39.68 H ATOM 3797 H62 DA F 7 11.595 21.086 35.638 1.00 39.68 H ATOM 3798 H2 DA F 7 13.068 23.409 39.775 1.00 41.69 H ATOM 3799 P DT F 8 20.669 24.904 37.139 1.00 50.88 P ANISOU 3799 P DT F 8 6854 6669 5811 1425 -591 -916 P ATOM 3800 OP1 DT F 8 21.853 25.721 37.484 1.00 55.09 O ANISOU 3800 OP1 DT F 8 7460 7163 6309 1389 -702 -904 O ATOM 3801 OP2 DT F 8 20.852 23.747 36.217 1.00 47.61 O ANISOU 3801 OP2 DT F 8 6301 6367 5420 1367 -540 -928 O ATOM 3802 O5' DT F 8 19.994 24.405 38.508 1.00 50.18 O ANISOU 3802 O5' DT F 8 6861 6495 5710 1545 -508 -950 O ATOM 3803 C5' DT F 8 19.608 25.369 39.484 1.00 49.56 C ANISOU 3803 C5' DT F 8 6915 6303 5611 1616 -534 -943 C ATOM 3804 C4' DT F 8 19.056 24.716 40.746 1.00 49.92 C ANISOU 3804 C4' DT F 8 7042 6280 5646 1725 -449 -980 C ATOM 3805 O4' DT F 8 17.778 24.089 40.468 1.00 47.75 O ANISOU 3805 O4' DT F 8 6709 6029 5406 1769 -343 -987 O ATOM 3806 C3' DT F 8 19.945 23.638 41.375 1.00 53.36 C ANISOU 3806 C3' DT F 8 7485 6732 6058 1731 -426 -1017 C ATOM 3807 O3' DT F 8 20.153 23.938 42.731 1.00 63.27 O ANISOU 3807 O3' DT F 8 8877 7884 7277 1805 -441 -1034 O ATOM 3808 C2' DT F 8 19.175 22.338 41.197 1.00 48.57 C ANISOU 3808 C2' DT F 8 6798 6178 5479 1764 -306 -1044 C ATOM 3809 C1' DT F 8 17.730 22.800 41.046 1.00 46.04 C ANISOU 3809 C1' DT F 8 6481 5824 5186 1816 -255 -1028 C ATOM 3810 N1 DT F 8 16.871 21.904 40.159 1.00 42.48 N ANISOU 3810 N1 DT F 8 5905 5457 4777 1804 -163 -1033 N ATOM 3811 C2 DT F 8 15.727 21.366 40.677 1.00 40.92 C ANISOU 3811 C2 DT F 8 5725 5228 4595 1891 -60 -1052 C ATOM 3812 O2 DT F 8 15.369 21.563 41.807 1.00 41.15 O ANISOU 3812 O2 DT F 8 5864 5165 4606 1977 -39 -1066 O ATOM 3813 N3 DT F 8 15.016 20.568 39.819 1.00 39.71 N ANISOU 3813 N3 DT F 8 5454 5156 4479 1873 18 -1055 N ATOM 3814 C4 DT F 8 15.310 20.277 38.507 1.00 36.95 C ANISOU 3814 C4 DT F 8 4974 4914 4153 1779 4 -1040 C ATOM 3815 O4 DT F 8 14.577 19.565 37.817 1.00 33.76 O ANISOU 3815 O4 DT F 8 4472 4574 3782 1772 80 -1044 O ATOM 3816 C5 DT F 8 16.540 20.870 38.010 1.00 38.29 C ANISOU 3816 C5 DT F 8 5132 5113 4305 1689 -106 -1020 C ATOM 3817 C7 DT F 8 17.001 20.612 36.592 1.00 36.10 C ANISOU 3817 C7 DT F 8 4716 4951 4049 1580 -131 -1003 C ATOM 3818 C6 DT F 8 17.254 21.646 38.856 1.00 40.52 C ANISOU 3818 C6 DT F 8 5529 5316 4550 1706 -183 -1017 C ATOM 3819 H5' DT F 8 18.928 25.947 39.104 1.00 59.47 H ATOM 3820 H5'' DT F 8 20.381 25.905 39.719 1.00 59.47 H ATOM 3821 H4' DT F 8 18.913 25.412 41.407 1.00 59.91 H ATOM 3822 H3' DT F 8 20.793 23.591 40.907 1.00 64.03 H ATOM 3823 H2' DT F 8 19.470 21.872 40.399 1.00 58.29 H ATOM 3824 H2'' DT F 8 19.273 21.773 41.980 1.00 58.29 H ATOM 3825 H1' DT F 8 17.323 22.861 41.925 1.00 55.24 H ATOM 3826 H3 DT F 8 14.284 20.236 40.126 1.00 47.66 H ATOM 3827 H71 DT F 8 16.365 20.031 36.146 1.00 43.32 H ATOM 3828 H72 DT F 8 17.061 21.454 36.113 1.00 43.32 H ATOM 3829 H73 DT F 8 17.872 20.186 36.607 1.00 43.32 H ATOM 3830 H6 DT F 8 18.041 22.031 38.543 1.00 48.62 H ATOM 3831 P DG F 9 21.304 23.203 43.567 1.00 78.08 P ANISOU 3831 P DG F 9 11908 9416 8341 1818 -2233 1089 P ATOM 3832 OP1 DG F 9 21.740 24.215 44.567 1.00 81.59 O ANISOU 3832 OP1 DG F 9 12470 9719 8813 1784 -2284 1103 O ATOM 3833 OP2 DG F 9 22.267 22.596 42.609 1.00 78.27 O ANISOU 3833 OP2 DG F 9 11842 9462 8435 1739 -2248 1148 O ATOM 3834 O5' DG F 9 20.523 22.039 44.348 1.00 75.57 O ANISOU 3834 O5' DG F 9 11578 9145 7991 1891 -2180 1024 O ATOM 3835 C5' DG F 9 19.349 22.363 45.084 1.00 74.37 C ANISOU 3835 C5' DG F 9 11496 9003 7757 1995 -2147 955 C ATOM 3836 C4' DG F 9 18.726 21.122 45.694 1.00 73.27 C ANISOU 3836 C4' DG F 9 11300 8904 7636 2029 -2030 887 C ATOM 3837 O4' DG F 9 17.869 20.467 44.710 1.00 72.26 O ANISOU 3837 O4' DG F 9 10981 8942 7530 2037 -1903 781 O ATOM 3838 C3' DG F 9 19.717 20.057 46.150 1.00 74.06 C ANISOU 3838 C3' DG F 9 11354 8945 7842 1933 -1988 930 C ATOM 3839 O3' DG F 9 19.263 19.465 47.367 1.00 78.10 O ANISOU 3839 O3' DG F 9 11930 9403 8341 1994 -1907 905 O ATOM 3840 C2' DG F 9 19.730 19.071 44.986 1.00 70.93 C ANISOU 3840 C2' DG F 9 10733 8677 7539 1852 -1868 879 C ATOM 3841 C1' DG F 9 18.285 19.120 44.524 1.00 69.68 C ANISOU 3841 C1' DG F 9 10497 8650 7327 1941 -1782 756 C ATOM 3842 N9 DG F 9 18.063 18.757 43.117 1.00 65.23 N ANISOU 3842 N9 DG F 9 9738 8250 6797 1909 -1725 684 N ATOM 3843 C8 DG F 9 18.852 19.060 42.030 1.00 63.39 C ANISOU 3843 C8 DG F 9 9455 8058 6573 1850 -1792 743 C ATOM 3844 N7 DG F 9 18.368 18.618 40.895 1.00 61.58 N ANISOU 3844 N7 DG F 9 9044 7998 6355 1855 -1719 646 N ATOM 3845 C5 DG F 9 17.184 17.995 41.255 1.00 59.61 C ANISOU 3845 C5 DG F 9 8708 7821 6120 1913 -1598 501 C ATOM 3846 C6 DG F 9 16.225 17.334 40.460 1.00 56.51 C ANISOU 3846 C6 DG F 9 8104 7611 5755 1945 -1485 325 C ATOM 3847 O6 DG F 9 16.225 17.160 39.231 1.00 55.05 O ANISOU 3847 O6 DG F 9 7768 7580 5569 1940 -1478 263 O ATOM 3848 N1 DG F 9 15.182 16.841 41.222 1.00 57.33 N ANISOU 3848 N1 DG F 9 8174 7714 5896 1993 -1365 203 N ATOM 3849 C2 DG F 9 15.065 16.973 42.587 1.00 59.71 C ANISOU 3849 C2 DG F 9 8642 7859 6189 2018 -1353 260 C ATOM 3850 N2 DG F 9 13.978 16.433 43.146 1.00 61.16 N ANISOU 3850 N2 DG F 9 8766 8056 6418 2068 -1207 126 N ATOM 3851 N3 DG F 9 15.949 17.593 43.346 1.00 60.62 N ANISOU 3851 N3 DG F 9 8961 7815 6256 2002 -1470 425 N ATOM 3852 C4 DG F 9 16.980 18.079 42.616 1.00 61.77 C ANISOU 3852 C4 DG F 9 9127 7958 6383 1945 -1591 531 C ATOM 3853 H5' DG F 9 18.707 22.782 44.490 1.00 89.24 H ATOM 3854 H5'' DG F 9 19.580 22.984 45.792 1.00 89.24 H ATOM 3855 H4' DG F 9 18.183 21.387 46.452 1.00 87.93 H ATOM 3856 H3' DG F 9 20.597 20.447 46.271 1.00 88.88 H ATOM 3857 H2' DG F 9 20.328 19.371 44.284 1.00 85.11 H ATOM 3858 H2'' DG F 9 19.966 18.180 45.290 1.00 85.11 H ATOM 3859 H1' DG F 9 17.751 18.541 45.090 1.00 83.61 H ATOM 3860 H8 DG F 9 19.651 19.532 42.094 1.00 76.07 H ATOM 3861 H1 DG F 9 14.553 16.423 40.810 1.00 68.80 H ATOM 3862 H21 DG F 9 13.858 16.490 43.996 1.00 73.40 H ATOM 3863 H22 DG F 9 13.398 16.028 42.657 1.00 73.40 H ATOM 3864 P DG F 10 20.233 18.537 48.249 1.00 80.88 P ANISOU 3864 P DG F 10 12307 9663 8759 1952 -1878 966 P ATOM 3865 OP1 DG F 10 20.317 19.167 49.589 1.00 82.22 O ANISOU 3865 OP1 DG F 10 12689 9718 8833 2048 -1979 1006 O ATOM 3866 OP2 DG F 10 21.452 18.238 47.451 1.00 81.69 O ANISOU 3866 OP2 DG F 10 12305 9775 8960 1824 -1925 1020 O ATOM 3867 O5' DG F 10 19.440 17.156 48.378 1.00 76.07 O ANISOU 3867 O5' DG F 10 11573 9110 8221 1963 -1641 892 O ATOM 3868 C5' DG F 10 18.025 17.147 48.441 1.00 72.29 C ANISOU 3868 C5' DG F 10 11071 8688 7709 2044 -1523 788 C ATOM 3869 C4' DG F 10 17.502 15.764 48.144 1.00 67.65 C ANISOU 3869 C4' DG F 10 10296 8163 7247 2006 -1286 699 C ATOM 3870 O4' DG F 10 17.173 15.642 46.729 1.00 64.48 O ANISOU 3870 O4' DG F 10 9688 7910 6901 1942 -1257 604 O ATOM 3871 C3' DG F 10 18.502 14.653 48.409 1.00 66.73 C ANISOU 3871 C3' DG F 10 10136 7987 7230 1933 -1205 770 C ATOM 3872 O3' DG F 10 17.830 13.511 48.847 1.00 69.30 O ANISOU 3872 O3' DG F 10 10392 8296 7642 1958 -959 707 O ATOM 3873 C2' DG F 10 19.128 14.449 47.039 1.00 62.75 C ANISOU 3873 C2' DG F 10 9451 7581 6810 1807 -1240 757 C ATOM 3874 C1' DG F 10 17.894 14.557 46.182 1.00 60.24 C ANISOU 3874 C1' DG F 10 8993 7399 6495 1829 -1164 610 C ATOM 3875 N9 DG F 10 18.140 14.788 44.755 1.00 53.36 N ANISOU 3875 N9 DG F 10 7976 6657 5642 1760 -1232 577 N ATOM 3876 C8 DG F 10 19.158 15.502 44.175 1.00 51.02 C ANISOU 3876 C8 DG F 10 7724 6352 5309 1707 -1404 677 C ATOM 3877 N7 DG F 10 19.096 15.522 42.860 1.00 48.73 N ANISOU 3877 N7 DG F 10 7282 6197 5035 1668 -1407 622 N ATOM 3878 C5 DG F 10 17.967 14.776 42.570 1.00 47.18 C ANISOU 3878 C5 DG F 10 6922 6114 4889 1697 -1243 459 C ATOM 3879 C6 DG F 10 17.402 14.430 41.328 1.00 46.14 C ANISOU 3879 C6 DG F 10 6577 6165 4790 1689 -1179 319 C ATOM 3880 O6 DG F 10 17.792 14.738 40.185 1.00 46.05 O ANISOU 3880 O6 DG F 10 6493 6256 4749 1665 -1256 327 O ATOM 3881 N1 DG F 10 16.262 13.644 41.491 1.00 48.26 N ANISOU 3881 N1 DG F 10 6707 6496 5132 1721 -1001 145 N ATOM 3882 C2 DG F 10 15.740 13.241 42.712 1.00 48.63 C ANISOU 3882 C2 DG F 10 6828 6428 5220 1757 -879 129 C ATOM 3883 N2 DG F 10 14.618 12.486 42.680 1.00 48.70 N ANISOU 3883 N2 DG F 10 6674 6507 5326 1779 -688 -61 N ATOM 3884 N3 DG F 10 16.275 13.554 43.873 1.00 48.02 N ANISOU 3884 N3 DG F 10 6967 6184 5095 1776 -934 278 N ATOM 3885 C4 DG F 10 17.377 14.314 43.728 1.00 48.46 C ANISOU 3885 C4 DG F 10 7145 6191 5078 1744 -1125 429 C ATOM 3886 H5' DG F 10 17.670 17.771 47.789 1.00 86.75 H ATOM 3887 H5'' DG F 10 17.741 17.414 49.329 1.00 86.75 H ATOM 3888 H4' DG F 10 16.704 15.605 48.671 1.00 81.19 H ATOM 3889 H3' DG F 10 19.169 14.935 49.055 1.00 80.07 H ATOM 3890 H2' DG F 10 19.762 15.153 46.832 1.00 75.30 H ATOM 3891 H2'' DG F 10 19.532 13.571 46.964 1.00 75.30 H ATOM 3892 H1' DG F 10 17.369 13.747 46.284 1.00 72.28 H ATOM 3893 H8 DG F 10 19.821 15.936 44.662 1.00 61.22 H ATOM 3894 H1 DG F 10 15.846 13.396 40.780 1.00 57.91 H ATOM 3895 H21 DG F 10 14.261 12.215 43.414 1.00 58.45 H ATOM 3896 H22 DG F 10 14.262 12.277 41.925 1.00 58.45 H ATOM 3897 P DC F 11 18.387 12.647 50.067 1.00 70.11 P ANISOU 3897 P DC F 11 10607 8266 7765 2003 -850 805 P ATOM 3898 OP1 DC F 11 17.896 13.327 51.293 1.00 72.17 O ANISOU 3898 OP1 DC F 11 11093 8441 7887 2148 -895 838 O ATOM 3899 OP2 DC F 11 19.838 12.367 49.881 1.00 68.13 O ANISOU 3899 OP2 DC F 11 10345 7991 7551 1922 -953 911 O ATOM 3900 O5' DC F 11 17.645 11.264 49.860 1.00 68.22 O ANISOU 3900 O5' DC F 11 10188 8046 7687 1973 -535 704 O ATOM 3901 C5' DC F 11 18.189 10.329 48.969 1.00 65.26 C ANISOU 3901 C5' DC F 11 9613 7725 7460 1848 -445 681 C ATOM 3902 C4' DC F 11 17.203 9.956 47.881 1.00 61.60 C ANISOU 3902 C4' DC F 11 8906 7390 7110 1786 -308 497 C ATOM 3903 O4' DC F 11 17.313 10.892 46.791 1.00 59.04 O ANISOU 3903 O4' DC F 11 8521 7193 6720 1742 -517 463 O ATOM 3904 C3' DC F 11 17.468 8.589 47.292 1.00 61.02 C ANISOU 3904 C3' DC F 11 8617 7338 7227 1678 -100 442 C ATOM 3905 O3' DC F 11 16.568 7.655 47.812 1.00 62.83 O ANISOU 3905 O3' DC F 11 8788 7508 7576 1715 194 351 O ATOM 3906 C2' DC F 11 17.316 8.746 45.781 1.00 58.82 C ANISOU 3906 C2' DC F 11 8118 7236 6996 1584 -167 315 C ATOM 3907 C1' DC F 11 17.144 10.229 45.556 1.00 56.85 C ANISOU 3907 C1' DC F 11 7985 7046 6569 1645 -423 336 C ATOM 3908 N1 DC F 11 18.102 10.806 44.565 1.00 51.78 N ANISOU 3908 N1 DC F 11 7313 6480 5881 1570 -630 402 N ATOM 3909 C2 DC F 11 17.844 10.650 43.197 1.00 47.25 C ANISOU 3909 C2 DC F 11 6523 6071 5359 1510 -618 277 C ATOM 3910 O2 DC F 11 16.863 9.984 42.844 1.00 46.47 O ANISOU 3910 O2 DC F 11 6244 6057 5354 1513 -444 99 O ATOM 3911 N3 DC F 11 18.677 11.226 42.303 1.00 45.57 N ANISOU 3911 N3 DC F 11 6301 5919 5094 1458 -791 346 N ATOM 3912 C4 DC F 11 19.722 11.931 42.722 1.00 45.26 C ANISOU 3912 C4 DC F 11 6442 5775 4979 1449 -964 517 C ATOM 3913 N4 DC F 11 20.518 12.471 41.796 1.00 44.92 N ANISOU 3913 N4 DC F 11 6380 5781 4908 1393 -1105 577 N ATOM 3914 C5 DC F 11 20.007 12.107 44.112 1.00 46.83 C ANISOU 3914 C5 DC F 11 6847 5814 5132 1504 -993 626 C ATOM 3915 C6 DC F 11 19.177 11.536 44.991 1.00 49.45 C ANISOU 3915 C6 DC F 11 7201 6095 5492 1571 -827 570 C ATOM 3916 H5' DC F 11 18.436 9.530 49.460 1.00 78.32 H ATOM 3917 H5'' DC F 11 18.984 10.707 48.560 1.00 78.32 H ATOM 3918 H4' DC F 11 16.302 9.983 48.239 1.00 73.92 H ATOM 3919 H3' DC F 11 18.375 8.316 47.500 1.00 73.22 H ATOM 3920 H2' DC F 11 18.112 8.427 45.328 1.00 70.59 H ATOM 3921 H2'' DC F 11 16.534 8.265 45.470 1.00 70.59 H ATOM 3922 H1' DC F 11 16.241 10.389 45.240 1.00 68.22 H ATOM 3923 H41 DC F 11 21.203 12.932 42.034 1.00 53.91 H ATOM 3924 H42 DC F 11 20.345 12.356 40.961 1.00 53.91 H ATOM 3925 H5 DC F 11 20.740 12.606 44.395 1.00 56.20 H ATOM 3926 H6 DC F 11 19.322 11.652 45.903 1.00 59.34 H ATOM 3927 P DT F 12 16.923 6.103 47.680 1.00 65.34 P ANISOU 3927 P DT F 12 8947 7776 8101 1631 465 335 P ATOM 3928 OP1 DT F 12 15.912 5.352 48.475 1.00 68.35 O ANISOU 3928 OP1 DT F 12 9329 8053 8586 1700 778 261 O ATOM 3929 OP2 DT F 12 18.371 5.952 47.961 1.00 64.44 O ANISOU 3929 OP2 DT F 12 8943 7596 7947 1607 349 527 O ATOM 3930 O5' DT F 12 16.741 5.815 46.112 1.00 60.24 O ANISOU 3930 O5' DT F 12 8003 7306 7579 1499 471 161 O ATOM 3931 C5' DT F 12 15.444 5.833 45.540 1.00 56.38 C ANISOU 3931 C5' DT F 12 7338 6926 7156 1504 571 -66 C ATOM 3932 C4' DT F 12 15.478 5.384 44.097 1.00 52.38 C ANISOU 3932 C4' DT F 12 6548 6588 6766 1389 582 -222 C ATOM 3933 O4' DT F 12 16.311 6.283 43.327 1.00 49.99 O ANISOU 3933 O4' DT F 12 6288 6387 6320 1360 287 -130 O ATOM 3934 C3' DT F 12 16.049 3.990 43.868 1.00 54.00 C ANISOU 3934 C3' DT F 12 6595 6745 7177 1278 803 -233 C ATOM 3935 O3' DT F 12 15.247 3.316 42.922 1.00 58.86 O ANISOU 3935 O3' DT F 12 6911 7488 7965 1213 967 -491 O ATOM 3936 C2' DT F 12 17.468 4.264 43.369 1.00 50.85 C ANISOU 3936 C2' DT F 12 6247 6375 6701 1208 582 -66 C ATOM 3937 C1' DT F 12 17.267 5.552 42.592 1.00 48.39 C ANISOU 3937 C1' DT F 12 5950 6216 6220 1240 309 -102 C ATOM 3938 N1 DT F 12 18.476 6.422 42.433 1.00 46.17 N ANISOU 3938 N1 DT F 12 5824 5927 5791 1224 33 92 N ATOM 3939 C2 DT F 12 18.849 6.827 41.171 1.00 45.72 C ANISOU 3939 C2 DT F 12 5655 6018 5699 1167 -116 59 C ATOM 3940 O2 DT F 12 18.277 6.476 40.171 1.00 45.96 O ANISOU 3940 O2 DT F 12 5465 6199 5798 1135 -46 -120 O ATOM 3941 N3 DT F 12 19.931 7.658 41.130 1.00 45.12 N ANISOU 3941 N3 DT F 12 5734 5905 5506 1154 -343 238 N ATOM 3942 C4 DT F 12 20.652 8.137 42.201 1.00 44.97 C ANISOU 3942 C4 DT F 12 5951 5731 5403 1192 -453 420 C ATOM 3943 O4 DT F 12 21.608 8.882 42.062 1.00 44.56 O ANISOU 3943 O4 DT F 12 6006 5654 5272 1171 -651 548 O ATOM 3944 C5 DT F 12 20.202 7.680 43.504 1.00 45.47 C ANISOU 3944 C5 DT F 12 6124 5665 5488 1266 -306 441 C ATOM 3945 C7 DT F 12 20.918 8.118 44.756 1.00 45.52 C ANISOU 3945 C7 DT F 12 6385 5517 5394 1335 -417 620 C ATOM 3946 C6 DT F 12 19.144 6.857 43.551 1.00 46.03 C ANISOU 3946 C6 DT F 12 6058 5758 5674 1279 -65 286 C ATOM 3947 H5' DT F 12 15.090 6.734 45.584 1.00 67.65 H ATOM 3948 H5'' DT F 12 14.866 5.239 46.044 1.00 67.65 H ATOM 3949 H4' DT F 12 14.576 5.414 43.742 1.00 62.85 H ATOM 3950 H3' DT F 12 16.075 3.496 44.703 1.00 64.80 H ATOM 3951 H2' DT F 12 18.078 4.397 44.111 1.00 61.02 H ATOM 3952 H2'' DT F 12 17.775 3.552 42.786 1.00 61.02 H ATOM 3953 H1' DT F 12 16.906 5.345 41.716 1.00 58.07 H ATOM 3954 H3 DT F 12 20.184 7.919 40.351 1.00 54.15 H ATOM 3955 H71 DT F 12 21.656 8.702 44.520 1.00 54.63 H ATOM 3956 H72 DT F 12 20.300 8.596 45.332 1.00 54.63 H ATOM 3957 H73 DT F 12 21.259 7.339 45.223 1.00 54.63 H ATOM 3958 H6 DT F 12 18.843 6.573 44.384 1.00 55.24 H ATOM 3959 P DT F 13 15.563 1.809 42.494 1.00 63.92 P ANISOU 3959 P DT F 13 7322 8103 8861 1088 1236 -576 P ATOM 3960 OP1 DT F 13 14.231 1.196 42.281 1.00 67.27 O ANISOU 3960 OP1 DT F 13 7518 8570 9472 1084 1491 -860 O ATOM 3961 OP2 DT F 13 16.562 1.234 43.436 1.00 64.57 O ANISOU 3961 OP2 DT F 13 7579 7990 8965 1085 1324 -343 O ATOM 3962 O5' DT F 13 16.274 1.968 41.068 1.00 61.09 O ANISOU 3962 O5' DT F 13 6804 7931 8475 992 1042 -612 O ATOM 3963 C5' DT F 13 15.693 2.814 40.116 1.00 58.12 C ANISOU 3963 C5' DT F 13 6334 7760 7990 1026 857 -756 C ATOM 3964 C4' DT F 13 16.489 2.831 38.842 1.00 55.04 C ANISOU 3964 C4' DT F 13 5813 7521 7578 944 711 -761 C ATOM 3965 O4' DT F 13 17.619 3.715 38.994 1.00 51.56 O ANISOU 3965 O4' DT F 13 5604 7031 6956 954 458 -501 O ATOM 3966 C3' DT F 13 17.051 1.478 38.407 1.00 56.16 C ANISOU 3966 C3' DT F 13 5755 7645 7941 810 913 -812 C ATOM 3967 O3' DT F 13 16.697 1.265 37.042 1.00 62.12 O ANISOU 3967 O3' DT F 13 6235 8619 8748 767 900 -1042 O ATOM 3968 C2' DT F 13 18.569 1.606 38.638 1.00 50.98 C ANISOU 3968 C2' DT F 13 5276 6883 7211 759 776 -531 C ATOM 3969 C1' DT F 13 18.791 3.103 38.498 1.00 48.72 C ANISOU 3969 C1' DT F 13 5179 6659 6672 839 459 -411 C ATOM 3970 N1 DT F 13 19.913 3.693 39.268 1.00 45.56 N ANISOU 3970 N1 DT F 13 5046 6114 6152 852 294 -136 N ATOM 3971 C2 DT F 13 20.800 4.523 38.610 1.00 44.89 C ANISOU 3971 C2 DT F 13 5029 6088 5941 829 52 -20 C ATOM 3972 O2 DT F 13 20.762 4.713 37.413 1.00 44.83 O ANISOU 3972 O2 DT F 13 4879 6243 5912 801 -19 -113 O ATOM 3973 N3 DT F 13 21.755 5.090 39.406 1.00 44.45 N ANISOU 3973 N3 DT F 13 5206 5890 5791 846 -94 202 N ATOM 3974 C4 DT F 13 21.888 4.947 40.776 1.00 44.62 C ANISOU 3974 C4 DT F 13 5409 5740 5805 901 -41 318 C ATOM 3975 O4 DT F 13 22.772 5.509 41.413 1.00 44.33 O ANISOU 3975 O4 DT F 13 5567 5601 5677 923 -197 495 O ATOM 3976 C5 DT F 13 20.907 4.086 41.408 1.00 45.33 C ANISOU 3976 C5 DT F 13 5439 5778 6008 939 219 207 C ATOM 3977 C7 DT F 13 20.959 3.847 42.892 1.00 45.74 C ANISOU 3977 C7 DT F 13 5689 5645 6045 1023 312 331 C ATOM 3978 C6 DT F 13 19.961 3.533 40.636 1.00 45.76 C ANISOU 3978 C6 DT F 13 5257 5954 6177 907 377 -14 C ATOM 3979 H5' DT F 13 15.650 3.714 40.476 1.00 69.75 H ATOM 3980 H5'' DT F 13 14.793 2.507 39.925 1.00 69.75 H ATOM 3981 H4' DT F 13 15.924 3.172 38.131 1.00 66.05 H ATOM 3982 H3' DT F 13 16.687 0.771 38.962 1.00 67.40 H ATOM 3983 H2' DT F 13 18.809 1.303 39.527 1.00 61.18 H ATOM 3984 H2'' DT F 13 19.063 1.120 37.959 1.00 61.18 H ATOM 3985 H1' DT F 13 18.894 3.325 37.560 1.00 58.46 H ATOM 3986 H3 DT F 13 22.330 5.595 39.015 1.00 53.33 H ATOM 3987 H71 DT F 13 20.131 4.149 43.298 1.00 54.89 H ATOM 3988 H72 DT F 13 21.077 2.900 43.063 1.00 54.89 H ATOM 3989 H73 DT F 13 21.704 4.339 43.272 1.00 54.89 H ATOM 3990 H6 DT F 13 19.327 2.983 41.039 1.00 54.92 H ATOM 3991 P DT F 14 17.161 -0.049 36.245 1.00 66.29 P ANISOU 3991 P DT F 14 6498 9190 9501 625 1082 -1158 P ATOM 3992 OP1 DT F 14 16.053 -0.313 35.304 1.00 68.10 O ANISOU 3992 OP1 DT F 14 6433 9626 9816 637 1155 -1498 O ATOM 3993 OP2 DT F 14 17.661 -1.050 37.228 1.00 68.72 O ANISOU 3993 OP2 DT F 14 6869 9265 9976 563 1319 -1032 O ATOM 3994 O5' DT F 14 18.438 0.438 35.400 1.00 63.39 O ANISOU 3994 O5' DT F 14 6186 8903 8996 577 837 -989 O ATOM 3995 C5' DT F 14 18.352 1.628 34.630 1.00 59.92 C ANISOU 3995 C5' DT F 14 5796 8633 8336 658 571 -987 C ATOM 3996 C4' DT F 14 19.697 2.007 34.035 1.00 55.35 C ANISOU 3996 C4' DT F 14 5304 8068 7660 602 387 -787 C ATOM 3997 O4' DT F 14 20.545 2.595 35.058 1.00 51.85 O ANISOU 3997 O4' DT F 14 5150 7428 7122 613 275 -504 O ATOM 3998 C3' DT F 14 20.502 0.844 33.441 1.00 55.40 C ANISOU 3998 C3' DT F 14 5127 8076 7847 459 520 -811 C ATOM 3999 O3' DT F 14 20.978 1.209 32.155 1.00 60.34 O ANISOU 3999 O3' DT F 14 5670 8875 8379 445 368 -828 O ATOM 4000 C2' DT F 14 21.636 0.640 34.447 1.00 51.37 C ANISOU 4000 C2' DT F 14 4817 7332 7368 401 531 -542 C ATOM 4001 C1' DT F 14 21.840 2.054 34.946 1.00 48.82 C ANISOU 4001 C1' DT F 14 4771 6962 6815 499 283 -356 C ATOM 4002 N1 DT F 14 22.505 2.180 36.264 1.00 44.36 N ANISOU 4002 N1 DT F 14 4448 6178 6230 511 264 -131 N ATOM 4003 C2 DT F 14 23.556 3.056 36.394 1.00 43.70 C ANISOU 4003 C2 DT F 14 4558 6032 6015 512 42 81 C ATOM 4004 O2 DT F 14 23.996 3.712 35.473 1.00 43.42 O ANISOU 4004 O2 DT F 14 4512 6095 5890 497 -118 108 O ATOM 4005 N3 DT F 14 24.086 3.126 37.642 1.00 43.55 N ANISOU 4005 N3 DT F 14 4742 5828 5977 540 25 254 N ATOM 4006 C4 DT F 14 23.676 2.450 38.752 1.00 43.98 C ANISOU 4006 C4 DT F 14 4847 5756 6108 580 205 257 C ATOM 4007 O4 DT F 14 24.212 2.606 39.832 1.00 43.94 O ANISOU 4007 O4 DT F 14 5039 5602 6054 627 162 419 O ATOM 4008 C5 DT F 14 22.560 1.552 38.558 1.00 44.65 C ANISOU 4008 C5 DT F 14 4733 5894 6338 573 456 46 C ATOM 4009 C7 DT F 14 22.028 0.741 39.709 1.00 45.33 C ANISOU 4009 C7 DT F 14 4861 5830 6532 618 704 38 C ATOM 4010 C6 DT F 14 22.031 1.466 37.335 1.00 44.80 C ANISOU 4010 C6 DT F 14 4531 6098 6393 534 468 -147 C ATOM 4011 H5' DT F 14 18.042 2.351 35.198 1.00 71.90 H ATOM 4012 H5'' DT F 14 17.714 1.495 33.912 1.00 71.90 H ATOM 4013 H4' DT F 14 19.551 2.667 33.339 1.00 66.42 H ATOM 4014 H3' DT F 14 19.951 0.047 33.385 1.00 66.48 H ATOM 4015 H2' DT F 14 21.360 0.052 35.168 1.00 61.64 H ATOM 4016 H2'' DT F 14 22.434 0.307 34.008 1.00 61.64 H ATOM 4017 H1' DT F 14 22.341 2.558 34.286 1.00 58.58 H ATOM 4018 H3 DT F 14 24.744 3.670 37.748 1.00 52.26 H ATOM 4019 H71 DT F 14 21.097 0.966 39.861 1.00 54.39 H ATOM 4020 H72 DT F 14 22.102 -0.204 39.501 1.00 54.39 H ATOM 4021 H73 DT F 14 22.543 0.936 40.508 1.00 54.39 H ATOM 4022 H6 DT F 14 21.311 0.892 37.202 1.00 53.76 H ATOM 4023 P DC F 15 21.522 0.108 31.128 1.00 64.36 P ANISOU 4023 P DC F 15 5925 9477 9052 318 485 -938 P ATOM 4024 OP1 DC F 15 21.117 0.579 29.779 1.00 67.48 O ANISOU 4024 OP1 DC F 15 6181 10133 9323 386 361 -1100 O ATOM 4025 OP2 DC F 15 21.131 -1.226 31.656 1.00 65.44 O ANISOU 4025 OP2 DC F 15 5900 9517 9446 238 775 -1073 O ATOM 4026 O5' DC F 15 23.111 0.241 31.217 1.00 61.75 O ANISOU 4026 O5' DC F 15 5754 9013 8694 231 381 -651 O ATOM 4027 C5' DC F 15 23.728 1.512 31.030 1.00 58.76 C ANISOU 4027 C5' DC F 15 5583 8638 8105 287 132 -460 C ATOM 4028 C4' DC F 15 25.210 1.438 31.346 1.00 55.12 C ANISOU 4028 C4' DC F 15 5251 8014 7680 187 79 -215 C ATOM 4029 O4' DC F 15 25.411 1.615 32.784 1.00 52.14 O ANISOU 4029 O4' DC F 15 5085 7426 7299 211 75 -55 O ATOM 4030 C3' DC F 15 25.878 0.097 30.989 1.00 55.88 C ANISOU 4030 C3' DC F 15 5157 8089 7986 45 251 -253 C ATOM 4031 O3' DC F 15 27.118 0.312 30.301 1.00 57.66 O ANISOU 4031 O3' DC F 15 5408 8316 8185 -29 137 -113 O ATOM 4032 C2' DC F 15 26.090 -0.561 32.351 1.00 53.53 C ANISOU 4032 C2' DC F 15 4954 7575 7812 16 387 -152 C ATOM 4033 C1' DC F 15 26.345 0.660 33.224 1.00 49.88 C ANISOU 4033 C1' DC F 15 4781 7002 7170 105 187 44 C ATOM 4034 N1 DC F 15 26.185 0.451 34.700 1.00 44.92 N ANISOU 4034 N1 DC F 15 4306 6190 6571 153 267 132 N ATOM 4035 C2 DC F 15 26.959 1.222 35.575 1.00 42.49 C ANISOU 4035 C2 DC F 15 4249 5743 6154 193 101 347 C ATOM 4036 O2 DC F 15 27.741 2.068 35.113 1.00 42.09 O ANISOU 4036 O2 DC F 15 4278 5710 6004 176 -99 452 O ATOM 4037 N3 DC F 15 26.826 1.029 36.896 1.00 42.74 N ANISOU 4037 N3 DC F 15 4424 5623 6191 257 168 424 N ATOM 4038 C4 DC F 15 25.981 0.116 37.358 1.00 43.29 C ANISOU 4038 C4 DC F 15 4409 5660 6379 277 410 314 C ATOM 4039 N4 DC F 15 25.888 -0.026 38.682 1.00 43.62 N ANISOU 4039 N4 DC F 15 4619 5546 6408 358 479 411 N ATOM 4040 C5 DC F 15 25.198 -0.696 36.484 1.00 43.69 C ANISOU 4040 C5 DC F 15 4197 5834 6570 220 599 90 C ATOM 4041 C6 DC F 15 25.329 -0.494 35.179 1.00 43.47 C ANISOU 4041 C6 DC F 15 4018 5972 6525 162 509 0 C ATOM 4042 H5' DC F 15 23.308 2.160 31.616 1.00 70.51 H ATOM 4043 H5'' DC F 15 23.612 1.791 30.108 1.00 70.51 H ATOM 4044 H4' DC F 15 25.667 2.152 30.874 1.00 66.15 H ATOM 4045 H3' DC F 15 25.281 -0.441 30.446 1.00 67.06 H ATOM 4046 HO3' DC F 15 27.835 0.021 30.627 1.00 69.20 H ATOM 4047 H2' DC F 15 25.293 -1.034 32.638 1.00 64.24 H ATOM 4048 H2'' DC F 15 26.862 -1.148 32.339 1.00 64.24 H ATOM 4049 H1' DC F 15 27.240 0.991 33.048 1.00 59.86 H ATOM 4050 H41 DC F 15 25.350 -0.608 39.016 1.00 52.34 H ATOM 4051 H42 DC F 15 26.366 0.465 39.202 1.00 52.34 H ATOM 4052 H5 DC F 15 24.603 -1.328 36.817 1.00 52.43 H ATOM 4053 H6 DC F 15 24.828 -1.003 34.583 1.00 52.16 H TER 4054 DC F 15 HETATM 4055 NI NI A 101 4.200 11.760 13.716 0.97 47.28 NI HETATM 4056 NI NI B 101 2.023 34.591 -16.777 0.85 77.21 NI HETATM 4057 NI NI B 102 25.501 6.537 -14.869 0.61 74.69 NI HETATM 4058 NI NI B 103 5.048 31.041 -6.137 1.00112.85 NI HETATM 4059 NI NI E 101 27.768 3.026 43.751 1.00 58.98 NI HETATM 4060 NI NI E 102 6.762 33.025 41.399 0.78 83.62 NI HETATM 4061 C1 MPD F 101 10.456 0.094 48.296 0.47 90.46 C HETATM 4062 C2 MPD F 101 11.461 -0.514 47.313 0.47 90.86 C HETATM 4063 O2 MPD F 101 12.369 0.551 46.921 0.47 90.77 O HETATM 4064 CM MPD F 101 12.313 -1.609 47.966 0.47 90.50 C HETATM 4065 C3 MPD F 101 10.733 -1.094 46.092 0.47 90.58 C HETATM 4066 C4 MPD F 101 10.290 -0.045 45.076 0.47 90.41 C HETATM 4067 O4 MPD F 101 11.409 0.677 44.610 0.47 90.53 O HETATM 4068 C5 MPD F 101 9.607 -0.710 43.888 0.47 90.02 C HETATM 4069 H11 MPD F 101 9.446 -0.024 47.903 0.47108.55 H HETATM 4070 H12 MPD F 101 10.673 1.154 48.428 0.47108.55 H HETATM 4071 H13 MPD F 101 10.534 -0.416 49.257 0.47108.55 H HETATM 4072 HO2 MPD F 101 12.325 0.676 45.950 0.47108.92 H HETATM 4073 HM1 MPD F 101 12.199 -2.539 47.408 0.47108.59 H HETATM 4074 HM2 MPD F 101 11.984 -1.760 48.994 0.47108.59 H HETATM 4075 HM3 MPD F 101 13.360 -1.307 47.960 0.47108.59 H HETATM 4076 H31 MPD F 101 11.392 -1.808 45.596 0.47108.70 H HETATM 4077 H32 MPD F 101 9.857 -1.645 46.433 0.47108.70 H HETATM 4078 H4 MPD F 101 9.583 0.632 45.555 0.47108.50 H HETATM 4079 HO4 MPD F 101 11.244 1.637 44.711 0.47108.63 H HETATM 4080 H51 MPD F 101 10.148 -0.465 42.974 0.47108.03 H HETATM 4081 H52 MPD F 101 9.602 -1.790 44.030 0.47108.03 H HETATM 4082 H53 MPD F 101 8.581 -0.349 43.811 0.47108.03 H HETATM 4083 C1 MPD F 102 10.698 1.901 41.934 0.89 70.92 C HETATM 4084 C2 MPD F 102 9.729 1.830 40.742 0.89 71.54 C HETATM 4085 O2 MPD F 102 10.059 0.597 40.049 0.89 71.36 O HETATM 4086 CM MPD F 102 8.272 1.646 41.202 0.89 71.43 C HETATM 4087 C3 MPD F 102 9.896 3.078 39.852 0.89 70.25 C HETATM 4088 C4 MPD F 102 9.940 2.829 38.349 0.89 68.87 C HETATM 4089 O4 MPD F 102 9.467 3.991 37.704 0.89 68.99 O HETATM 4090 C5 MPD F 102 11.353 2.500 37.871 0.89 67.14 C HETATM 4091 H11 MPD F 102 11.281 2.820 41.874 0.89 85.11 H HETATM 4092 H12 MPD F 102 10.130 1.890 42.864 0.89 85.11 H HETATM 4093 H13 MPD F 102 11.369 1.042 41.908 0.89 85.11 H HETATM 4094 HO2 MPD F 102 10.329 0.801 39.130 0.89 85.63 H HETATM 4095 HM1 MPD F 102 7.658 2.448 40.793 0.89 85.72 H HETATM 4096 HM2 MPD F 102 8.228 1.672 42.290 0.89 85.72 H HETATM 4097 HM3 MPD F 102 7.898 0.685 40.846 0.89 85.72 H HETATM 4098 H31 MPD F 102 9.073 3.762 40.062 0.89 84.30 H HETATM 4099 H32 MPD F 102 10.814 3.587 40.143 0.89 84.30 H HETATM 4100 H4 MPD F 102 9.289 1.987 38.116 0.89 82.65 H HETATM 4101 HO4 MPD F 102 8.731 3.754 37.102 0.89 82.79 H HETATM 4102 H51 MPD F 102 11.670 3.242 37.139 0.89 80.56 H HETATM 4103 H52 MPD F 102 11.360 1.511 37.413 0.89 80.56 H HETATM 4104 H53 MPD F 102 12.036 2.511 38.720 0.89 80.56 H HETATM 4105 C1 MPD F 103 14.200 1.457 34.170 0.84 70.53 C HETATM 4106 C2 MPD F 103 13.369 2.651 33.681 0.84 70.72 C HETATM 4107 O2 MPD F 103 12.826 2.331 32.370 0.84 72.16 O HETATM 4108 CM MPD F 103 12.166 2.882 34.594 0.84 69.11 C HETATM 4109 C3 MPD F 103 14.244 3.912 33.578 0.84 69.93 C HETATM 4110 C4 MPD F 103 15.187 3.871 32.366 0.84 69.09 C HETATM 4111 O4 MPD F 103 14.640 4.647 31.324 0.84 70.41 O HETATM 4112 C5 MPD F 103 16.588 4.414 32.640 0.84 67.84 C HETATM 4113 H11 MPD F 103 15.229 1.775 34.335 0.84 84.64 H HETATM 4114 H12 MPD F 103 13.781 1.082 35.104 0.84 84.64 H HETATM 4115 H13 MPD F 103 14.179 0.668 33.419 0.84 84.64 H HETATM 4116 HO2 MPD F 103 13.139 2.990 31.716 0.84 86.59 H HETATM 4117 HM1 MPD F 103 12.192 3.902 34.977 0.84 82.94 H HETATM 4118 HM2 MPD F 103 11.247 2.729 34.029 0.84 82.94 H HETATM 4119 HM3 MPD F 103 12.203 2.180 35.427 0.84 82.94 H HETATM 4120 H31 MPD F 103 14.834 4.014 34.488 0.84 83.92 H HETATM 4121 H32 MPD F 103 13.601 4.789 33.501 0.84 83.92 H HETATM 4122 H4 MPD F 103 15.279 2.836 32.038 0.84 82.91 H HETATM 4123 HO4 MPD F 103 14.943 4.295 30.461 0.84 84.50 H HETATM 4124 H51 MPD F 103 16.794 5.246 31.967 0.84 81.41 H HETATM 4125 H52 MPD F 103 17.322 3.625 32.476 0.84 81.41 H HETATM 4126 H53 MPD F 103 16.649 4.758 33.673 0.84 81.41 H HETATM 4127 O HOH A 201 14.905 9.889 2.763 1.00 44.35 O HETATM 4128 O HOH A 202 13.419 8.362 1.083 1.00 61.59 O HETATM 4129 O HOH A 203 7.719 7.223 0.910 1.00 47.39 O HETATM 4130 O HOH A 204 19.785 20.215 12.281 1.00 47.70 O HETATM 4131 O HOH A 205 18.935 18.302 -3.333 1.00 24.32 O HETATM 4132 O HOH A 206 5.071 10.223 14.140 1.00 37.29 O HETATM 4133 O HOH A 207 14.815 9.047 -0.757 1.00 47.36 O HETATM 4134 O HOH A 208 9.540 11.344 6.649 1.00 30.34 O HETATM 4135 O HOH A 209 3.075 20.573 4.566 1.00 39.58 O HETATM 4136 O HOH A 210 23.411 5.527 6.774 1.00 57.35 O HETATM 4137 O HOH A 211 26.891 16.533 2.344 1.00 40.07 O HETATM 4138 O HOH A 212 7.717 22.495 8.014 1.00 48.77 O HETATM 4139 O HOH A 213 16.943 9.911 15.518 1.00 41.32 O HETATM 4140 O HOH A 214 22.114 10.101 2.774 1.00 37.22 O HETATM 4141 O HOH A 215 25.908 10.159 -4.072 1.00 51.83 O HETATM 4142 O HOH A 216 19.822 9.261 7.474 1.00 34.64 O HETATM 4143 O HOH A 217 25.824 9.437 3.220 1.00 34.68 O HETATM 4144 O HOH A 218 26.403 16.609 8.241 1.00 32.55 O HETATM 4145 O HOH A 219 15.235 16.677 14.594 1.00 42.86 O HETATM 4146 O HOH A 220 26.094 23.055 -0.579 1.00 59.57 O HETATM 4147 O HOH A 221 18.608 13.493 13.406 1.00 44.30 O HETATM 4148 O HOH A 222 29.246 13.091 2.007 1.00 50.63 O HETATM 4149 O HOH A 223 11.579 22.011 -7.561 1.00 52.63 O HETATM 4150 O HOH A 224 15.151 13.682 -1.933 1.00 29.89 O HETATM 4151 O HOH A 225 13.906 32.242 8.307 1.00 38.62 O HETATM 4152 O HOH A 226 2.027 17.907 4.138 1.00 50.41 O HETATM 4153 O HOH A 227 1.777 17.171 10.756 1.00 48.61 O HETATM 4154 O HOH A 228 7.226 24.619 6.468 1.00 43.67 O HETATM 4155 O HOH A 229 19.947 28.521 -3.506 1.00 37.33 O HETATM 4156 O HOH A 230 4.824 12.847 5.201 1.00 43.54 O HETATM 4157 O HOH A 231 3.909 8.324 4.384 1.00 64.68 O HETATM 4158 O HOH A 232 21.097 22.030 -6.492 1.00 44.98 O HETATM 4159 O HOH A 233 25.094 19.211 8.462 1.00 32.76 O HETATM 4160 O HOH A 234 25.686 8.749 12.187 1.00 48.19 O HETATM 4161 O HOH A 235 13.814 11.419 -2.320 1.00 43.68 O HETATM 4162 O HOH A 236 22.916 22.617 -6.640 1.00 57.19 O HETATM 4163 O HOH A 237 22.576 11.029 12.013 1.00 47.23 O HETATM 4164 O HOH A 238 8.012 23.745 11.001 1.00 49.84 O HETATM 4165 O HOH A 239 16.978 8.947 7.171 1.00 43.24 O HETATM 4166 O HOH A 240 28.249 17.859 6.357 1.00 42.92 O HETATM 4167 O HOH A 241 14.653 10.263 -5.221 1.00 44.96 O HETATM 4168 O HOH A 242 -0.610 22.050 6.448 1.00 64.07 O HETATM 4169 O HOH A 243 8.423 21.333 12.835 1.00 56.58 O HETATM 4170 O HOH A 244 16.289 7.981 4.615 1.00 44.33 O HETATM 4171 O HOH A 245 29.122 17.185 4.154 1.00 51.73 O HETATM 4172 O HOH A 246 21.482 8.123 4.957 1.00 40.45 O HETATM 4173 O HOH A 247 0.229 23.471 5.388 1.00 59.59 O HETATM 4174 O HOH A 248 13.973 34.376 6.571 1.00 57.35 O HETATM 4175 O HOH A 249 -1.254 22.507 -2.638 1.00 62.79 O HETATM 4176 O HOH B 201 11.835 28.862 -5.748 1.00 46.71 O HETATM 4177 O HOH B 202 15.775 8.123 -12.132 1.00 50.52 O HETATM 4178 O HOH B 203 15.502 7.895 -18.743 1.00 68.39 O HETATM 4179 O HOH B 204 9.993 35.396 -15.783 1.00 70.94 O HETATM 4180 O HOH B 205 23.192 9.308 -18.493 1.00 57.19 O HETATM 4181 O HOH B 206 32.313 5.264 -9.140 1.00 47.25 O HETATM 4182 O HOH B 207 27.472 6.963 -14.341 1.00 55.27 O HETATM 4183 O HOH B 208 11.881 13.861 -10.017 1.00 52.12 O HETATM 4184 O HOH B 209 8.387 22.602 -0.568 1.00 31.41 O HETATM 4185 O HOH B 210 3.877 26.546 -8.173 1.00 32.31 O HETATM 4186 O HOH B 211 25.544 7.125 -4.395 1.00 63.68 O HETATM 4187 O HOH B 212 6.466 35.639 -7.335 1.00 38.28 O HETATM 4188 O HOH B 213 13.804 9.980 -10.298 1.00 48.24 O HETATM 4189 O HOH B 214 10.228 21.981 -2.804 1.00 36.58 O HETATM 4190 O HOH B 215 10.170 31.954 -13.656 1.00 60.06 O HETATM 4191 O HOH B 216 30.603 12.517 -0.061 1.00 43.28 O HETATM 4192 O HOH B 217 24.488 12.683 -10.316 1.00 48.23 O HETATM 4193 O HOH B 218 12.482 6.550 -20.260 1.00 57.23 O HETATM 4194 O HOH B 219 11.743 16.189 -8.849 1.00 65.67 O HETATM 4195 O HOH B 220 10.086 22.841 -6.334 1.00 40.50 O HETATM 4196 O HOH B 221 26.297 2.937 -3.394 1.00 36.29 O HETATM 4197 O HOH B 222 10.134 37.886 -18.265 1.00 65.80 O HETATM 4198 O HOH B 223 24.407 1.620 -4.068 1.00 70.26 O HETATM 4199 O HOH B 224 9.190 35.920 -17.698 1.00 59.67 O HETATM 4200 O HOH B 225 12.652 20.262 -8.781 1.00 50.85 O HETATM 4201 O HOH B 226 10.730 5.494 -18.231 1.00 63.07 O HETATM 4202 O HOH C 101 18.641 8.126 1.056 1.00 42.37 O HETATM 4203 O HOH C 102 24.526 3.424 -13.745 1.00 39.88 O HETATM 4204 O HOH C 103 25.992 20.532 -6.055 1.00 54.79 O HETATM 4205 O HOH C 104 1.912 33.619 -0.916 1.00 57.77 O HETATM 4206 O HOH C 105 13.926 21.643 -10.990 1.00 51.15 O HETATM 4207 O HOH C 106 18.715 12.272 1.095 1.00 25.32 O HETATM 4208 O HOH C 107 15.236 7.612 -4.604 1.00 36.82 O HETATM 4209 O HOH C 108 17.463 15.792 -3.894 1.00 27.27 O HETATM 4210 O HOH C 109 20.218 19.278 -5.639 1.00 34.28 O HETATM 4211 O HOH C 110 22.656 11.739 -0.621 1.00 37.91 O HETATM 4212 O HOH C 111 15.803 23.437 -12.777 1.00 46.91 O HETATM 4213 O HOH C 112 4.018 30.916 -16.840 1.00 51.27 O HETATM 4214 O HOH C 113 3.941 34.737 -6.112 1.00 53.68 O HETATM 4215 O HOH C 114 15.679 11.507 -7.049 1.00 37.93 O HETATM 4216 O HOH C 115 0.312 26.288 -1.743 1.00 64.64 O HETATM 4217 O HOH C 116 3.375 23.135 -11.143 1.00 41.30 O HETATM 4218 O HOH C 117 13.575 17.711 -8.581 1.00 39.86 O HETATM 4219 O HOH C 118 -1.757 27.606 -15.278 1.00 53.14 O HETATM 4220 O HOH C 119 22.830 24.740 -12.104 1.00 60.03 O HETATM 4221 O HOH C 120 18.199 0.940 -11.664 1.00 46.74 O HETATM 4222 O HOH C 121 1.665 27.527 -19.004 1.00 58.52 O HETATM 4223 O HOH C 122 0.484 32.265 -15.607 1.00 65.63 O HETATM 4224 O HOH C 123 19.235 3.000 -12.802 1.00 57.66 O HETATM 4225 O HOH C 124 24.137 14.566 -9.991 1.00 52.80 O HETATM 4226 O HOH C 125 20.188 -7.255 -9.382 1.00 46.16 O HETATM 4227 O HOH C 126 1.178 23.971 -1.862 1.00 62.09 O HETATM 4228 O HOH C 127 -0.666 27.748 2.823 1.00 52.60 O HETATM 4229 O HOH C 128 -0.796 25.110 1.388 1.00 63.62 O HETATM 4230 O HOH D 101 18.943 23.852 13.922 1.00 56.76 O HETATM 4231 O HOH D 102 29.124 17.707 26.847 1.00 57.87 O HETATM 4232 O HOH D 103 7.115 22.247 23.401 1.00 51.89 O HETATM 4233 O HOH D 104 2.680 16.303 25.850 1.00 38.58 O HETATM 4234 O HOH D 105 23.845 17.196 33.871 1.00 57.02 O HETATM 4235 O HOH D 106 18.105 31.036 23.995 1.00 39.08 O HETATM 4236 O HOH D 107 17.154 7.689 21.697 1.00 51.39 O HETATM 4237 O HOH D 108 17.483 12.923 32.880 1.00 46.70 O HETATM 4238 O HOH D 109 21.284 11.794 26.571 1.00 44.22 O HETATM 4239 O HOH D 110 15.676 20.229 11.733 1.00 43.07 O HETATM 4240 O HOH D 111 7.044 16.752 20.173 1.00 31.80 O HETATM 4241 O HOH D 112 10.305 29.260 23.537 1.00 44.62 O HETATM 4242 O HOH D 113 15.755 19.182 15.736 1.00 49.88 O HETATM 4243 O HOH D 114 -3.437 13.797 33.645 1.00 44.26 O HETATM 4244 O HOH D 115 13.799 22.512 30.608 1.00 24.60 O HETATM 4245 O HOH D 116 16.476 23.013 29.702 1.00 23.71 O HETATM 4246 O HOH D 117 13.995 18.278 35.301 1.00 37.06 O HETATM 4247 O HOH D 118 21.161 24.812 13.755 1.00 42.80 O HETATM 4248 O HOH D 119 21.686 7.874 18.068 1.00 55.03 O HETATM 4249 O HOH D 120 17.049 33.511 37.617 1.00 42.49 O HETATM 4250 O HOH D 121 23.670 27.917 26.771 1.00 57.17 O HETATM 4251 O HOH D 122 9.530 30.317 29.354 1.00 51.13 O HETATM 4252 O HOH D 123 7.053 11.669 21.266 1.00 35.43 O HETATM 4253 O HOH D 124 7.174 19.203 32.997 1.00 40.51 O HETATM 4254 O HOH D 125 8.280 27.079 18.860 1.00 44.22 O HETATM 4255 O HOH D 126 16.331 23.918 10.909 1.00 43.93 O HETATM 4256 O HOH D 127 17.977 30.431 18.248 1.00 47.73 O HETATM 4257 O HOH D 128 12.991 32.742 14.575 1.00 47.59 O HETATM 4258 O HOH D 129 26.989 23.096 22.815 1.00 49.31 O HETATM 4259 O HOH D 130 24.256 24.813 31.495 1.00 50.66 O HETATM 4260 O HOH D 131 10.038 18.208 35.944 1.00 63.53 O HETATM 4261 O HOH D 132 25.080 19.700 15.102 1.00 40.93 O HETATM 4262 O HOH D 133 8.905 19.900 35.018 1.00 45.72 O HETATM 4263 O HOH D 134 24.243 16.454 31.822 1.00 50.30 O HETATM 4264 O HOH D 135 21.101 12.115 14.237 1.00 37.25 O HETATM 4265 O HOH D 136 13.671 7.355 22.695 1.00 44.43 O HETATM 4266 O HOH D 137 27.909 20.972 26.789 1.00 48.94 O HETATM 4267 O HOH D 138 26.689 20.621 29.831 1.00 41.85 O HETATM 4268 O HOH D 139 18.803 9.580 20.359 1.00 38.67 O HETATM 4269 O HOH D 140 12.085 33.841 19.672 1.00 43.24 O HETATM 4270 O HOH D 141 18.424 9.799 16.586 1.00 72.17 O HETATM 4271 O HOH D 142 26.522 18.019 30.769 1.00 56.68 O HETATM 4272 O HOH D 143 4.893 18.734 33.978 1.00 51.69 O HETATM 4273 O HOH D 144 17.311 21.261 10.913 1.00 54.72 O HETATM 4274 O HOH D 145 25.565 10.866 11.974 1.00 40.97 O HETATM 4275 O HOH D 146 8.291 20.838 29.035 1.00 29.41 O HETATM 4276 O HOH D 147 7.213 24.525 19.333 1.00 49.39 O HETATM 4277 O HOH D 148 18.873 8.261 17.702 1.00 52.44 O HETATM 4278 O HOH D 149 7.593 21.645 31.751 1.00 35.18 O HETATM 4279 O HOH D 150 24.941 28.390 29.408 1.00 47.81 O HETATM 4280 O HOH D 151 19.933 9.876 15.264 1.00 46.29 O HETATM 4281 O HOH D 152 7.873 28.609 21.380 1.00 44.53 O HETATM 4282 O HOH D 153 5.844 24.281 21.865 1.00 46.68 O HETATM 4283 O HOH E 201 6.073 33.302 31.421 1.00 50.39 O HETATM 4284 O HOH E 202 9.309 30.799 45.244 1.00 54.21 O HETATM 4285 O HOH E 203 9.955 35.855 28.644 1.00 59.26 O HETATM 4286 O HOH E 204 32.894 10.811 43.599 1.00 47.86 O HETATM 4287 O HOH E 205 27.671 1.086 42.708 1.00 32.20 O HETATM 4288 O HOH E 206 5.693 28.000 41.978 1.00 61.05 O HETATM 4289 O HOH E 207 18.860 8.368 27.661 1.00 36.22 O HETATM 4290 O HOH E 208 5.687 39.319 34.954 1.00 72.14 O HETATM 4291 O HOH E 209 26.135 10.441 40.887 1.00 52.55 O HETATM 4292 O HOH E 210 26.903 -2.847 40.787 1.00 47.30 O HETATM 4293 O HOH E 211 17.129 13.555 29.511 1.00 23.59 O HETATM 4294 O HOH E 212 28.305 13.183 36.974 1.00 43.46 O HETATM 4295 O HOH E 213 6.197 36.205 38.874 1.00 48.39 O HETATM 4296 O HOH E 214 7.052 20.696 36.907 1.00 58.30 O HETATM 4297 O HOH E 215 35.069 12.021 37.510 1.00 28.04 O HETATM 4298 O HOH E 216 27.509 7.477 42.588 1.00 39.44 O HETATM 4299 O HOH E 217 17.050 11.857 27.155 1.00 27.92 O HETATM 4300 O HOH E 218 28.373 5.020 44.455 1.00 45.85 O HETATM 4301 O HOH E 219 20.114 13.121 28.511 1.00 35.45 O HETATM 4302 O HOH E 220 19.633 5.806 34.661 1.00 36.99 O HETATM 4303 O HOH E 221 30.604 12.641 40.360 1.00 55.28 O HETATM 4304 O HOH E 222 14.017 23.609 43.823 1.00 56.21 O HETATM 4305 O HOH E 223 31.164 14.264 38.424 1.00 58.20 O HETATM 4306 O HOH E 224 23.998 13.021 40.049 1.00 68.02 O HETATM 4307 O HOH E 225 6.200 27.898 44.394 1.00 54.05 O HETATM 4308 O HOH E 226 7.658 29.849 44.766 1.00 60.04 O HETATM 4309 O HOH E 227 29.177 9.163 44.119 1.00 58.29 O HETATM 4310 O HOH E 228 30.545 14.216 42.774 1.00 42.91 O HETATM 4311 O HOH F 201 -2.631 27.478 38.280 1.00 42.37 O HETATM 4312 O HOH F 202 5.318 23.259 30.731 1.00 31.29 O HETATM 4313 O HOH F 203 -2.178 38.797 43.668 1.00 58.27 O HETATM 4314 O HOH F 204 27.588 3.808 33.429 1.00 52.44 O HETATM 4315 O HOH F 205 17.827 17.057 37.329 1.00 50.61 O HETATM 4316 O HOH F 206 23.196 -2.183 32.807 1.00 49.01 O HETATM 4317 O HOH F 207 11.242 28.513 27.010 1.00 43.35 O HETATM 4318 O HOH F 208 9.177 22.365 33.518 1.00 29.02 O HETATM 4319 O HOH F 209 14.408 9.265 43.468 1.00 61.34 O HETATM 4320 O HOH F 210 11.000 24.910 25.268 1.00 22.81 O HETATM 4321 O HOH F 211 -6.658 26.235 38.160 1.00 50.27 O HETATM 4322 O HOH F 212 19.132 0.396 42.707 1.00 60.22 O HETATM 4323 O HOH F 213 5.666 23.068 38.315 1.00 46.35 O HETATM 4324 O HOH F 214 11.248 21.105 28.555 1.00 28.55 O HETATM 4325 O HOH F 215 17.759 23.974 32.212 1.00 28.02 O HETATM 4326 O HOH F 216 2.652 26.455 38.892 1.00 48.57 O HETATM 4327 O HOH F 217 -4.447 24.640 30.247 1.00 52.75 O HETATM 4328 O HOH F 218 1.490 31.597 31.024 1.00 59.10 O HETATM 4329 O HOH F 219 14.354 28.968 36.218 1.00 49.24 O HETATM 4330 O HOH F 220 24.192 1.115 42.497 1.00 63.33 O HETATM 4331 O HOH F 221 16.892 -2.940 33.883 1.00 56.91 O HETATM 4332 O HOH F 222 16.056 6.256 37.976 1.00 43.48 O HETATM 4333 O HOH F 223 20.777 23.819 33.062 1.00 40.54 O HETATM 4334 O HOH F 224 21.594 28.379 32.433 1.00 62.60 O HETATM 4335 O HOH F 225 7.165 22.313 27.220 1.00 46.61 O HETATM 4336 O HOH F 226 16.597 5.476 36.095 1.00 49.59 O HETATM 4337 O HOH F 227 18.840 -1.624 40.522 1.00 56.51 O HETATM 4338 O HOH F 228 5.963 26.872 22.429 1.00 48.22 O CONECT 307 4055 CONECT 1084 4056 CONECT 1241 1263 CONECT 1263 1241 1265 1280 1281 CONECT 1264 1265 1266 1282 1283 CONECT 1265 1263 1264 CONECT 1266 1264 1267 1268 1284 CONECT 1267 1266 1271 CONECT 1268 1266 1269 1270 1285 CONECT 1269 1268 1293 CONECT 1270 1268 1271 1286 1287 CONECT 1271 1267 1270 1272 1288 CONECT 1272 1271 1273 1279 CONECT 1273 1272 1274 1275 CONECT 1274 1273 CONECT 1275 1273 1276 CONECT 1276 1275 1277 1278 CONECT 1277 1276 1289 1290 CONECT 1278 1276 1279 1291 CONECT 1279 1272 1278 1292 CONECT 1280 1263 CONECT 1281 1263 CONECT 1282 1264 CONECT 1283 1264 CONECT 1284 1266 CONECT 1285 1268 CONECT 1286 1270 CONECT 1287 1270 CONECT 1288 1271 CONECT 1289 1277 CONECT 1290 1277 CONECT 1291 1278 CONECT 1292 1279 CONECT 1293 1269 CONECT 1434 4057 CONECT 2301 4055 CONECT 3144 4059 CONECT 3301 3323 CONECT 3323 3301 3325 3340 3341 CONECT 3324 3325 3326 3342 3343 CONECT 3325 3323 3324 CONECT 3326 3324 3327 3328 3344 CONECT 3327 3326 3331 CONECT 3328 3326 3329 3330 3345 CONECT 3329 3328 3353 CONECT 3330 3328 3331 3346 3347 CONECT 3331 3327 3330 3332 3348 CONECT 3332 3331 3333 3339 CONECT 3333 3332 3334 3335 CONECT 3334 3333 CONECT 3335 3333 3336 CONECT 3336 3335 3337 3338 CONECT 3337 3336 3349 3350 CONECT 3338 3336 3339 3351 CONECT 3339 3332 3338 3352 CONECT 3340 3323 CONECT 3341 3323 CONECT 3342 3324 CONECT 3343 3324 CONECT 3344 3326 CONECT 3345 3328 CONECT 3346 3330 CONECT 3347 3330 CONECT 3348 3331 CONECT 3349 3337 CONECT 3350 3337 CONECT 3351 3338 CONECT 3352 3339 CONECT 3353 3329 CONECT 4055 307 2301 4132 CONECT 4056 1084 CONECT 4057 1434 4182 CONECT 4059 3144 4287 4300 CONECT 4061 4062 4069 4070 4071 CONECT 4062 4061 4063 4064 4065 CONECT 4063 4062 4072 CONECT 4064 4062 4073 4074 4075 CONECT 4065 4062 4066 4076 4077 CONECT 4066 4065 4067 4068 4078 CONECT 4067 4066 4079 CONECT 4068 4066 4080 4081 4082 CONECT 4069 4061 CONECT 4070 4061 CONECT 4071 4061 CONECT 4072 4063 CONECT 4073 4064 CONECT 4074 4064 CONECT 4075 4064 CONECT 4076 4065 CONECT 4077 4065 CONECT 4078 4066 CONECT 4079 4067 CONECT 4080 4068 CONECT 4081 4068 CONECT 4082 4068 CONECT 4083 4084 4091 4092 4093 CONECT 4084 4083 4085 4086 4087 CONECT 4085 4084 4094 CONECT 4086 4084 4095 4096 4097 CONECT 4087 4084 4088 4098 4099 CONECT 4088 4087 4089 4090 4100 CONECT 4089 4088 4101 CONECT 4090 4088 4102 4103 4104 CONECT 4091 4083 CONECT 4092 4083 CONECT 4093 4083 CONECT 4094 4085 CONECT 4095 4086 CONECT 4096 4086 CONECT 4097 4086 CONECT 4098 4087 CONECT 4099 4087 CONECT 4100 4088 CONECT 4101 4089 CONECT 4102 4090 CONECT 4103 4090 CONECT 4104 4090 CONECT 4105 4106 4113 4114 4115 CONECT 4106 4105 4107 4108 4109 CONECT 4107 4106 4116 CONECT 4108 4106 4117 4118 4119 CONECT 4109 4106 4110 4120 4121 CONECT 4110 4109 4111 4112 4122 CONECT 4111 4110 4123 CONECT 4112 4110 4124 4125 4126 CONECT 4113 4105 CONECT 4114 4105 CONECT 4115 4105 CONECT 4116 4107 CONECT 4117 4108 CONECT 4118 4108 CONECT 4119 4108 CONECT 4120 4109 CONECT 4121 4109 CONECT 4122 4110 CONECT 4123 4111 CONECT 4124 4112 CONECT 4125 4112 CONECT 4126 4112 CONECT 4132 4055 CONECT 4182 4057 CONECT 4287 4059 CONECT 4300 4059 MASTER 893 0 11 6 0 0 14 6 2497 6 143 18 END
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Related entries of code: 5jlw
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5jlx
RCSB PDB
PDBbind
15aa, >5JLX_2|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5jlw
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Homeotic protein antennapedia, Antp homeodomain
Ligand Name
RP-monothioated duplex DNA
EC.Number
E.C.-.-.-.-
Resolution
2.09(Å)
Affinity (Kd/Ki/IC50)
Kd=3nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Chembiochem Vol. 17: pp. 1636-1642
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):
P02833
Entrez Gene ID
NCBI Entrez Gene ID:
40835
ASD
Information of known allosteric effects of PDB entries
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