Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 13-APR-12 4ENJ TITLE CRYSTAL STRUCTURE OF S. POMBE ATL1 IN COMPLEX WITH DAMAGED DNA TITLE 2 CONTAINING O6-HYDROXYETHYLGUANINE COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALKYLTRANSFERASE-LIKE PROTEIN 1; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA (5'-D(*GP*CP*CP*AP*TP*GP*(EHG)P*CP*TP*AP*GP*TP*A)-3'); COMPND 7 CHAIN: B; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 3; COMPND 10 MOLECULE: DNA (5'-D(*CP*TP*AP*CP*TP*AP*GP*CP*CP*AP*TP*GP*G)-3'); COMPND 11 CHAIN: C; COMPND 12 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; SOURCE 3 ORGANISM_COMMON: FISSION YEAST; SOURCE 4 ORGANISM_TAXID: 284812; SOURCE 5 STRAIN: 972 / ATCC 24843; SOURCE 6 GENE: ATL1, SPAC1250.04C; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 MOL_ID: 2; SOURCE 10 SYNTHETIC: YES; SOURCE 11 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 12 ORGANISM_TAXID: 32630; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES; SOURCE 15 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 16 ORGANISM_TAXID: 32630 KEYWDS ALKYLTRANSFERASE, DNA REPAIR, NUCLEOTIDE EXCISION REPAIR, NER, BASE KEYWDS 2 REPAIR, DNA, DNA DAMAGE, GUANINE, ALKYLATION, DNA BINDING PROTEIN- KEYWDS 3 DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.L.TUBBS,A.S.ARVAI,J.A.TAINER REVDAT 2 01-AUG-12 4ENJ 1 JRNL REVDAT 1 20-JUN-12 4ENJ 0 JRNL AUTH V.F.LATYPOV,J.L.TUBBS,A.J.WATSON,A.S.MARRIOTT,G.MCGOWN, JRNL AUTH 2 M.THORNCROFT,O.J.WILKINSON,P.SENTHONG,A.BUTT,A.S.ARVAI, JRNL AUTH 3 C.L.MILLINGTON,A.C.POVEY,D.M.WILLIAMS,M.F.SANTIBANEZ-KOREF, JRNL AUTH 4 J.A.TAINER,G.P.MARGISON JRNL TITL ATL1 REGULATES CHOICE BETWEEN GLOBAL GENOME AND JRNL TITL 2 TRANSCRIPTION-COUPLED REPAIR OF O(6)-ALKYLGUANINES. JRNL REF MOL.CELL V. 47 50 2012 JRNL REFN ISSN 1097-2765 JRNL PMID 22658721 JRNL DOI 10.1016/J.MOLCEL.2012.04.028 REMARK 2 REMARK 2 RESOLUTION. 3.10 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: 1.6.1_357) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VICENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE- REMARK 3 : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO, REMARK 3 : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL REMARK 3 : MORIARTY,REETAL PAI,RANDY READ,JANE REMARK 3 : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM REMARK 3 : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH, REMARK 3 : LAURENT STORONI,TOM TERWILLIGER,PETER REMARK 3 : ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 3.10 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 38.67 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.170 REMARK 3 COMPLETENESS FOR RANGE (%) : 89.5 REMARK 3 NUMBER OF REFLECTIONS : 4488 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.231 REMARK 3 R VALUE (WORKING SET) : 0.225 REMARK 3 FREE R VALUE : 0.283 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.980 REMARK 3 FREE R VALUE TEST SET COUNT : 448 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 38.6769 - 4.4678 0.98 1574 178 0.2067 0.2693 REMARK 3 2 4.4678 - 3.5470 0.94 1389 153 0.2377 0.2736 REMARK 3 3 3.5470 - 3.0989 0.75 1077 117 0.2906 0.3659 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : 0.32 REMARK 3 B_SOL : 113.26 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.430 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 30.440 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) : 15.51580 REMARK 3 B22 (A**2) : 15.51580 REMARK 3 B33 (A**2) : -31.03150 REMARK 3 B12 (A**2) : -0.00000 REMARK 3 B13 (A**2) : -0.00000 REMARK 3 B23 (A**2) : -0.00000 REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.010 1507 REMARK 3 ANGLE : 1.593 2144 REMARK 3 CHIRALITY : 0.082 226 REMARK 3 PLANARITY : 0.007 186 REMARK 3 DIHEDRAL : 26.194 615 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 24 REMARK 3 TLS GROUP : 1 REMARK 3 SELECTION: (chain A and resid 1:5) REMARK 3 ORIGIN FOR THE GROUP (A): 38.1934 -20.1199 21.4299 REMARK 3 T TENSOR REMARK 3 T11: 1.6580 T22: 1.5022 REMARK 3 T33: 1.4553 T12: -0.0554 REMARK 3 T13: 0.3147 T23: -0.3732 REMARK 3 L TENSOR REMARK 3 L11: -0.0143 L22: 0.1430 REMARK 3 L33: -0.0615 L12: -0.3418 REMARK 3 L13: 0.0280 L23: -0.0079 REMARK 3 S TENSOR REMARK 3 S11: -1.1500 S12: 0.6627 S13: -3.1330 REMARK 3 S21: 0.1132 S22: 0.4176 S23: 0.4414 REMARK 3 S31: -0.1790 S32: -1.6492 S33: 0.0000 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: (chain A and resid 6:10) REMARK 3 ORIGIN FOR THE GROUP (A): 36.8162 -17.8562 14.8965 REMARK 3 T TENSOR REMARK 3 T11: 1.1908 T22: 1.1513 REMARK 3 T33: 1.6846 T12: -0.1972 REMARK 3 T13: -0.1076 T23: -0.2200 REMARK 3 L TENSOR REMARK 3 L11: 0.0198 L22: -0.0211 REMARK 3 L33: 0.1178 L12: -0.0229 REMARK 3 L13: 0.0197 L23: -0.0845 REMARK 3 S TENSOR REMARK 3 S11: -0.0455 S12: -2.0238 S13: -2.1336 REMARK 3 S21: 0.6338 S22: -1.0828 S23: 0.7612 REMARK 3 S31: -0.9247 S32: 1.5040 S33: -0.0000 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: (chain A and resid 11:16) REMARK 3 ORIGIN FOR THE GROUP (A): 37.4157 -12.3895 8.6081 REMARK 3 T TENSOR REMARK 3 T11: 1.4676 T22: 1.2117 REMARK 3 T33: 2.1587 T12: -0.2110 REMARK 3 T13: 0.5797 T23: 0.2598 REMARK 3 L TENSOR REMARK 3 L11: 0.1574 L22: 0.0993 REMARK 3 L33: -0.0052 L12: -0.0659 REMARK 3 L13: 0.1889 L23: -0.1627 REMARK 3 S TENSOR REMARK 3 S11: -1.6380 S12: -0.3635 S13: -1.8134 REMARK 3 S21: 0.5166 S22: -0.5232 S23: -2.5550 REMARK 3 S31: 0.3462 S32: 0.9190 S33: 0.0000 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: (chain A and resid 17:22) REMARK 3 ORIGIN FOR THE GROUP (A): 37.9646 -11.4989 -3.0881 REMARK 3 T TENSOR REMARK 3 T11: 2.0335 T22: 1.6642 REMARK 3 T33: 1.8955 T12: 0.2598 REMARK 3 T13: 0.6849 T23: 0.0909 REMARK 3 L TENSOR REMARK 3 L11: -0.3020 L22: 0.0580 REMARK 3 L33: 0.0233 L12: 0.1837 REMARK 3 L13: -0.1480 L23: -0.0726 REMARK 3 S TENSOR REMARK 3 S11: 1.7948 S12: 0.4384 S13: 4.0507 REMARK 3 S21: -1.8419 S22: 0.2681 S23: -0.5884 REMARK 3 S31: 1.2354 S32: -0.5597 S33: -0.0000 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: (chain A and resid 23:30) REMARK 3 ORIGIN FOR THE GROUP (A): 40.3501 -22.8999 4.1242 REMARK 3 T TENSOR REMARK 3 T11: 1.3908 T22: 1.5058 REMARK 3 T33: 1.4593 T12: 0.0292 REMARK 3 T13: 0.1257 T23: -0.0302 REMARK 3 L TENSOR REMARK 3 L11: -0.0909 L22: 0.1813 REMARK 3 L33: 0.0939 L12: 0.1091 REMARK 3 L13: 0.0678 L23: 0.1713 REMARK 3 S TENSOR REMARK 3 S11: 1.7709 S12: 1.1289 S13: -2.4814 REMARK 3 S21: -0.2312 S22: -0.4495 S23: -1.1692 REMARK 3 S31: 2.4942 S32: 0.2403 S33: 0.0000 REMARK 3 TLS GROUP : 6 REMARK 3 SELECTION: (chain A and resid 31:38) REMARK 3 ORIGIN FOR THE GROUP (A): 42.3152 -24.3802 11.7380 REMARK 3 T TENSOR REMARK 3 T11: 1.0272 T22: 1.2702 REMARK 3 T33: 1.8417 T12: -0.0902 REMARK 3 T13: 0.1416 T23: -0.0624 REMARK 3 L TENSOR REMARK 3 L11: 0.1828 L22: 0.1629 REMARK 3 L33: 0.5171 L12: 0.1706 REMARK 3 L13: 0.0118 L23: 0.6515 REMARK 3 S TENSOR REMARK 3 S11: 1.4364 S12: -1.1014 S13: 2.1630 REMARK 3 S21: 0.8194 S22: -1.3067 S23: -0.9349 REMARK 3 S31: -0.8895 S32: 3.1060 S33: -0.0000 REMARK 3 TLS GROUP : 7 REMARK 3 SELECTION: (chain A and resid 39:43) REMARK 3 ORIGIN FOR THE GROUP (A): 32.3330 -26.6096 9.9747 REMARK 3 T TENSOR REMARK 3 T11: 1.0701 T22: 1.6592 REMARK 3 T33: 1.3251 T12: -0.2555 REMARK 3 T13: 0.1982 T23: 0.0333 REMARK 3 L TENSOR REMARK 3 L11: -0.0521 L22: 0.2222 REMARK 3 L33: 0.2042 L12: -0.0298 REMARK 3 L13: -0.1016 L23: -0.2247 REMARK 3 S TENSOR REMARK 3 S11: -1.8292 S12: 0.0647 S13: 0.6915 REMARK 3 S21: 0.5109 S22: 1.0740 S23: 3.1917 REMARK 3 S31: 2.7394 S32: -1.8500 S33: -0.0000 REMARK 3 TLS GROUP : 8 REMARK 3 SELECTION: (chain A and resid 44:48) REMARK 3 ORIGIN FOR THE GROUP (A): 27.3056 -19.8692 10.0353 REMARK 3 T TENSOR REMARK 3 T11: 0.7135 T22: 1.8226 REMARK 3 T33: 1.8787 T12: -0.2229 REMARK 3 T13: -0.0194 T23: -0.4029 REMARK 3 L TENSOR REMARK 3 L11: -0.0884 L22: 0.1026 REMARK 3 L33: -0.0873 L12: 0.2612 REMARK 3 L13: -0.0488 L23: 0.2290 REMARK 3 S TENSOR REMARK 3 S11: -0.0641 S12: -3.8620 S13: 0.3187 REMARK 3 S21: 1.6312 S22: -1.9889 S23: 1.1754 REMARK 3 S31: -0.8614 S32: -1.1525 S33: 0.0000 REMARK 3 TLS GROUP : 9 REMARK 3 SELECTION: (chain A and resid 49:53) REMARK 3 ORIGIN FOR THE GROUP (A): 24.0864 -9.9776 9.1312 REMARK 3 T TENSOR REMARK 3 T11: 1.3897 T22: 1.7220 REMARK 3 T33: 1.7682 T12: 0.2011 REMARK 3 T13: -0.0395 T23: -0.3507 REMARK 3 L TENSOR REMARK 3 L11: 0.1779 L22: 0.1540 REMARK 3 L33: 0.1631 L12: -0.3719 REMARK 3 L13: 0.1947 L23: -0.0207 REMARK 3 S TENSOR REMARK 3 S11: 0.1090 S12: 1.1934 S13: -0.6855 REMARK 3 S21: 0.1456 S22: 1.1991 S23: -0.0662 REMARK 3 S31: -1.1430 S32: -1.7501 S33: 0.0000 REMARK 3 TLS GROUP : 10 REMARK 3 SELECTION: (chain A and resid 54:59) REMARK 3 ORIGIN FOR THE GROUP (A): 30.9331 -14.3695 1.8488 REMARK 3 T TENSOR REMARK 3 T11: 1.6996 T22: 1.9177 REMARK 3 T33: 1.3945 T12: -0.2400 REMARK 3 T13: -0.1019 T23: -0.0782 REMARK 3 L TENSOR REMARK 3 L11: -0.1166 L22: 0.1351 REMARK 3 L33: -0.0348 L12: -0.5169 REMARK 3 L13: 0.1685 L23: 0.0594 REMARK 3 S TENSOR REMARK 3 S11: -1.1606 S12: 3.4702 S13: 1.0221 REMARK 3 S21: 1.0235 S22: 0.2652 S23: 2.8824 REMARK 3 S31: -1.1007 S32: -1.4205 S33: 0.0000 REMARK 3 TLS GROUP : 11 REMARK 3 SELECTION: (chain A and resid 60:65) REMARK 3 ORIGIN FOR THE GROUP (A): 34.8823 -26.8163 -3.5024 REMARK 3 T TENSOR REMARK 3 T11: 1.7656 T22: 1.3757 REMARK 3 T33: 1.5157 T12: 0.2842 REMARK 3 T13: 0.3086 T23: -0.1352 REMARK 3 L TENSOR REMARK 3 L11: -0.1403 L22: 0.0221 REMARK 3 L33: 0.0665 L12: -0.1149 REMARK 3 L13: 0.0112 L23: 0.0384 REMARK 3 S TENSOR REMARK 3 S11: -1.2881 S12: -0.1628 S13: -2.2832 REMARK 3 S21: 0.3629 S22: -1.4134 S23: 0.7546 REMARK 3 S31: -0.7428 S32: -2.5701 S33: 0.0000 REMARK 3 TLS GROUP : 12 REMARK 3 SELECTION: (chain A and resid 66:70) REMARK 3 ORIGIN FOR THE GROUP (A): 25.3699 -27.1301 -0.2649 REMARK 3 T TENSOR REMARK 3 T11: 1.6843 T22: 1.8901 REMARK 3 T33: 1.6010 T12: -0.5553 REMARK 3 T13: 0.2640 T23: -0.0642 REMARK 3 L TENSOR REMARK 3 L11: 0.1524 L22: -0.1366 REMARK 3 L33: 0.0294 L12: -0.0955 REMARK 3 L13: 0.1425 L23: 0.1066 REMARK 3 S TENSOR REMARK 3 S11: 0.9279 S12: 0.6112 S13: 0.4588 REMARK 3 S21: 1.0112 S22: 0.5546 S23: 1.7228 REMARK 3 S31: -0.4509 S32: -0.7988 S33: -0.0000 REMARK 3 TLS GROUP : 13 REMARK 3 SELECTION: (chain A and resid 71:76) REMARK 3 ORIGIN FOR THE GROUP (A): 20.8622 -22.7105 -1.1900 REMARK 3 T TENSOR REMARK 3 T11: 1.4936 T22: 1.4710 REMARK 3 T33: 1.4578 T12: 0.0856 REMARK 3 T13: -0.1371 T23: -0.3742 REMARK 3 L TENSOR REMARK 3 L11: 0.2994 L22: 0.3155 REMARK 3 L33: 0.1986 L12: 0.1144 REMARK 3 L13: 0.0251 L23: 0.4875 REMARK 3 S TENSOR REMARK 3 S11: -0.0888 S12: 1.4080 S13: 0.1271 REMARK 3 S21: 0.0708 S22: 0.4092 S23: 0.9055 REMARK 3 S31: 1.4102 S32: -1.7149 S33: -0.0001 REMARK 3 TLS GROUP : 14 REMARK 3 SELECTION: (chain A and resid 77:81) REMARK 3 ORIGIN FOR THE GROUP (A): 24.6935 -15.4007 -4.1330 REMARK 3 T TENSOR REMARK 3 T11: 1.7534 T22: 1.9507 REMARK 3 T33: 1.3585 T12: -0.0199 REMARK 3 T13: -0.0233 T23: -0.1852 REMARK 3 L TENSOR REMARK 3 L11: -0.3322 L22: 0.0499 REMARK 3 L33: -0.0072 L12: -0.3555 REMARK 3 L13: 0.2374 L23: -0.0181 REMARK 3 S TENSOR REMARK 3 S11: 0.7960 S12: -1.9962 S13: 0.3877 REMARK 3 S21: 0.5270 S22: 1.2663 S23: 0.9235 REMARK 3 S31: -1.1634 S32: -2.3264 S33: -0.0000 REMARK 3 TLS GROUP : 15 REMARK 3 SELECTION: (chain A and resid 82:87) REMARK 3 ORIGIN FOR THE GROUP (A): 30.1750 -11.8001 -8.7761 REMARK 3 T TENSOR REMARK 3 T11: 2.2866 T22: 1.3236 REMARK 3 T33: 1.8353 T12: 0.1096 REMARK 3 T13: -0.0447 T23: -0.0191 REMARK 3 L TENSOR REMARK 3 L11: -0.0835 L22: 0.0159 REMARK 3 L33: 0.0740 L12: 0.1522 REMARK 3 L13: 0.0721 L23: -0.0562 REMARK 3 S TENSOR REMARK 3 S11: 0.1102 S12: 0.3131 S13: -0.7464 REMARK 3 S21: -0.2053 S22: 0.9222 S23: 3.2403 REMARK 3 S31: -2.5745 S32: -1.4273 S33: 0.0001 REMARK 3 TLS GROUP : 16 REMARK 3 SELECTION: (chain A and resid 88:92) REMARK 3 ORIGIN FOR THE GROUP (A): 29.4599 -21.6918 -14.0813 REMARK 3 T TENSOR REMARK 3 T11: 2.2414 T22: 2.3393 REMARK 3 T33: 1.4014 T12: 0.3414 REMARK 3 T13: 0.0223 T23: -0.2187 REMARK 3 L TENSOR REMARK 3 L11: -0.0355 L22: 0.0236 REMARK 3 L33: -0.0608 L12: -0.3522 REMARK 3 L13: -0.2085 L23: 0.0164 REMARK 3 S TENSOR REMARK 3 S11: -0.5782 S12: 0.2217 S13: -1.8104 REMARK 3 S21: -0.1864 S22: 1.3988 S23: -0.3644 REMARK 3 S31: -3.5589 S32: -3.2524 S33: -0.0000 REMARK 3 TLS GROUP : 17 REMARK 3 SELECTION: (chain A and resid 93:98) REMARK 3 ORIGIN FOR THE GROUP (A): 27.3341 -27.9377 -11.0700 REMARK 3 T TENSOR REMARK 3 T11: 2.1896 T22: 2.6167 REMARK 3 T33: 1.5981 T12: -0.1676 REMARK 3 T13: 0.1888 T23: -0.3416 REMARK 3 L TENSOR REMARK 3 L11: 0.1609 L22: 0.0377 REMARK 3 L33: 0.0822 L12: 0.3867 REMARK 3 L13: 0.1253 L23: -0.2882 REMARK 3 S TENSOR REMARK 3 S11: 1.3327 S12: -2.5297 S13: -0.8499 REMARK 3 S21: 0.1886 S22: -2.5871 S23: 1.3055 REMARK 3 S31: -1.7798 S32: 4.1573 S33: -0.0000 REMARK 3 TLS GROUP : 18 REMARK 3 SELECTION: (chain A and resid 99:103) REMARK 3 ORIGIN FOR THE GROUP (A): 39.7859 -20.2957 -10.2191 REMARK 3 T TENSOR REMARK 3 T11: 1.6396 T22: 2.1528 REMARK 3 T33: 1.8358 T12: -0.4885 REMARK 3 T13: 0.3962 T23: -0.2041 REMARK 3 L TENSOR REMARK 3 L11: 0.0311 L22: -0.0585 REMARK 3 L33: 0.1262 L12: 0.1103 REMARK 3 L13: 0.1435 L23: 0.0611 REMARK 3 S TENSOR REMARK 3 S11: -1.4742 S12: -0.0605 S13: -3.4293 REMARK 3 S21: 0.1289 S22: 1.0116 S23: -0.8712 REMARK 3 S31: 0.5522 S32: -0.9288 S33: -0.0000 REMARK 3 TLS GROUP : 19 REMARK 3 SELECTION: (chain A and resid 104:108) REMARK 3 ORIGIN FOR THE GROUP (A): 44.6130 -15.6577 -2.3736 REMARK 3 T TENSOR REMARK 3 T11: 2.2546 T22: 1.9381 REMARK 3 T33: 2.2464 T12: -0.0969 REMARK 3 T13: 0.7650 T23: -0.0720 REMARK 3 L TENSOR REMARK 3 L11: 0.1403 L22: 0.2943 REMARK 3 L33: 0.0296 L12: -0.3386 REMARK 3 L13: -0.1429 L23: 0.0030 REMARK 3 S TENSOR REMARK 3 S11: -0.4010 S12: 0.7162 S13: 1.0944 REMARK 3 S21: 0.8534 S22: 0.8657 S23: -1.4679 REMARK 3 S31: -1.5268 S32: -0.6285 S33: 0.0001 REMARK 3 TLS GROUP : 20 REMARK 3 SELECTION: (chain B and resid 1:4) REMARK 3 ORIGIN FOR THE GROUP (A): 26.4083 -41.5626 20.0664 REMARK 3 T TENSOR REMARK 3 T11: 2.0594 T22: 1.8535 REMARK 3 T33: 1.3701 T12: -0.0071 REMARK 3 T13: 0.4144 T23: 0.1516 REMARK 3 L TENSOR REMARK 3 L11: 0.0191 L22: 0.5195 REMARK 3 L33: -0.0205 L12: 0.1480 REMARK 3 L13: 0.2109 L23: 0.1109 REMARK 3 S TENSOR REMARK 3 S11: -1.4071 S12: -1.7792 S13: -1.3290 REMARK 3 S21: -1.0771 S22: 1.1179 S23: -0.4230 REMARK 3 S31: 2.8212 S32: -0.9077 S33: 0.0000 REMARK 3 TLS GROUP : 21 REMARK 3 SELECTION: (chain B and resid 5:10) REMARK 3 ORIGIN FOR THE GROUP (A): 31.4327 -31.2901 5.4210 REMARK 3 T TENSOR REMARK 3 T11: 1.2940 T22: 1.2112 REMARK 3 T33: 1.4413 T12: -0.1894 REMARK 3 T13: 0.2694 T23: -0.2161 REMARK 3 L TENSOR REMARK 3 L11: -1.1036 L22: 2.7791 REMARK 3 L33: 1.1929 L12: -0.4289 REMARK 3 L13: 2.5173 L23: -0.1832 REMARK 3 S TENSOR REMARK 3 S11: 0.3837 S12: 0.6032 S13: 0.2195 REMARK 3 S21: -0.2292 S22: -0.4871 S23: 0.5857 REMARK 3 S31: 1.0632 S32: -0.8711 S33: 0.0000 REMARK 3 TLS GROUP : 22 REMARK 3 SELECTION: (chain B and resid 11:13) or (chain C and resid 14: REMARK 3 17) REMARK 3 ORIGIN FOR THE GROUP (A): 37.2757 -40.9633 -6.8211 REMARK 3 T TENSOR REMARK 3 T11: 1.7443 T22: 1.8445 REMARK 3 T33: 1.5236 T12: 0.1489 REMARK 3 T13: 0.1702 T23: -0.2927 REMARK 3 L TENSOR REMARK 3 L11: 1.0396 L22: 1.5414 REMARK 3 L33: 0.5626 L12: 1.2173 REMARK 3 L13: -0.7974 L23: 0.4806 REMARK 3 S TENSOR REMARK 3 S11: 0.1086 S12: -0.4158 S13: -0.7003 REMARK 3 S21: 0.8390 S22: 0.8255 S23: 0.5325 REMARK 3 S31: 0.3049 S32: -0.8690 S33: 0.0000 REMARK 3 TLS GROUP : 23 REMARK 3 SELECTION: (chain C and resid 18:21) REMARK 3 ORIGIN FOR THE GROUP (A): 37.4140 -41.1674 6.4010 REMARK 3 T TENSOR REMARK 3 T11: 1.7280 T22: 1.7336 REMARK 3 T33: 1.7926 T12: 0.0106 REMARK 3 T13: 0.2453 T23: -0.2209 REMARK 3 L TENSOR REMARK 3 L11: -0.2221 L22: 0.3717 REMARK 3 L33: 0.0385 L12: -1.1405 REMARK 3 L13: -0.0153 L23: -0.2612 REMARK 3 S TENSOR REMARK 3 S11: 0.2318 S12: 0.5249 S13: -0.4610 REMARK 3 S21: 2.3376 S22: -0.7749 S23: 1.2386 REMARK 3 S31: 3.8012 S32: -0.3450 S33: 0.0000 REMARK 3 TLS GROUP : 24 REMARK 3 SELECTION: (chain C and resid 22:26) REMARK 3 ORIGIN FOR THE GROUP (A): 28.1653 -31.8667 18.6102 REMARK 3 T TENSOR REMARK 3 T11: 1.1214 T22: 1.4681 REMARK 3 T33: 1.5033 T12: 0.0639 REMARK 3 T13: 0.2798 T23: -0.2200 REMARK 3 L TENSOR REMARK 3 L11: 0.0430 L22: 2.1508 REMARK 3 L33: 0.3334 L12: 0.0275 REMARK 3 L13: -0.3392 L23: -0.0248 REMARK 3 S TENSOR REMARK 3 S11: -0.1423 S12: -1.2046 S13: -0.5300 REMARK 3 S21: 0.3494 S22: -0.4130 S23: 0.8297 REMARK 3 S31: 0.4967 S32: 0.3589 S33: 0.0000 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 4ENJ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 27-APR-12. REMARK 100 THE RCSB ID CODE IS RCSB071840. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-NOV-08 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.4 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 12.3.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.1158 REMARK 200 MONOCHROMATOR : ML CRYSTALS REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 4929 REMARK 200 RESOLUTION RANGE HIGH (A) : 3.099 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.1 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 3.10 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.21 REMARK 200 COMPLETENESS FOR SHELL (%) : 77.5 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 57.62 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.90 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 15% MPEG 2000, 0.2M IMIDAZOLE-MALATE, REMARK 280 30% XYLOSE, PH 5.4, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE REMARK 280 288K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+5/6 REMARK 290 6555 X-Y,X,Z+1/6 REMARK 290 7555 Y,X,-Z+1/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+2/3 REMARK 290 10555 -Y,-X,-Z+5/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+1/6 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 77.57467 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 155.14933 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 116.36200 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 193.93667 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 38.78733 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 77.57467 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 155.14933 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 193.93667 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 116.36200 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 38.78733 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3190 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 10020 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -12.0 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 109 REMARK 465 SER A 110 REMARK 465 HIS A 111 REMARK 465 HIS A 112 REMARK 465 HIS A 113 REMARK 465 HIS A 114 REMARK 465 HIS A 115 REMARK 465 HIS A 116 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O MET A 3 N GLU A 5 2.17 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 DC C 14 O3' DC C 14 C3' -0.037 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 DC B 3 O4' - C1' - N1 ANGL. DEV. = 5.9 DEGREES REMARK 500 DA B 4 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DT B 5 C6 - C5 - C7 ANGL. DEV. = -3.8 DEGREES REMARK 500 DC B 8 C3' - C2' - C1' ANGL. DEV. = -6.7 DEGREES REMARK 500 DC B 8 O4' - C1' - C2' ANGL. DEV. = -5.1 DEGREES REMARK 500 DT B 9 O4' - C4' - C3' ANGL. DEV. = -3.0 DEGREES REMARK 500 DT B 9 N3 - C4 - O4 ANGL. DEV. = 3.8 DEGREES REMARK 500 DT B 9 C5 - C4 - O4 ANGL. DEV. = -4.7 DEGREES REMARK 500 DA B 10 C3' - C2' - C1' ANGL. DEV. = -7.6 DEGREES REMARK 500 DA B 10 O4' - C1' - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 DG B 11 O4' - C1' - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DT B 12 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES REMARK 500 DA B 13 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DT C 15 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DA C 16 O4' - C1' - N9 ANGL. DEV. = 2.2 DEGREES REMARK 500 DC C 17 O4' - C1' - C2' ANGL. DEV. = -4.8 DEGREES REMARK 500 DC C 17 O4' - C1' - N1 ANGL. DEV. = 6.2 DEGREES REMARK 500 DA C 19 C1' - O4' - C4' ANGL. DEV. = -6.4 DEGREES REMARK 500 DA C 19 C3' - C2' - C1' ANGL. DEV. = -5.3 DEGREES REMARK 500 DC C 22 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DT C 24 C3' - C2' - C1' ANGL. DEV. = -6.2 DEGREES REMARK 500 DT C 24 O4' - C1' - N1 ANGL. DEV. = 3.4 DEGREES REMARK 500 DG C 25 C3' - C2' - C1' ANGL. DEV. = -5.9 DEGREES REMARK 500 DG C 25 O4' - C1' - N9 ANGL. DEV. = 6.7 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 MET A 3 -158.06 -63.73 REMARK 500 ASP A 4 -41.02 47.70 REMARK 500 SER A 23 -154.32 -142.32 REMARK 500 TYR A 25 -59.24 -29.75 REMARK 500 GLU A 27 1.33 -57.10 REMARK 500 TYR A 31 -59.44 141.56 REMARK 500 TYR A 37 32.36 -88.98 REMARK 500 HIS A 47 -119.08 -58.69 REMARK 500 LEU A 48 123.23 51.60 REMARK 500 ASP A 70 -72.15 15.01 REMARK 500 SER A 72 177.06 169.15 REMARK 500 ALA A 73 25.26 -156.87 REMARK 500 ASP A 80 -2.03 -57.12 REMARK 500 LEU A 94 73.37 22.37 REMARK 500 GLU A 96 127.27 96.25 REMARK 500 LEU A 99 146.71 -174.44 REMARK 500 ASN A 100 93.40 -30.71 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4ENK RELATED DB: PDB REMARK 900 RELATED ID: 4ENM RELATED DB: PDB REMARK 900 RELATED ID: 4ENN RELATED DB: PDB DBREF 4ENJ A 1 108 UNP Q9UTN9 ATL1_SCHPO 1 108 DBREF 4ENJ B 1 13 PDB 4ENJ 4ENJ 1 13 DBREF 4ENJ C 14 26 PDB 4ENJ 4ENJ 1 13 SEQADV 4ENJ GLY A 109 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ SER A 110 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ HIS A 111 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ HIS A 112 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ HIS A 113 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ HIS A 114 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ HIS A 115 UNP Q9UTN9 EXPRESSION TAG SEQADV 4ENJ HIS A 116 UNP Q9UTN9 EXPRESSION TAG SEQRES 1 A 116 MET ARG MET ASP GLU PHE TYR THR LYS VAL TYR ASP ALA SEQRES 2 A 116 VAL CYS GLU ILE PRO TYR GLY LYS VAL SER THR TYR GLY SEQRES 3 A 116 GLU ILE ALA ARG TYR VAL GLY MET PRO SER TYR ALA ARG SEQRES 4 A 116 GLN VAL GLY GLN ALA MET LYS HIS LEU HIS PRO GLU THR SEQRES 5 A 116 HIS VAL PRO TRP HIS ARG VAL ILE ASN SER ARG GLY THR SEQRES 6 A 116 ILE SER LYS ARG ASP ILE SER ALA GLY GLU GLN ARG GLN SEQRES 7 A 116 LYS ASP ARG LEU GLU GLU GLU GLY VAL GLU ILE TYR GLN SEQRES 8 A 116 THR SER LEU GLY GLU TYR LYS LEU ASN LEU PRO GLU TYR SEQRES 9 A 116 MET TRP LYS PRO GLY SER HIS HIS HIS HIS HIS HIS SEQRES 1 B 13 DG DC DC DA DT DG EHG DC DT DA DG DT DA SEQRES 1 C 13 DC DT DA DC DT DA DG DC DC DA DT DG DG MODRES 4ENJ EHG B 7 DG HET EHG B 7 25 HETNAM EHG 9-(2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO- HETNAM 2 EHG PENTOFURANOSYL)-6-(2-HYDROXYETHOXY)-9H-PURIN-2-AMINE FORMUL 2 EHG C12 H18 N5 O8 P FORMUL 4 HOH *4(H2 O) HELIX 1 1 ASP A 4 GLU A 16 1 13 HELIX 2 2 TYR A 25 ARG A 30 1 6 HELIX 3 3 TYR A 37 HIS A 47 1 11 HELIX 4 4 GLY A 74 GLU A 83 1 10 HELIX 5 5 ASN A 100 TYR A 104 5 5 SHEET 1 A 2 SER A 23 THR A 24 0 SHEET 2 A 2 VAL A 59 ILE A 60 1 O ILE A 60 N SER A 23 SHEET 1 B 2 TYR A 90 GLN A 91 0 SHEET 2 B 2 TYR A 97 LYS A 98 -1 O LYS A 98 N TYR A 90 LINK O3' DG B 6 P EHG B 7 1555 1555 1.60 CRYST1 59.774 59.774 232.724 90.00 90.00 120.00 P 61 2 2 12 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 0.016730 0.009659 0.000000 0.00000 SCALE2 0.000000 0.019318 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004297 0.00000 ATOM 1 N MET A 1 43.808 -23.376 22.527 1.00149.73 N ANISOU 1 N MET A 1 20325 15436 21131 -1369 4191 -3208 N ATOM 2 CA MET A 1 42.829 -22.398 22.066 1.00144.26 C ANISOU 2 CA MET A 1 19740 15479 19594 -1182 3853 -3397 C ATOM 3 C MET A 1 41.405 -22.908 22.214 1.00143.29 C ANISOU 3 C MET A 1 19077 15631 19735 -1243 4061 -3453 C ATOM 4 O MET A 1 41.079 -24.007 21.767 1.00126.25 O ANISOU 4 O MET A 1 16348 13281 18339 -1673 4393 -3841 O ATOM 5 CB MET A 1 43.057 -22.066 20.599 1.00150.17 C ANISOU 5 CB MET A 1 20525 16510 20022 -1494 3626 -4141 C ATOM 6 CG MET A 1 42.079 -21.048 20.050 1.00150.94 C ANISOU 6 CG MET A 1 20739 17373 19239 -1318 3270 -4375 C ATOM 7 SD MET A 1 41.974 -21.160 18.260 1.00128.30 S ANISOU 7 SD MET A 1 17617 14801 16329 -1828 3172 -5366 S ATOM 8 CE MET A 1 41.977 -19.435 17.786 1.00129.36 C ANISOU 8 CE MET A 1 18401 15602 15149 -1457 2575 -5423 C ATOM 9 N ARG A 2 40.563 -22.088 22.833 1.00136.84 N ANISOU 9 N ARG A 2 18451 15270 18271 -809 3856 -3066 N ATOM 10 CA ARG A 2 39.139 -22.375 22.952 1.00139.25 C ANISOU 10 CA ARG A 2 18304 15930 18674 -814 3989 -3111 C ATOM 11 C ARG A 2 38.385 -22.015 21.659 1.00142.25 C ANISOU 11 C ARG A 2 18512 16900 18637 -1043 3784 -3816 C ATOM 12 O ARG A 2 38.954 -21.424 20.729 1.00134.36 O ANISOU 12 O ARG A 2 17796 16071 17185 -1144 3506 -4224 O ATOM 13 CB ARG A 2 38.531 -21.637 24.158 1.00137.86 C ANISOU 13 CB ARG A 2 18405 16005 17969 -247 3853 -2399 C ATOM 14 CG ARG A 2 38.106 -20.195 23.889 1.00120.62 C ANISOU 14 CG ARG A 2 16676 14503 14649 106 3363 -2401 C ATOM 15 CD ARG A 2 37.322 -19.590 25.059 1.00119.89 C ANISOU 15 CD ARG A 2 16763 14684 14107 633 3269 -1731 C ATOM 16 NE ARG A 2 38.101 -18.713 25.946 1.00116.38 N ANISOU 16 NE ARG A 2 16957 14132 13130 1111 3028 -1105 N ATOM 17 CZ ARG A 2 38.255 -17.400 25.774 1.00114.81 C ANISOU 17 CZ ARG A 2 17311 14362 11950 1437 2574 -1039 C ATOM 18 NH1 ARG A 2 37.714 -16.797 24.725 1.00111.71 N ANISOU 18 NH1 ARG A 2 16922 14535 10989 1331 2307 -1570 N ATOM 19 NH2 ARG A 2 38.968 -16.688 26.641 1.00108.08 N ANISOU 19 NH2 ARG A 2 17011 13369 10686 1866 2384 -446 N ATOM 20 N MET A 3 37.108 -22.393 21.619 1.00149.63 N ANISOU 20 N MET A 3 18976 18134 19743 -1122 3930 -3951 N ATOM 21 CA MET A 3 36.200 -22.017 20.544 1.00147.76 C ANISOU 21 CA MET A 3 18559 18506 19078 -1278 3739 -4547 C ATOM 22 C MET A 3 36.025 -20.501 20.547 1.00139.45 C ANISOU 22 C MET A 3 18083 18034 16868 -836 3246 -4380 C ATOM 23 O MET A 3 36.889 -19.797 21.057 1.00133.72 O ANISOU 23 O MET A 3 17906 17180 15722 -522 3038 -3971 O ATOM 24 CB MET A 3 34.850 -22.704 20.744 1.00151.22 C ANISOU 24 CB MET A 3 18406 19118 19933 -1379 4006 -4591 C ATOM 25 CG MET A 3 34.286 -23.361 19.481 1.00155.75 C ANISOU 25 CG MET A 3 18443 19860 20874 -1891 4128 -5394 C ATOM 26 SD MET A 3 35.004 -24.960 19.005 1.00184.17 S ANISOU 26 SD MET A 3 21517 22752 25709 -2501 4595 -5799 S ATOM 27 CE MET A 3 35.913 -25.467 20.487 1.00174.20 C ANISOU 27 CE MET A 3 20422 20769 24997 -2276 4867 -4993 C ATOM 28 N ASP A 4 34.930 -20.005 19.966 1.00134.47 N ANISOU 28 N ASP A 4 17327 18033 15731 -817 3059 -4704 N ATOM 29 CA ASP A 4 34.543 -18.582 20.050 1.00132.34 C ANISOU 29 CA ASP A 4 17554 18371 14360 -374 2608 -4515 C ATOM 30 C ASP A 4 35.633 -17.547 19.766 1.00136.48 C ANISOU 30 C ASP A 4 18734 18938 14182 -188 2226 -4490 C ATOM 31 O ASP A 4 35.354 -16.517 19.167 1.00144.93 O ANISOU 31 O ASP A 4 20096 20558 14412 -45 1850 -4717 O ATOM 32 CB ASP A 4 33.884 -18.264 21.399 1.00124.70 C ANISOU 32 CB ASP A 4 16695 17507 13179 105 2620 -3771 C ATOM 33 CG ASP A 4 34.881 -18.163 22.526 1.00121.95 C ANISOU 33 CG ASP A 4 16746 16674 12915 413 2653 -3085 C ATOM 34 OD1 ASP A 4 35.694 -17.215 22.503 1.00117.82 O ANISOU 34 OD1 ASP A 4 16803 16212 11749 654 2322 -2945 O ATOM 35 OD2 ASP A 4 34.843 -19.022 23.434 1.00123.92 O ANISOU 35 OD2 ASP A 4 16730 16486 13866 419 3008 -2687 O ATOM 36 N GLU A 5 36.843 -17.783 20.263 1.00126.81 N ANISOU 36 N GLU A 5 17757 17146 13277 -158 2318 -4176 N ATOM 37 CA GLU A 5 38.004 -17.021 19.846 1.00115.80 C ANISOU 37 CA GLU A 5 16910 15697 11392 -87 2015 -4251 C ATOM 38 C GLU A 5 38.145 -17.489 18.435 1.00115.95 C ANISOU 38 C GLU A 5 16629 15742 11683 -606 2061 -5069 C ATOM 39 O GLU A 5 38.108 -16.707 17.494 1.00124.56 O ANISOU 39 O GLU A 5 17932 17271 12123 -631 1737 -5496 O ATOM 40 CB GLU A 5 39.249 -17.430 20.634 1.00133.01 C ANISOU 40 CB GLU A 5 19305 17187 14044 -29 2183 -3797 C ATOM 41 CG GLU A 5 38.999 -17.716 22.118 1.00150.34 C ANISOU 41 CG GLU A 5 21477 19119 16524 302 2392 -3034 C ATOM 42 CD GLU A 5 40.290 -17.823 22.933 1.00160.87 C ANISOU 42 CD GLU A 5 23165 19848 18112 456 2461 -2532 C ATOM 43 OE1 GLU A 5 41.018 -16.814 22.995 1.00162.91 O ANISOU 43 OE1 GLU A 5 24013 20196 17690 742 2117 -2342 O ATOM 44 OE2 GLU A 5 40.578 -18.900 23.510 1.00167.13 O ANISOU 44 OE2 GLU A 5 23652 20077 19772 297 2855 -2327 O ATOM 45 N PHE A 6 38.290 -18.801 18.314 1.00116.37 N ANISOU 45 N PHE A 6 12357 14702 17158 -2581 -591 -25 N ATOM 46 CA PHE A 6 38.212 -19.487 17.041 1.00113.98 C ANISOU 46 CA PHE A 6 11855 13762 17689 -2158 -611 -286 C ATOM 47 C PHE A 6 37.222 -18.786 16.125 1.00110.29 C ANISOU 47 C PHE A 6 11879 12594 17431 -2016 -767 -1258 C ATOM 48 O PHE A 6 37.603 -18.168 15.133 1.00112.35 O ANISOU 48 O PHE A 6 12482 12716 17492 -2060 -1068 -1698 O ATOM 49 CB PHE A 6 37.745 -20.915 17.271 1.00115.81 C ANISOU 49 CB PHE A 6 11445 13679 18877 -1749 -236 123 C ATOM 50 CG PHE A 6 37.585 -21.699 16.018 1.00131.51 C ANISOU 50 CG PHE A 6 13197 14987 21782 -1290 -225 -129 C ATOM 51 CD1 PHE A 6 38.549 -22.610 15.639 1.00140.01 C ANISOU 51 CD1 PHE A 6 13803 16208 23185 -1136 -194 424 C ATOM 52 CD2 PHE A 6 36.475 -21.525 15.206 1.00128.45 C ANISOU 52 CD2 PHE A 6 13059 13815 21932 -1011 -247 -921 C ATOM 53 CE1 PHE A 6 38.415 -23.336 14.478 1.00145.31 C ANISOU 53 CE1 PHE A 6 14256 16255 24700 -713 -186 197 C ATOM 54 CE2 PHE A 6 36.337 -22.254 14.038 1.00135.41 C ANISOU 54 CE2 PHE A 6 13720 14068 23662 -586 -238 -1152 C ATOM 55 CZ PHE A 6 37.304 -23.156 13.680 1.00141.03 C ANISOU 55 CZ PHE A 6 13964 14933 24687 -438 -208 -593 C ATOM 56 N TYR A 7 35.940 -18.882 16.459 1.00110.33 N ANISOU 56 N TYR A 7 11922 12157 17843 -1844 -562 -1594 N ATOM 57 CA TYR A 7 34.901 -18.249 15.647 1.00106.94 C ANISOU 57 CA TYR A 7 11947 11039 17647 -1696 -685 -2520 C ATOM 58 C TYR A 7 35.338 -16.852 15.141 1.00107.13 C ANISOU 58 C TYR A 7 12626 11250 16830 -2041 -1086 -3034 C ATOM 59 O TYR A 7 35.437 -16.619 13.935 1.00101.32 O ANISOU 59 O TYR A 7 12095 10111 16290 -1900 -1304 -3527 O ATOM 60 CB TYR A 7 33.566 -18.213 16.409 1.00107.86 C ANISOU 60 CB TYR A 7 12127 10879 17975 -1627 -443 -2762 C ATOM 61 CG TYR A 7 32.749 -19.500 16.331 1.00145.43 C ANISOU 61 CG TYR A 7 16366 15069 23822 -1145 -101 -2650 C ATOM 62 CD1 TYR A 7 33.172 -20.666 16.972 1.00145.20 C ANISOU 62 CD1 TYR A 7 15703 15315 24151 -1024 175 -1836 C ATOM 63 CD2 TYR A 7 31.543 -19.543 15.632 1.00149.20 C ANISOU 63 CD2 TYR A 7 16987 14736 24964 -814 -52 -3357 C ATOM 64 CE1 TYR A 7 32.426 -21.849 16.900 1.00146.62 C ANISOU 64 CE1 TYR A 7 15405 14973 25329 -583 488 -1731 C ATOM 65 CE2 TYR A 7 30.790 -20.716 15.563 1.00149.73 C ANISOU 65 CE2 TYR A 7 16583 14283 26026 -375 260 -3257 C ATOM 66 CZ TYR A 7 31.239 -21.861 16.197 1.00145.48 C ANISOU 66 CZ TYR A 7 15420 14030 25827 -263 527 -2443 C ATOM 67 OH TYR A 7 30.502 -23.021 16.133 1.00139.83 O ANISOU 67 OH TYR A 7 14236 12802 26089 169 835 -2339 O ATOM 68 N THR A 8 35.631 -15.935 16.058 1.00105.88 N ANISOU 68 N THR A 8 12787 11712 15730 -2494 -1184 -2903 N ATOM 69 CA THR A 8 36.098 -14.609 15.664 1.00105.64 C ANISOU 69 CA THR A 8 13368 11915 14855 -2847 -1560 -3339 C ATOM 70 C THR A 8 37.235 -14.673 14.648 1.00114.71 C ANISOU 70 C THR A 8 14476 13150 15957 -2831 -1809 -3256 C ATOM 71 O THR A 8 37.098 -14.153 13.543 1.00134.18 O ANISOU 71 O THR A 8 17292 15192 18500 -2745 -2047 -3903 O ATOM 72 CB THR A 8 36.554 -13.763 16.861 1.00111.70 C ANISOU 72 CB THR A 8 14386 13476 14581 -3359 -1626 -3016 C ATOM 73 OG1 THR A 8 35.454 -13.564 17.749 1.00113.15 O ANISOU 73 OG1 THR A 8 14680 13558 14754 -3391 -1427 -3180 O ATOM 74 CG2 THR A 8 37.041 -12.396 16.392 1.00117.95 C ANISOU 74 CG2 THR A 8 15813 14484 14518 -3713 -2024 -3486 C ATOM 75 N LYS A 9 38.354 -15.291 15.026 1.00111.63 N ANISOU 75 N LYS A 9 13669 13315 15430 -2919 -1756 -2464 N ATOM 76 CA LYS A 9 39.527 -15.347 14.152 1.00105.84 C ANISOU 76 CA LYS A 9 12884 12743 14588 -2936 -1991 -2315 C ATOM 77 C LYS A 9 39.053 -15.526 12.735 1.00103.02 C ANISOU 77 C LYS A 9 12609 11591 14945 -2554 -2090 -2963 C ATOM 78 O LYS A 9 39.359 -14.732 11.849 1.00110.30 O ANISOU 78 O LYS A 9 13949 12408 15553 -2652 -2405 -3454 O ATOM 79 CB LYS A 9 40.450 -16.511 14.521 1.00108.84 C ANISOU 79 CB LYS A 9 12611 13512 15231 -2845 -1805 -1409 C ATOM 80 CG LYS A 9 41.084 -16.405 15.902 1.00112.70 C ANISOU 80 CG LYS A 9 12973 14843 15005 -3227 -1713 -687 C ATOM 81 CD LYS A 9 42.608 -16.425 15.824 1.00122.37 C ANISOU 81 CD LYS A 9 14062 16706 15726 -3455 -1889 -116 C ATOM 82 CE LYS A 9 43.199 -15.053 16.130 1.00131.26 C ANISOU 82 CE LYS A 9 15747 18406 15719 -3970 -2198 -257 C ATOM 83 NZ LYS A 9 43.290 -14.779 17.604 1.00132.43 N ANISOU 83 NZ LYS A 9 15886 19217 15214 -4326 -2068 230 N ATOM 84 N VAL A 10 38.281 -16.585 12.541 1.00102.33 N ANISOU 84 N VAL A 10 12114 10938 15828 -2116 -1812 -2960 N ATOM 85 CA VAL A 10 37.677 -16.884 11.254 1.00109.57 C ANISOU 85 CA VAL A 10 13057 11037 17537 -1706 -1855 -3567 C ATOM 86 C VAL A 10 37.006 -15.667 10.619 1.00108.23 C ANISOU 86 C VAL A 10 13564 10492 17065 -1802 -2114 -4493 C ATOM 87 O VAL A 10 37.407 -15.196 9.549 1.00127.28 O ANISOU 87 O VAL A 10 16252 12724 19384 -1797 -2397 -4902 O ATOM 88 CB VAL A 10 36.650 -18.003 11.409 1.00 97.51 C ANISOU 88 CB VAL A 10 11089 8963 16999 -1275 -1491 -3511 C ATOM 89 CG1 VAL A 10 35.925 -18.235 10.114 1.00 94.12 C ANISOU 89 CG1 VAL A 10 10727 7668 17365 -863 -1535 -4192 C ATOM 90 CG2 VAL A 10 37.355 -19.254 11.852 1.00100.47 C ANISOU 90 CG2 VAL A 10 10785 9646 17744 -1140 -1254 -2633 C ATOM 91 N TYR A 11 35.981 -15.169 11.297 1.00131.04 N ANISOU 91 N TYR A 11 15564 12078 22146 -1229 6567 2961 N ATOM 92 CA TYR A 11 35.233 -14.015 10.833 1.00125.41 C ANISOU 92 CA TYR A 11 15271 11707 20673 -1547 6078 2390 C ATOM 93 C TYR A 11 36.193 -12.928 10.326 1.00127.45 C ANISOU 93 C TYR A 11 15247 12142 21035 -1763 5499 2605 C ATOM 94 O TYR A 11 36.105 -12.497 9.174 1.00123.82 O ANISOU 94 O TYR A 11 14791 11769 20487 -2062 5734 2171 O ATOM 95 CB TYR A 11 34.275 -13.516 11.944 1.00126.31 C ANISOU 95 CB TYR A 11 15921 12058 20012 -1465 5341 2265 C ATOM 96 CG TYR A 11 33.186 -14.524 12.319 1.00134.10 C ANISOU 96 CG TYR A 11 17239 12895 20817 -1295 5938 1947 C ATOM 97 CD1 TYR A 11 32.887 -14.804 13.649 1.00143.37 C ANISOU 97 CD1 TYR A 11 18596 14065 21814 -1006 5559 2252 C ATOM 98 CD2 TYR A 11 32.454 -15.190 11.336 1.00120.59 C ANISOU 98 CD2 TYR A 11 15660 11049 19111 -1426 6879 1341 C ATOM 99 CE1 TYR A 11 31.892 -15.724 13.984 1.00142.69 C ANISOU 99 CE1 TYR A 11 18809 13844 21564 -853 6106 1963 C ATOM 100 CE2 TYR A 11 31.469 -16.106 11.658 1.00120.20 C ANISOU 100 CE2 TYR A 11 15906 10861 18903 -1276 7426 1052 C ATOM 101 CZ TYR A 11 31.186 -16.369 12.977 1.00135.73 C ANISOU 101 CZ TYR A 11 18048 12828 20696 -991 7040 1362 C ATOM 102 OH TYR A 11 30.197 -17.282 13.292 1.00143.79 O ANISOU 102 OH TYR A 11 19364 13713 21557 -842 7587 1073 O ATOM 103 N ASP A 12 37.133 -12.519 11.177 1.00140.32 N ANISOU 103 N ASP A 12 16618 13818 22879 -1606 4764 3287 N ATOM 104 CA ASP A 12 38.100 -11.478 10.812 1.00158.03 C ANISOU 104 CA ASP A 12 18580 16230 25235 -1785 4147 3557 C ATOM 105 C ASP A 12 38.787 -11.830 9.492 1.00156.46 C ANISOU 105 C ASP A 12 17953 15852 25642 -1946 4908 3485 C ATOM 106 O ASP A 12 38.912 -10.990 8.593 1.00129.32 O ANISOU 106 O ASP A 12 14504 12595 22039 -2247 4739 3208 O ATOM 107 CB ASP A 12 39.145 -11.275 11.916 1.00167.74 C ANISOU 107 CB ASP A 12 19502 17447 26784 -1540 3423 4384 C ATOM 108 CG ASP A 12 38.581 -10.573 13.153 1.00161.43 C ANISOU 108 CG ASP A 12 19122 16903 25311 -1441 2454 4464 C ATOM 109 OD1 ASP A 12 38.846 -11.081 14.258 1.00166.38 O ANISOU 109 OD1 ASP A 12 19662 17407 26146 -1128 2275 4970 O ATOM 110 OD2 ASP A 12 37.916 -9.514 13.028 1.00155.24 O ANISOU 110 OD2 ASP A 12 18737 16438 23811 -1671 1866 4043 O ATOM 111 N ALA A 13 39.216 -13.087 9.392 1.00148.24 N ANISOU 111 N ALA A 13 16566 14457 25301 -1738 5748 3734 N ATOM 112 CA ALA A 13 39.875 -13.610 8.197 1.00144.50 C ANISOU 112 CA ALA A 13 15665 13770 25470 -1845 6569 3699 C ATOM 113 C ALA A 13 39.015 -13.436 6.965 1.00136.43 C ANISOU 113 C ALA A 13 14917 12834 24086 -2163 7081 2894 C ATOM 114 O ALA A 13 39.463 -12.931 5.937 1.00132.82 O ANISOU 114 O ALA A 13 14263 12444 23757 -2415 7165 2748 O ATOM 115 CB ALA A 13 40.202 -15.084 8.377 1.00141.39 C ANISOU 115 CB ALA A 13 14960 12982 25781 -1554 7435 4000 C ATOM 116 N VAL A 14 37.773 -13.879 7.082 1.00130.21 N ANISOU 116 N VAL A 14 14583 12039 22850 -2145 7432 2375 N ATOM 117 CA VAL A 14 36.846 -13.866 5.964 1.00126.33 C ANISOU 117 CA VAL A 14 14383 11600 22015 -2420 8004 1586 C ATOM 118 C VAL A 14 36.511 -12.440 5.569 1.00127.76 C ANISOU 118 C VAL A 14 14854 12159 21530 -2748 7267 1215 C ATOM 119 O VAL A 14 35.866 -12.184 4.551 1.00143.49 O ANISOU 119 O VAL A 14 17062 14243 23214 -3027 7608 575 O ATOM 120 CB VAL A 14 35.575 -14.650 6.295 1.00129.85 C ANISOU 120 CB VAL A 14 15267 11959 22111 -2307 8486 1148 C ATOM 121 CG1 VAL A 14 34.790 -14.972 5.016 1.00143.62 C ANISOU 121 CG1 VAL A 14 17191 13651 23726 -2551 9336 395 C ATOM 122 CG2 VAL A 14 35.952 -15.920 7.048 1.00128.44 C ANISOU 122 CG2 VAL A 14 14827 11448 22526 -1934 8954 1643 C ATOM 123 N CYS A 15 36.978 -11.501 6.369 1.00122.36 N ANISOU 123 N CYS A 15 14164 11693 20635 -2716 6246 1628 N ATOM 124 CA CYS A 15 36.897 -10.119 5.963 1.00121.92 C ANISOU 124 CA CYS A 15 14287 11983 20056 -3023 5517 1375 C ATOM 125 C CYS A 15 38.213 -9.707 5.333 1.00132.20 C ANISOU 125 C CYS A 15 15057 13267 21907 -3131 5404 1771 C ATOM 126 O CYS A 15 38.279 -8.783 4.522 1.00129.45 O ANISOU 126 O CYS A 15 14734 13128 21323 -3435 5145 1490 O ATOM 127 CB CYS A 15 36.554 -9.275 7.164 1.00120.82 C ANISOU 127 CB CYS A 15 14489 12110 19305 -2946 4450 1540 C ATOM 128 SG CYS A 15 34.963 -9.782 7.749 1.00135.08 S ANISOU 128 SG CYS A 15 16921 13936 20469 -2846 4671 1011 S ATOM 129 N GLU A 16 39.268 -10.415 5.711 1.00142.62 N ANISOU 129 N GLU A 16 15888 14330 23971 -2878 5612 2431 N ATOM 130 CA GLU A 16 40.566 -10.202 5.099 1.00151.98 C ANISOU 130 CA GLU A 16 16524 15450 25770 -2950 5626 2839 C ATOM 131 C GLU A 16 40.555 -10.573 3.617 1.00148.16 C ANISOU 131 C GLU A 16 15880 14845 25569 -3176 6537 2389 C ATOM 132 O GLU A 16 41.543 -10.354 2.929 1.00145.14 O ANISOU 132 O GLU A 16 15067 14425 25654 -3281 6610 2629 O ATOM 133 CB GLU A 16 41.670 -10.987 5.830 1.00160.02 C ANISOU 133 CB GLU A 16 17053 16195 27552 -2614 5723 3639 C ATOM 134 CG GLU A 16 41.915 -10.588 7.287 1.00160.46 C ANISOU 134 CG GLU A 16 17178 16360 27431 -2383 4782 4190 C ATOM 135 CD GLU A 16 43.292 -11.004 7.787 1.00165.07 C ANISOU 135 CD GLU A 16 17190 16733 28797 -2135 4712 5027 C ATOM 136 OE1 GLU A 16 44.022 -11.681 7.039 1.00159.62 O ANISOU 136 OE1 GLU A 16 16055 15797 28794 -2125 5432 5178 O ATOM 137 OE2 GLU A 16 43.654 -10.648 8.924 1.00171.30 O ANISOU 137 OE2 GLU A 16 17971 17603 29514 -1952 3931 5535 O ATOM 138 N ILE A 17 39.451 -11.134 3.125 1.00157.88 N ANISOU 138 N ILE A 17 19073 18256 22659 1274 6935 -4053 N ATOM 139 CA ILE A 17 39.385 -11.541 1.720 1.00163.58 C ANISOU 139 CA ILE A 17 20628 18976 22551 1605 6783 -3067 C ATOM 140 C ILE A 17 39.267 -10.310 0.828 1.00171.63 C ANISOU 140 C ILE A 17 21051 19520 24642 1940 7668 -2291 C ATOM 141 O ILE A 17 38.640 -9.319 1.216 1.00179.63 O ANISOU 141 O ILE A 17 21172 20373 26706 1795 8099 -2232 O ATOM 142 CB ILE A 17 38.202 -12.500 1.442 1.00153.47 C ANISOU 142 CB ILE A 17 20184 18212 19916 1335 5784 -2470 C ATOM 143 CG1 ILE A 17 38.431 -13.839 2.137 1.00157.69 C ANISOU 143 CG1 ILE A 17 21473 19216 19227 1068 4883 -3163 C ATOM 144 CG2 ILE A 17 37.986 -12.713 -0.059 1.00142.71 C ANISOU 144 CG2 ILE A 17 19546 16800 17876 1674 5726 -1337 C ATOM 145 CD1 ILE A 17 37.411 -14.871 1.760 1.00159.60 C ANISOU 145 CD1 ILE A 17 22645 19959 18035 852 3899 -2568 C ATOM 146 N PRO A 18 39.899 -10.358 -0.359 1.00164.11 N ANISOU 146 N PRO A 18 20577 18330 23448 2393 7960 -1714 N ATOM 147 CA PRO A 18 39.811 -9.271 -1.337 1.00161.28 C ANISOU 147 CA PRO A 18 19765 17527 23989 2743 8766 -905 C ATOM 148 C PRO A 18 38.581 -9.402 -2.219 1.00150.81 C ANISOU 148 C PRO A 18 18873 16388 22041 2703 8373 206 C ATOM 149 O PRO A 18 38.315 -10.488 -2.742 1.00149.10 O ANISOU 149 O PRO A 18 19677 16520 20454 2680 7607 600 O ATOM 150 CB PRO A 18 41.072 -9.464 -2.168 1.00152.95 C ANISOU 150 CB PRO A 18 19163 16192 22758 3220 9125 -847 C ATOM 151 CG PRO A 18 41.318 -10.915 -2.116 1.00151.00 C ANISOU 151 CG PRO A 18 19993 16375 21003 3118 8220 -1094 C ATOM 152 CD PRO A 18 40.875 -11.384 -0.764 1.00154.25 C ANISOU 152 CD PRO A 18 20253 17179 21176 2613 7623 -1903 C ATOM 153 N TYR A 19 37.846 -8.304 -2.376 1.00153.95 N ANISOU 153 N TYR A 19 18501 16555 23440 2694 8896 700 N ATOM 154 CA TYR A 19 36.635 -8.326 -3.176 1.00155.55 C ANISOU 154 CA TYR A 19 19023 16915 23164 2645 8572 1757 C ATOM 155 C TYR A 19 36.920 -8.960 -4.523 1.00181.74 C ANISOU 155 C TYR A 19 23328 20232 25494 3004 8371 2542 C ATOM 156 O TYR A 19 37.722 -8.445 -5.320 1.00179.42 O ANISOU 156 O TYR A 19 22944 19519 25708 3439 9057 2814 O ATOM 157 CB TYR A 19 36.069 -6.926 -3.396 1.00159.61 C ANISOU 157 CB TYR A 19 18561 17060 25023 2720 9361 2252 C ATOM 158 CG TYR A 19 34.944 -6.911 -4.419 1.00181.24 C ANISOU 158 CG TYR A 19 21676 19903 27284 2752 9112 3435 C ATOM 159 CD1 TYR A 19 35.208 -7.044 -5.793 1.00182.68 C ANISOU 159 CD1 TYR A 19 22477 19921 27012 3160 9244 4284 C ATOM 160 CD2 TYR A 19 33.618 -6.794 -4.025 1.00173.17 C ANISOU 160 CD2 TYR A 19 20418 19149 26231 2373 8728 3712 C ATOM 161 CE1 TYR A 19 34.172 -7.049 -6.749 1.00180.34 C ANISOU 161 CE1 TYR A 19 22546 19724 26251 3189 9003 5384 C ATOM 162 CE2 TYR A 19 32.583 -6.795 -4.972 1.00172.86 C ANISOU 162 CE2 TYR A 19 20735 19209 25734 2401 8489 4806 C ATOM 163 CZ TYR A 19 32.867 -6.922 -6.327 1.00174.12 C ANISOU 163 CZ TYR A 19 21502 19202 25452 2808 8628 5635 C ATOM 164 OH TYR A 19 31.833 -6.924 -7.242 1.00172.48 O ANISOU 164 OH TYR A 19 21641 19098 24796 2826 8386 6708 O ATOM 165 N GLY A 20 36.251 -10.081 -4.774 1.00176.12 N ANISOU 165 N GLY A 20 23563 19990 23365 2816 7426 2908 N ATOM 166 CA GLY A 20 36.415 -10.817 -6.015 1.00180.83 C ANISOU 166 CA GLY A 20 25188 20654 22867 3106 7109 3663 C ATOM 167 C GLY A 20 37.015 -12.189 -5.762 1.00184.71 C ANISOU 167 C GLY A 20 26624 21503 22054 3033 6355 3136 C ATOM 168 O GLY A 20 36.469 -13.194 -6.229 1.00207.67 O ANISOU 168 O GLY A 20 30476 24796 23632 2938 5553 3615 O ATOM 169 N LYS A 21 38.130 -12.223 -5.017 1.00169.58 N ANISOU 169 N LYS A 21 24448 19460 20524 3075 6614 2152 N ATOM 170 CA LYS A 21 38.853 -13.469 -4.703 1.00153.26 C ANISOU 170 CA LYS A 21 23206 17693 17333 3025 5979 1542 C ATOM 171 C LYS A 21 38.107 -14.243 -3.630 1.00146.01 C ANISOU 171 C LYS A 21 22473 17302 15704 2505 5108 1026 C ATOM 172 O LYS A 21 37.134 -13.731 -3.071 1.00145.38 O ANISOU 172 O LYS A 21 21797 17311 16131 2197 5079 1064 O ATOM 173 CB LYS A 21 40.304 -13.200 -4.268 1.00148.93 C ANISOU 173 CB LYS A 21 22283 16817 17487 3250 6581 665 C ATOM 174 CG LYS A 21 41.245 -12.871 -5.443 1.00150.58 C ANISOU 174 CG LYS A 21 22686 16593 17936 3797 7227 1138 C ATOM 175 CD LYS A 21 42.658 -12.528 -4.964 1.00148.60 C ANISOU 175 CD LYS A 21 21986 16002 18473 4009 7862 251 C ATOM 176 CE LYS A 21 43.691 -12.705 -6.090 1.00150.51 C ANISOU 176 CE LYS A 21 22788 15961 18437 4513 8194 613 C ATOM 177 NZ LYS A 21 43.895 -14.139 -6.494 1.00147.66 N ANISOU 177 NZ LYS A 21 23669 15978 16458 4522 7344 714 N ATOM 178 N VAL A 22 38.532 -15.476 -3.362 1.00144.73 N ANISOU 178 N VAL A 22 23146 17491 14355 2405 4390 570 N ATOM 179 CA VAL A 22 37.840 -16.311 -2.385 1.00139.15 C ANISOU 179 CA VAL A 22 22708 17308 12854 1915 3506 91 C ATOM 180 C VAL A 22 38.815 -17.184 -1.625 1.00149.10 C ANISOU 180 C VAL A 22 24342 18748 13564 1839 3155 -911 C ATOM 181 O VAL A 22 40.027 -17.136 -1.861 1.00154.45 O ANISOU 181 O VAL A 22 25064 19140 14481 2168 3604 -1227 O ATOM 182 CB VAL A 22 36.806 -17.229 -3.052 1.00142.04 C ANISOU 182 CB VAL A 22 24033 18110 11825 1779 2628 914 C ATOM 183 CG1 VAL A 22 36.128 -16.504 -4.194 1.00136.46 C ANISOU 183 CG1 VAL A 22 23209 17171 11468 2004 3014 2059 C ATOM 184 CG2 VAL A 22 37.451 -18.517 -3.532 1.00129.85 C ANISOU 184 CG2 VAL A 22 23652 16810 8877 1919 2028 897 C ATOM 185 N SER A 23 38.291 -17.976 -0.698 1.00127.70 N ANISOU 185 N SER A 23 14122 20843 13557 1053 4792 -1114 N ATOM 186 CA SER A 23 39.100 -19.023 -0.128 1.00134.85 C ANISOU 186 CA SER A 23 15235 20949 15052 1228 4152 -1194 C ATOM 187 C SER A 23 38.326 -20.304 0.142 1.00136.00 C ANISOU 187 C SER A 23 15894 20354 15425 843 3377 -1210 C ATOM 188 O SER A 23 37.320 -20.579 -0.500 1.00147.84 O ANISOU 188 O SER A 23 17590 21922 16659 667 3315 -1390 O ATOM 189 CB SER A 23 39.810 -18.530 1.111 1.00126.20 C ANISOU 189 CB SER A 23 13970 19796 14183 1037 4198 -667 C ATOM 190 OG SER A 23 40.861 -19.416 1.402 1.00134.53 O ANISOU 190 OG SER A 23 15129 20189 15797 1417 3709 -875 O ATOM 191 N THR A 24 38.800 -21.088 1.096 1.00120.88 N ANISOU 191 N THR A 24 14197 17727 14004 714 2784 -1022 N ATOM 192 CA THR A 24 38.244 -22.409 1.309 1.00118.65 C ANISOU 192 CA THR A 24 14403 16677 14001 446 2007 -1104 C ATOM 193 C THR A 24 38.244 -22.807 2.771 1.00121.05 C ANISOU 193 C THR A 24 14933 16409 14651 -103 1496 -551 C ATOM 194 O THR A 24 39.233 -22.622 3.476 1.00117.75 O ANISOU 194 O THR A 24 14354 15855 14533 45 1494 -358 O ATOM 195 CB THR A 24 39.011 -23.456 0.486 1.00140.04 C ANISOU 195 CB THR A 24 17230 18912 17067 1140 1643 -1782 C ATOM 196 OG1 THR A 24 38.285 -23.742 -0.723 1.00155.75 O ANISOU 196 OG1 THR A 24 19331 21075 18770 1304 1705 -2250 O ATOM 197 CG2 THR A 24 39.230 -24.739 1.297 1.00147.65 C ANISOU 197 CG2 THR A 24 18591 18928 18581 976 797 -1716 C ATOM 198 N TYR A 25 37.110 -23.349 3.200 1.00121.59 N ANISOU 198 N TYR A 25 15377 16155 14668 -741 1071 -301 N ATOM 199 CA TYR A 25 36.906 -23.847 4.551 1.00119.02 C ANISOU 199 CA TYR A 25 15334 15239 14647 -1335 522 214 C ATOM 200 C TYR A 25 38.193 -24.349 5.163 1.00121.98 C ANISOU 200 C TYR A 25 15696 15076 15575 -992 178 188 C ATOM 201 O TYR A 25 38.631 -23.861 6.216 1.00119.03 O ANISOU 201 O TYR A 25 15191 14700 15334 -1231 244 674 O ATOM 202 CB TYR A 25 35.926 -25.000 4.498 1.00125.27 C ANISOU 202 CB TYR A 25 16619 15456 15520 -1695 -127 110 C ATOM 203 CG TYR A 25 34.626 -24.632 3.847 1.00126.98 C ANISOU 203 CG TYR A 25 16887 16143 15216 -2022 151 94 C ATOM 204 CD1 TYR A 25 34.020 -25.488 2.942 1.00131.28 C ANISOU 204 CD1 TYR A 25 17711 16455 15716 -1898 -150 -375 C ATOM 205 CD2 TYR A 25 34.004 -23.429 4.141 1.00124.82 C ANISOU 205 CD2 TYR A 25 16384 16546 14497 -2456 713 547 C ATOM 206 CE1 TYR A 25 32.830 -25.168 2.356 1.00131.60 C ANISOU 206 CE1 TYR A 25 17804 16913 15286 -2200 92 -391 C ATOM 207 CE2 TYR A 25 32.810 -23.093 3.561 1.00124.90 C ANISOU 207 CE2 TYR A 25 16441 16981 14033 -2763 962 536 C ATOM 208 CZ TYR A 25 32.229 -23.967 2.662 1.00128.19 C ANISOU 208 CZ TYR A 25 17139 17150 14417 -2629 650 62 C ATOM 209 OH TYR A 25 31.038 -23.644 2.052 1.00123.99 O ANISOU 209 OH TYR A 25 16657 17042 13413 -2921 896 34 O ATOM 210 N GLY A 26 38.786 -25.338 4.495 1.00131.84 N ANISOU 210 N GLY A 26 17085 15862 17145 -432 -197 -384 N ATOM 211 CA GLY A 26 40.067 -25.878 4.904 1.00141.88 C ANISOU 211 CA GLY A 26 18337 16621 18948 -10 -523 -508 C ATOM 212 C GLY A 26 41.135 -24.806 4.823 1.00138.24 C ANISOU 212 C GLY A 26 17380 16714 18431 443 115 -495 C ATOM 213 O GLY A 26 41.871 -24.588 5.780 1.00139.56 O ANISOU 213 O GLY A 26 17438 16720 18867 384 65 -151 O ATOM 214 N GLU A 27 41.203 -24.116 3.692 1.00122.96 N ANISOU 214 N GLU A 27 15143 15441 16136 882 723 -859 N ATOM 215 CA GLU A 27 42.185 -23.061 3.513 1.00122.34 C ANISOU 215 CA GLU A 27 14581 15937 15966 1334 1370 -880 C ATOM 216 C GLU A 27 42.083 -21.980 4.575 1.00115.05 C ANISOU 216 C GLU A 27 13442 15397 14875 832 1732 -190 C ATOM 217 O GLU A 27 42.825 -21.007 4.549 1.00130.44 O ANISOU 217 O GLU A 27 14983 17856 16720 1124 2293 -123 O ATOM 218 CB GLU A 27 42.033 -22.423 2.133 1.00127.08 C ANISOU 218 CB GLU A 27 14915 17242 16126 1773 1990 -1329 C ATOM 219 CG GLU A 27 43.199 -21.527 1.745 1.00132.88 C ANISOU 219 CG GLU A 27 15169 18495 16825 2389 2603 -1502 C ATOM 220 CD GLU A 27 44.539 -22.225 1.910 1.00135.94 C ANISOU 220 CD GLU A 27 15548 18333 17770 2938 2248 -1777 C ATOM 221 OE1 GLU A 27 45.244 -21.940 2.908 1.00134.62 O ANISOU 221 OE1 GLU A 27 15257 18040 17853 2848 2226 -1398 O ATOM 222 OE2 GLU A 27 44.877 -23.057 1.033 1.00137.25 O ANISOU 222 OE2 GLU A 27 15832 18197 18121 3457 1993 -2376 O ATOM 223 N ILE A 28 41.165 -22.140 5.514 1.00110.48 N ANISOU 223 N ILE A 28 13134 14577 14267 76 1416 326 N ATOM 224 CA ILE A 28 41.015 -21.136 6.550 1.00104.40 C ANISOU 224 CA ILE A 28 12176 14155 13335 -433 1741 997 C ATOM 225 C ILE A 28 41.205 -21.702 7.946 1.00105.49 C ANISOU 225 C ILE A 28 12561 13618 13904 -870 1158 1461 C ATOM 226 O ILE A 28 41.850 -21.086 8.801 1.00102.43 O ANISOU 226 O ILE A 28 11955 13332 13632 -947 1342 1857 O ATOM 227 CB ILE A 28 39.680 -20.421 6.414 1.00110.04 C ANISOU 227 CB ILE A 28 12889 15424 13498 -992 2101 1281 C ATOM 228 CG1 ILE A 28 39.533 -19.944 4.968 1.00107.87 C ANISOU 228 CG1 ILE A 28 12389 15778 12821 -515 2645 770 C ATOM 229 CG2 ILE A 28 39.601 -19.285 7.412 1.00101.40 C ANISOU 229 CG2 ILE A 28 11553 14758 12215 -1462 2508 1950 C ATOM 230 CD1 ILE A 28 38.771 -18.681 4.819 1.00 99.90 C ANISOU 230 CD1 ILE A 28 11124 15596 11238 -840 3323 1069 C ATOM 231 N ALA A 29 40.653 -22.884 8.178 1.00109.91 N ANISOU 231 N ALA A 29 13576 13480 14703 -1153 450 1411 N ATOM 232 CA ALA A 29 41.000 -23.617 9.383 1.00112.46 C ANISOU 232 CA ALA A 29 14158 13061 15510 -1441 -180 1736 C ATOM 233 C ALA A 29 42.511 -23.655 9.371 1.00128.67 C ANISOU 233 C ALA A 29 15973 14972 17944 -772 -143 1493 C ATOM 234 O ALA A 29 43.178 -23.313 10.355 1.00127.93 O ANISOU 234 O ALA A 29 15751 14786 18072 -879 -135 1886 O ATOM 235 CB ALA A 29 40.444 -25.000 9.332 1.00117.91 C ANISOU 235 CB ALA A 29 15344 13006 16449 -1608 -940 1523 C ATOM 236 N ARG A 30 43.054 -24.062 8.227 1.00142.66 N ANISOU 236 N ARG A 30 17681 16738 19787 -72 -108 833 N ATOM 237 CA ARG A 30 44.473 -23.871 7.997 1.00135.87 C ANISOU 237 CA ARG A 30 16511 15929 19186 630 97 551 C ATOM 238 C ARG A 30 44.638 -22.392 7.749 1.00125.70 C ANISOU 238 C ARG A 30 14741 15547 17474 736 958 712 C ATOM 239 O ARG A 30 44.145 -21.851 6.761 1.00117.57 O ANISOU 239 O ARG A 30 13555 15107 16010 880 1435 467 O ATOM 240 CB ARG A 30 45.032 -24.749 6.854 1.00138.45 C ANISOU 240 CB ARG A 30 16908 15974 19723 1355 -123 -206 C ATOM 241 CG ARG A 30 44.798 -24.299 5.405 1.00133.55 C ANISOU 241 CG ARG A 30 16077 15980 18685 1794 413 -710 C ATOM 242 CD ARG A 30 45.127 -25.432 4.442 1.00132.61 C ANISOU 242 CD ARG A 30 16157 15407 18822 2358 10 -1404 C ATOM 243 NE ARG A 30 45.533 -24.961 3.119 1.00143.44 N ANISOU 243 NE ARG A 30 17219 17333 19950 3024 556 -1949 N ATOM 244 CZ ARG A 30 45.760 -25.766 2.079 1.00164.05 C ANISOU 244 CZ ARG A 30 19942 19704 22683 3558 344 -2596 C ATOM 245 NH1 ARG A 30 45.604 -27.074 2.237 1.00176.04 N ANISOU 245 NH1 ARG A 30 21881 20440 24565 3487 -406 -2761 N ATOM 246 NH2 ARG A 30 46.139 -25.275 0.892 1.00168.53 N ANISOU 246 NH2 ARG A 30 20211 20806 23014 4156 873 -3075 N ATOM 247 N TYR A 31 45.283 -21.745 8.706 1.00122.17 N ANISOU 247 N TYR A 31 10270 14773 21375 -1375 2222 606 N ATOM 248 CA TYR A 31 45.554 -20.325 8.676 1.00138.85 C ANISOU 248 CA TYR A 31 12210 16533 24012 -2183 2585 399 C ATOM 249 C TYR A 31 45.377 -19.830 10.083 1.00133.13 C ANISOU 249 C TYR A 31 11626 15753 23205 -3085 2517 -262 C ATOM 250 O TYR A 31 46.302 -19.279 10.671 1.00146.47 O ANISOU 250 O TYR A 31 12889 17916 24846 -3817 2453 -413 O ATOM 251 CB TYR A 31 44.616 -19.551 7.746 1.00140.80 C ANISOU 251 CB TYR A 31 12834 15763 24902 -2010 3074 423 C ATOM 252 CG TYR A 31 44.861 -18.050 7.774 1.00154.88 C ANISOU 252 CG TYR A 31 14467 17151 27229 -2885 3451 175 C ATOM 253 CD1 TYR A 31 45.163 -17.399 8.970 1.00156.06 C ANISOU 253 CD1 TYR A 31 14511 17449 27334 -3855 3400 -345 C ATOM 254 CD2 TYR A 31 44.808 -17.289 6.610 1.00161.78 C ANISOU 254 CD2 TYR A 31 15300 17515 28654 -2746 3855 462 C ATOM 255 CE1 TYR A 31 45.399 -16.047 9.012 1.00149.99 C ANISOU 255 CE1 TYR A 31 13602 16336 27052 -4655 3738 -573 C ATOM 256 CE2 TYR A 31 45.039 -15.921 6.644 1.00155.30 C ANISOU 256 CE2 TYR A 31 14349 16335 28324 -3551 4197 235 C ATOM 257 CZ TYR A 31 45.334 -15.313 7.854 1.00153.71 C ANISOU 257 CZ TYR A 31 14045 16297 28062 -4502 4135 -285 C ATOM 258 OH TYR A 31 45.561 -13.964 7.918 1.00144.49 O ANISOU 258 OH TYR A 31 12750 14778 27371 -5311 4471 -522 O ATOM 259 N VAL A 32 44.184 -20.009 10.627 1.00126.33 N ANISOU 259 N VAL A 32 11361 14307 22331 -3048 2539 -667 N ATOM 260 CA VAL A 32 43.958 -19.566 11.990 1.00132.97 C ANISOU 260 CA VAL A 32 12362 15076 23085 -3899 2471 -1313 C ATOM 261 C VAL A 32 44.576 -20.570 12.953 1.00131.68 C ANISOU 261 C VAL A 32 11996 15817 22221 -3909 1953 -1362 C ATOM 262 O VAL A 32 44.314 -20.543 14.160 1.00131.39 O ANISOU 262 O VAL A 32 12145 15810 21969 -4457 1801 -1876 O ATOM 263 CB VAL A 32 42.480 -19.338 12.267 1.00130.26 C ANISOU 263 CB VAL A 32 12719 13784 22991 -3915 2686 -1761 C ATOM 264 CG1 VAL A 32 41.956 -18.291 11.297 1.00134.61 C ANISOU 264 CG1 VAL A 32 13431 13469 24246 -3932 3196 -1701 C ATOM 265 CG2 VAL A 32 41.722 -20.645 12.118 1.00119.22 C ANISOU 265 CG2 VAL A 32 11718 12366 21215 -3013 2456 -1609 C ATOM 266 N GLY A 33 45.416 -21.437 12.389 1.00135.65 N ANISOU 266 N GLY A 33 12105 17056 22378 -3301 1688 -818 N ATOM 267 CA GLY A 33 46.250 -22.344 13.154 1.00139.65 C ANISOU 267 CA GLY A 33 12298 18530 22233 -3297 1193 -771 C ATOM 268 C GLY A 33 45.517 -23.594 13.581 1.00133.31 C ANISOU 268 C GLY A 33 11925 17784 20943 -2702 875 -832 C ATOM 269 O GLY A 33 46.010 -24.365 14.415 1.00127.51 O ANISOU 269 O GLY A 33 11046 17762 19641 -2750 450 -901 O ATOM 270 N MET A 34 44.330 -23.789 13.013 1.00120.79 N ANISOU 270 N MET A 34 10875 15440 19578 -2143 1083 -812 N ATOM 271 CA MET A 34 43.476 -24.902 13.404 1.00126.53 C ANISOU 271 CA MET A 34 12084 16096 19895 -1593 833 -916 C ATOM 272 C MET A 34 43.118 -25.686 12.157 1.00117.66 C ANISOU 272 C MET A 34 11086 14829 18790 -517 873 -367 C ATOM 273 O MET A 34 41.957 -25.802 11.788 1.00107.77 O ANISOU 273 O MET A 34 10361 12845 17740 -100 1071 -444 O ATOM 274 CB MET A 34 42.212 -24.418 14.130 1.00134.11 C ANISOU 274 CB MET A 34 13661 16226 21068 -2014 1030 -1541 C ATOM 275 CG MET A 34 42.441 -23.538 15.380 1.00152.20 C ANISOU 275 CG MET A 34 15878 18552 23401 -3127 1035 -2137 C ATOM 276 SD MET A 34 42.783 -24.469 16.885 1.00138.67 S ANISOU 276 SD MET A 34 14148 17620 20919 -3399 483 -2453 S ATOM 277 CE MET A 34 43.002 -26.139 16.273 1.00114.72 C ANISOU 277 CE MET A 34 11069 15202 17316 -2229 89 -1852 C ATOM 278 N PRO A 35 44.138 -26.246 11.511 1.00123.70 N ANISOU 278 N PRO A 35 11352 16317 19331 -60 676 187 N ATOM 279 CA PRO A 35 44.070 -27.003 10.263 1.00120.04 C ANISOU 279 CA PRO A 35 10871 15881 18858 955 683 787 C ATOM 280 C PRO A 35 42.820 -27.859 10.216 1.00114.07 C ANISOU 280 C PRO A 35 10741 14651 17949 1634 640 719 C ATOM 281 O PRO A 35 41.984 -27.645 9.355 1.00111.19 O ANISOU 281 O PRO A 35 10700 13565 17983 2058 965 831 O ATOM 282 CB PRO A 35 45.301 -27.905 10.337 1.00127.99 C ANISOU 282 CB PRO A 35 11339 17977 19313 1224 237 1173 C ATOM 283 CG PRO A 35 45.743 -27.859 11.807 1.00141.50 C ANISOU 283 CG PRO A 35 12943 20174 20646 438 -61 699 C ATOM 284 CD PRO A 35 45.396 -26.486 12.232 1.00141.04 C ANISOU 284 CD PRO A 35 13012 19488 21087 -462 305 209 C ATOM 285 N SER A 36 42.690 -28.797 11.148 1.00110.06 N ANISOU 285 N SER A 36 10407 14537 16872 1719 249 522 N ATOM 286 CA SER A 36 41.674 -29.847 11.061 1.00 97.51 C ANISOU 286 CA SER A 36 9346 12679 15025 2481 131 548 C ATOM 287 C SER A 36 40.216 -29.380 11.131 1.00101.76 C ANISOU 287 C SER A 36 10550 12176 15939 2411 469 125 C ATOM 288 O SER A 36 39.294 -30.140 10.828 1.00 98.95 O ANISOU 288 O SER A 36 10642 11478 15474 3103 457 187 O ATOM 289 CB SER A 36 41.931 -30.928 12.115 1.00 98.96 C ANISOU 289 CB SER A 36 9550 13556 14495 2522 -378 414 C ATOM 290 OG SER A 36 42.250 -30.372 13.367 1.00105.69 O ANISOU 290 OG SER A 36 10319 14604 15236 1574 -484 -96 O ATOM 291 N TYR A 37 40.006 -28.129 11.511 1.00 89.52 N ANISOU 291 N TYR A 37 9062 10119 14834 1585 775 -303 N ATOM 292 CA TYR A 37 38.661 -27.669 11.831 1.00 96.18 C ANISOU 292 CA TYR A 37 10532 10034 15978 1384 1048 -804 C ATOM 293 C TYR A 37 37.881 -27.122 10.643 1.00102.21 C ANISOU 293 C TYR A 37 11548 9944 17341 1787 1502 -633 C ATOM 294 O TYR A 37 37.031 -26.234 10.783 1.00108.16 O ANISOU 294 O TYR A 37 12664 9892 18541 1375 1838 -1046 O ATOM 295 CB TYR A 37 38.706 -26.686 12.992 1.00 97.88 C ANISOU 295 CB TYR A 37 10757 10114 16320 285 1114 -1422 C ATOM 296 CG TYR A 37 38.894 -27.382 14.325 1.00108.96 C ANISOU 296 CG TYR A 37 12204 12087 17111 -19 683 -1750 C ATOM 297 CD1 TYR A 37 39.227 -28.732 14.393 1.00108.23 C ANISOU 297 CD1 TYR A 37 12040 12675 16406 624 259 -1441 C ATOM 298 CD2 TYR A 37 38.709 -26.697 15.511 1.00121.86 C ANISOU 298 CD2 TYR A 37 13967 13557 18777 -941 701 -2372 C ATOM 299 CE1 TYR A 37 39.384 -29.368 15.604 1.00123.59 C ANISOU 299 CE1 TYR A 37 14044 15124 17789 352 -135 -1739 C ATOM 300 CE2 TYR A 37 38.860 -27.318 16.730 1.00135.80 C ANISOU 300 CE2 TYR A 37 15786 15824 19986 -1227 313 -2678 C ATOM 301 CZ TYR A 37 39.199 -28.655 16.777 1.00134.69 C ANISOU 301 CZ TYR A 37 15579 16358 19240 -579 -107 -2360 C ATOM 302 OH TYR A 37 39.349 -29.265 18.006 1.00136.94 O ANISOU 302 OH TYR A 37 15930 17136 18966 -876 -497 -2671 O ATOM 303 N ALA A 38 38.155 -27.694 9.477 1.00106.12 N ANISOU 303 N ALA A 38 11861 10626 17832 2617 1500 -22 N ATOM 304 CA ALA A 38 37.547 -27.232 8.246 1.00105.55 C ANISOU 304 CA ALA A 38 11966 9830 18309 3062 1912 221 C ATOM 305 C ALA A 38 36.045 -27.344 8.366 1.00 92.48 C ANISOU 305 C ALA A 38 11019 7326 16791 3300 2084 -142 C ATOM 306 O ALA A 38 35.315 -26.437 7.990 1.00 90.75 O ANISOU 306 O ALA A 38 11075 6284 17121 3117 2486 -340 O ATOM 307 CB ALA A 38 38.049 -28.044 7.081 1.00111.33 C ANISOU 307 CB ALA A 38 12417 10976 18909 3981 1814 927 C ATOM 308 N ARG A 39 35.590 -28.457 8.921 1.00119.12 N ANISOU 308 N ARG A 39 15378 17609 12275 -2123 1945 268 N ATOM 309 CA ARG A 39 34.170 -28.730 8.976 1.00119.62 C ANISOU 309 CA ARG A 39 14813 17686 12951 -2865 2223 332 C ATOM 310 C ARG A 39 33.494 -27.716 9.873 1.00106.72 C ANISOU 310 C ARG A 39 12165 16269 12115 -2408 2322 270 C ATOM 311 O ARG A 39 32.336 -27.380 9.670 1.00108.02 O ANISOU 311 O ARG A 39 11384 16597 13062 -2957 2159 361 O ATOM 312 CB ARG A 39 33.911 -30.166 9.440 1.00117.94 C ANISOU 312 CB ARG A 39 15542 17111 12159 -3216 3155 273 C ATOM 313 CG ARG A 39 32.432 -30.569 9.521 1.00129.08 C ANISOU 313 CG ARG A 39 16387 18506 14150 -4017 3511 338 C ATOM 314 CD ARG A 39 31.771 -30.874 8.167 1.00151.00 C ANISOU 314 CD ARG A 39 18831 21347 17197 -5121 2951 535 C ATOM 315 NE ARG A 39 31.474 -32.295 7.948 1.00159.31 N ANISOU 315 NE ARG A 39 20712 22090 17729 -5836 3498 562 N ATOM 316 CZ ARG A 39 32.288 -33.297 8.287 1.00151.79 C ANISOU 316 CZ ARG A 39 21005 20824 15846 -5595 4075 466 C ATOM 317 NH1 ARG A 39 31.942 -34.557 8.040 1.00141.58 N ANISOU 317 NH1 ARG A 39 20395 19264 14135 -6296 4540 500 N ATOM 318 NH2 ARG A 39 33.461 -33.047 8.867 1.00158.05 N ANISOU 318 NH2 ARG A 39 22373 21566 16112 -4653 4185 336 N ATOM 319 N GLN A 40 34.220 -27.196 10.852 1.00100.91 N ANISOU 319 N GLN A 40 11604 15542 11195 -1398 2567 118 N ATOM 320 CA GLN A 40 33.595 -26.262 11.782 1.00103.44 C ANISOU 320 CA GLN A 40 11007 16051 12243 -926 2717 50 C ATOM 321 C GLN A 40 33.471 -24.889 11.137 1.00107.80 C ANISOU 321 C GLN A 40 10422 16986 13553 -869 1750 149 C ATOM 322 O GLN A 40 32.584 -24.104 11.469 1.00113.23 O ANISOU 322 O GLN A 40 10072 17886 15066 -870 1662 167 O ATOM 323 CB GLN A 40 34.353 -26.192 13.104 1.00 97.89 C ANISOU 323 CB GLN A 40 10868 15221 11104 127 3351 -150 C ATOM 324 CG GLN A 40 35.464 -27.223 13.242 1.00107.16 C ANISOU 324 CG GLN A 40 13447 16078 11192 395 3794 -236 C ATOM 325 CD GLN A 40 34.968 -28.663 13.311 1.00121.95 C ANISOU 325 CD GLN A 40 16070 17632 12632 -268 4531 -235 C ATOM 326 OE1 GLN A 40 34.418 -29.100 14.322 1.00134.06 O ANISOU 326 OE1 GLN A 40 17725 19018 14194 -158 5341 -334 O ATOM 327 NE2 GLN A 40 35.187 -29.412 12.234 1.00117.55 N ANISOU 327 NE2 GLN A 40 16042 16964 11657 -948 4254 -124 N ATOM 328 N VAL A 41 34.353 -24.624 10.183 1.00109.40 N ANISOU 328 N VAL A 41 10829 17271 13469 -846 1020 220 N ATOM 329 CA VAL A 41 34.328 -23.378 9.432 1.00117.56 C ANISOU 329 CA VAL A 41 10859 18658 15151 -836 43 325 C ATOM 330 C VAL A 41 33.037 -23.270 8.639 1.00 96.61 C ANISOU 330 C VAL A 41 7271 16166 13272 -1816 -329 492 C ATOM 331 O VAL A 41 32.499 -22.182 8.437 1.00 98.62 O ANISOU 331 O VAL A 41 6405 16726 14339 -1823 -880 558 O ATOM 332 CB VAL A 41 35.523 -23.285 8.467 1.00111.39 C ANISOU 332 CB VAL A 41 10585 17899 13837 -722 -642 378 C ATOM 333 CG1 VAL A 41 35.589 -21.888 7.844 1.00 98.25 C ANISOU 333 CG1 VAL A 41 7880 16610 12841 -555 -1623 464 C ATOM 334 CG2 VAL A 41 36.821 -23.626 9.202 1.00120.92 C ANISOU 334 CG2 VAL A 41 12887 18896 14161 157 -199 220 C ATOM 335 N GLY A 42 32.540 -24.409 8.185 1.00103.69 N ANISOU 335 N GLY A 42 8634 16855 13908 -2651 -25 562 N ATOM 336 CA GLY A 42 31.315 -24.407 7.422 1.00108.97 C ANISOU 336 CA GLY A 42 8486 17655 15264 -3623 -341 723 C ATOM 337 C GLY A 42 30.222 -23.927 8.343 1.00117.32 C ANISOU 337 C GLY A 42 8674 18824 17079 -3523 55 682 C ATOM 338 O GLY A 42 29.481 -22.987 8.023 1.00118.66 O ANISOU 338 O GLY A 42 7691 19287 18106 -3733 -478 775 O ATOM 339 N GLN A 43 30.156 -24.582 9.502 1.00127.25 N ANISOU 339 N GLN A 43 10509 19842 17998 -3178 1002 539 N ATOM 340 CA GLN A 43 29.180 -24.289 10.539 1.00130.55 C ANISOU 340 CA GLN A 43 10277 20309 19017 -3022 1538 476 C ATOM 341 C GLN A 43 29.223 -22.814 10.902 1.00127.67 C ANISOU 341 C GLN A 43 8931 20263 19315 -2339 1077 448 C ATOM 342 O GLN A 43 28.212 -22.127 10.828 1.00120.58 O ANISOU 342 O GLN A 43 6938 19595 19282 -2633 823 528 O ATOM 343 CB GLN A 43 29.426 -25.194 11.754 1.00127.94 C ANISOU 343 CB GLN A 43 10895 19655 18061 -2581 2600 304 C ATOM 344 CG GLN A 43 29.283 -26.680 11.438 1.00142.80 C ANISOU 344 CG GLN A 43 13717 21217 19325 -3292 3104 332 C ATOM 345 CD GLN A 43 28.140 -26.962 10.441 1.00159.27 C ANISOU 345 CD GLN A 43 15203 23381 21932 -4437 2774 518 C ATOM 346 OE1 GLN A 43 26.959 -26.865 10.799 1.00160.41 O ANISOU 346 OE1 GLN A 43 14626 23592 22730 -4787 3037 550 O ATOM 347 NE2 GLN A 43 28.492 -27.296 9.179 1.00165.05 N ANISOU 347 NE2 GLN A 43 16223 24107 22381 -5020 2187 644 N ATOM 348 N ALA A 44 30.404 -22.333 11.265 1.00113.14 N ANISOU 348 N ALA A 44 7098 18636 17255 -3604 79 -254 N ATOM 349 CA ALA A 44 30.618 -20.917 11.531 1.00115.55 C ANISOU 349 CA ALA A 44 7674 18908 17320 -3439 -448 -1072 C ATOM 350 C ALA A 44 29.882 -20.032 10.540 1.00128.38 C ANISOU 350 C ALA A 44 9314 19809 19655 -2818 -764 -2133 C ATOM 351 O ALA A 44 29.289 -19.022 10.886 1.00130.13 O ANISOU 351 O ALA A 44 9517 20218 19710 -2641 -896 -3249 O ATOM 352 CB ALA A 44 32.093 -20.615 11.479 1.00112.46 C ANISOU 352 CB ALA A 44 7735 18242 16753 -3581 -991 -239 C ATOM 353 N MET A 45 29.948 -20.413 9.282 1.00132.25 N ANISOU 353 N MET A 45 9847 19450 20951 -2485 -900 -1762 N ATOM 354 CA MET A 45 29.325 -19.638 8.240 1.00103.07 C ANISOU 354 CA MET A 45 6184 14991 17985 -1888 -1221 -2666 C ATOM 355 C MET A 45 27.856 -19.925 8.273 1.00106.06 C ANISOU 355 C MET A 45 6116 15628 18555 -1734 -691 -3506 C ATOM 356 O MET A 45 27.035 -19.026 8.129 1.00109.60 O ANISOU 356 O MET A 45 6499 15957 19185 -1380 -821 -4682 O ATOM 357 CB MET A 45 29.895 -20.049 6.897 1.00 94.62 C ANISOU 357 CB MET A 45 5296 12947 17708 -1614 -1506 -1917 C ATOM 358 CG MET A 45 31.369 -19.732 6.763 1.00122.02 C ANISOU 358 CG MET A 45 9230 16081 21052 -1730 -2069 -1095 C ATOM 359 SD MET A 45 31.668 -17.999 6.346 1.00110.17 S ANISOU 359 SD MET A 45 8132 14007 19720 -1288 -2878 -2036 S ATOM 360 CE MET A 45 32.732 -17.478 7.689 1.00 95.30 C ANISOU 360 CE MET A 45 6526 12868 16814 -1785 -3094 -1716 C ATOM 361 N LYS A 46 27.524 -21.195 8.462 1.00106.34 N ANISOU 361 N LYS A 46 5838 16016 18550 -2002 -87 -2893 N ATOM 362 CA LYS A 46 26.131 -21.594 8.529 1.00109.22 C ANISOU 362 CA LYS A 46 5755 16668 19074 -1894 472 -3611 C ATOM 363 C LYS A 46 25.391 -20.703 9.510 1.00135.04 C ANISOU 363 C LYS A 46 8904 20607 21798 -1931 553 -4790 C ATOM 364 O LYS A 46 24.272 -20.284 9.247 1.00118.25 O ANISOU 364 O LYS A 46 6561 18382 19986 -1590 662 -5850 O ATOM 365 CB LYS A 46 25.986 -23.058 8.948 1.00110.03 C ANISOU 365 CB LYS A 46 5550 17291 18965 -2306 1144 -2750 C ATOM 366 CG LYS A 46 24.525 -23.481 9.128 1.00113.58 C ANISOU 366 CG LYS A 46 5525 18121 19509 -2229 1757 -3509 C ATOM 367 CD LYS A 46 24.359 -24.898 9.667 1.00115.08 C ANISOU 367 CD LYS A 46 5404 18914 19409 -2670 2443 -2704 C ATOM 368 CE LYS A 46 23.328 -25.638 8.819 1.00122.74 C ANISOU 368 CE LYS A 46 6032 19526 21079 -2376 2846 -2887 C ATOM 369 NZ LYS A 46 22.886 -26.932 9.388 1.00126.00 N ANISOU 369 NZ LYS A 46 6079 20583 21213 -2758 3573 -2364 N ATOM 370 N HIS A 47 26.022 -20.434 10.650 1.00146.09 N ANISOU 370 N HIS A 47 10440 22695 22374 -2357 507 -4589 N ATOM 371 CA HIS A 47 25.461 -19.533 11.661 1.00155.02 C ANISOU 371 CA HIS A 47 11494 24490 22916 -2434 542 -5651 C ATOM 372 C HIS A 47 25.239 -18.153 11.006 1.00145.14 C ANISOU 372 C HIS A 47 10450 22614 22082 -1902 -40 -6701 C ATOM 373 O HIS A 47 24.483 -18.070 10.037 1.00147.95 O ANISOU 373 O HIS A 47 10683 22368 23162 -1444 -58 -7238 O ATOM 374 CB HIS A 47 26.327 -19.512 12.929 1.00162.78 C ANISOU 374 CB HIS A 47 12628 26255 22966 -2991 548 -5123 C ATOM 375 CG HIS A 47 26.402 -20.845 13.625 1.00172.87 C ANISOU 375 CG HIS A 47 13666 28196 23820 -3507 1159 -4212 C ATOM 376 ND1 HIS A 47 27.376 -21.151 14.559 1.00185.74 N ANISOU 376 ND1 HIS A 47 15448 30399 24724 -4032 1183 -3368 N ATOM 377 CD2 HIS A 47 25.620 -21.944 13.527 1.00177.30 C ANISOU 377 CD2 HIS A 47 13847 28941 24577 -3577 1768 -4023 C ATOM 378 CE1 HIS A 47 27.186 -22.380 15.002 1.00187.57 C ANISOU 378 CE1 HIS A 47 15405 31137 24728 -4403 1778 -2700 C ATOM 379 NE2 HIS A 47 26.128 -22.887 14.399 1.00183.24 N ANISOU 379 NE2 HIS A 47 14530 30371 24723 -4141 2147 -3076 N ATOM 380 N LEU A 48 25.875 -17.086 11.479 1.00132.10 N ANISOU 380 N LEU A 48 9110 21070 20012 -1944 -517 -6995 N ATOM 381 CA LEU A 48 25.763 -15.790 10.783 1.00127.68 C ANISOU 381 CA LEU A 48 8779 19854 19880 -1431 -1108 -7909 C ATOM 382 C LEU A 48 24.338 -15.339 10.496 1.00133.60 C ANISOU 382 C LEU A 48 9233 20520 21009 -1031 -933 -9206 C ATOM 383 O LEU A 48 23.579 -16.012 9.810 1.00128.88 O ANISOU 383 O LEU A 48 8369 19624 20974 -820 -613 -9252 O ATOM 384 CB LEU A 48 26.483 -15.841 9.438 1.00121.91 C ANISOU 384 CB LEU A 48 8335 18082 19904 -1095 -1573 -7291 C ATOM 385 CG LEU A 48 27.917 -16.343 9.434 1.00129.22 C ANISOU 385 CG LEU A 48 9570 18887 20639 -1409 -1792 -5942 C ATOM 386 CD1 LEU A 48 28.580 -15.799 8.192 1.00135.04 C ANISOU 386 CD1 LEU A 48 10670 18580 22059 -984 -2438 -5776 C ATOM 387 CD2 LEU A 48 28.636 -15.874 10.683 1.00132.01 C ANISOU 387 CD2 LEU A 48 10106 19972 20082 -1842 -1908 -5820 C ATOM 388 N HIS A 49 23.979 -14.165 10.972 1.00130.99 N ANISOU 388 N HIS A 49 13072 17263 19435 1102 -1451 -4107 N ATOM 389 CA HIS A 49 22.668 -13.637 10.651 1.00144.32 C ANISOU 389 CA HIS A 49 14625 19562 20649 1462 -1283 -3458 C ATOM 390 C HIS A 49 22.745 -13.053 9.257 1.00138.15 C ANISOU 390 C HIS A 49 13820 19127 19542 1360 -1128 -3543 C ATOM 391 O HIS A 49 23.820 -12.654 8.811 1.00132.77 O ANISOU 391 O HIS A 49 13413 18113 18919 1185 -1052 -3986 O ATOM 392 CB HIS A 49 22.262 -12.594 11.687 1.00157.51 C ANISOU 392 CB HIS A 49 16754 21046 22048 2063 -1020 -2936 C ATOM 393 CG HIS A 49 22.254 -13.131 13.090 1.00146.22 C ANISOU 393 CG HIS A 49 15379 19237 20942 2174 -1163 -2870 C ATOM 394 ND1 HIS A 49 22.967 -12.555 14.118 1.00127.20 N ANISOU 394 ND1 HIS A 49 13490 16202 18639 2415 -1049 -2942 N ATOM 395 CD2 HIS A 49 21.648 -14.222 13.605 1.00142.78 C ANISOU 395 CD2 HIS A 49 14531 18957 20762 2059 -1419 -2760 C ATOM 396 CE1 HIS A 49 22.781 -13.265 15.220 1.00123.39 C ANISOU 396 CE1 HIS A 49 12915 15511 18455 2454 -1225 -2870 C ATOM 397 NE2 HIS A 49 21.988 -14.275 14.938 1.00127.53 N ANISOU 397 NE2 HIS A 49 12881 16499 19076 2241 -1449 -2756 N ATOM 398 N PRO A 50 21.611 -13.021 8.548 1.00138.04 N ANISOU 398 N PRO A 50 13471 19789 19191 1461 -1087 -3125 N ATOM 399 CA PRO A 50 21.585 -12.520 7.167 1.00143.15 C ANISOU 399 CA PRO A 50 14049 20827 19514 1363 -950 -3181 C ATOM 400 C PRO A 50 21.948 -11.031 7.090 1.00142.51 C ANISOU 400 C PRO A 50 14543 20543 19060 1732 -583 -3039 C ATOM 401 O PRO A 50 22.237 -10.513 6.013 1.00143.62 O ANISOU 401 O PRO A 50 14736 20854 18978 1634 -449 -3189 O ATOM 402 CB PRO A 50 20.124 -12.745 6.754 1.00146.82 C ANISOU 402 CB PRO A 50 14075 22026 19685 1508 -968 -2641 C ATOM 403 CG PRO A 50 19.605 -13.802 7.752 1.00141.63 C ANISOU 403 CG PRO A 50 13116 21342 19356 1470 -1230 -2506 C ATOM 404 CD PRO A 50 20.270 -13.406 9.020 1.00133.15 C ANISOU 404 CD PRO A 50 12530 19604 18457 1697 -1153 -2556 C ATOM 405 N GLU A 51 21.950 -10.371 8.247 1.00144.10 N ANISOU 405 N GLU A 51 15173 20371 19208 2149 -429 -2761 N ATOM 406 CA GLU A 51 22.086 -8.913 8.359 1.00142.99 C ANISOU 406 CA GLU A 51 15584 20065 18680 2589 -72 -2505 C ATOM 407 C GLU A 51 23.553 -8.478 8.352 1.00134.38 C ANISOU 407 C GLU A 51 14931 18344 17785 2427 -2 -3055 C ATOM 408 O GLU A 51 23.870 -7.291 8.472 1.00130.55 O ANISOU 408 O GLU A 51 14939 17627 17037 2749 280 -2931 O ATOM 409 CB GLU A 51 21.403 -8.437 9.656 1.00152.48 C ANISOU 409 CB GLU A 51 17040 21147 19747 3119 47 -1950 C ATOM 410 CG GLU A 51 20.482 -9.494 10.314 1.00162.48 C ANISOU 410 CG GLU A 51 17870 22661 21205 3105 -196 -1683 C ATOM 411 CD GLU A 51 20.742 -9.727 11.822 1.00169.85 C ANISOU 411 CD GLU A 51 19034 23059 22445 3276 -276 -1659 C ATOM 412 OE1 GLU A 51 20.033 -10.580 12.419 1.00181.09 O ANISOU 412 OE1 GLU A 51 20121 24648 24038 3271 -471 -1447 O ATOM 413 OE2 GLU A 51 21.644 -9.081 12.420 1.00166.83 O ANISOU 413 OE2 GLU A 51 19157 22090 22139 3413 -149 -1851 O ATOM 414 N THR A 52 24.442 -9.455 8.210 1.00129.00 N ANISOU 414 N THR A 52 14059 17387 17566 1924 -264 -3663 N ATOM 415 CA THR A 52 25.869 -9.207 8.345 1.00126.78 C ANISOU 415 CA THR A 52 14165 16462 17544 1741 -240 -4218 C ATOM 416 C THR A 52 26.513 -8.431 7.201 1.00133.91 C ANISOU 416 C THR A 52 15261 17394 18223 1633 -48 -4468 C ATOM 417 O THR A 52 25.951 -8.306 6.116 1.00129.23 O ANISOU 417 O THR A 52 14415 17351 17336 1582 12 -4324 O ATOM 418 CB THR A 52 26.652 -10.497 8.546 1.00124.83 C ANISOU 418 CB THR A 52 13660 15902 17866 1230 -581 -4807 C ATOM 419 OG1 THR A 52 28.036 -10.169 8.649 1.00122.75 O ANISOU 419 OG1 THR A 52 13796 15018 17825 1074 -536 -5330 O ATOM 420 CG2 THR A 52 26.472 -11.409 7.362 1.00125.87 C ANISOU 420 CG2 THR A 52 13239 16509 18076 768 -791 -5059 C ATOM 421 N HIS A 53 27.704 -7.905 7.463 1.00141.44 N ANISOU 421 N HIS A 53 16670 17748 19323 1602 49 -4844 N ATOM 422 CA HIS A 53 28.489 -7.234 6.432 1.00134.85 C ANISOU 422 CA HIS A 53 16036 16857 18343 1456 212 -5159 C ATOM 423 C HIS A 53 29.734 -8.065 6.245 1.00131.89 C ANISOU 423 C HIS A 53 15580 16073 18458 921 -21 -5895 C ATOM 424 O HIS A 53 30.778 -7.582 5.798 1.00129.37 O ANISOU 424 O HIS A 53 15545 15430 18179 775 81 -6293 O ATOM 425 CB HIS A 53 28.864 -5.823 6.865 1.00132.42 C ANISOU 425 CB HIS A 53 16359 16181 17773 1887 542 -4973 C ATOM 426 CG HIS A 53 27.824 -5.153 7.672 1.00148.24 C ANISOU 426 CG HIS A 53 18536 18336 19451 2450 716 -4291 C ATOM 427 ND1 HIS A 53 26.659 -4.590 7.097 1.00162.61 N ANISOU 427 ND1 HIS A 53 20230 20780 20775 2748 893 -3733 N ATOM 428 CD2 HIS A 53 27.668 -4.946 8.990 1.00159.93 C ANISOU 428 CD2 HIS A 53 20289 19476 21001 2797 745 -4031 C ATOM 429 CE1 HIS A 53 25.913 -4.094 8.018 1.00166.55 C ANISOU 429 CE1 HIS A 53 20920 21287 21076 3224 1014 -3201 C ATOM 430 NE2 HIS A 53 26.497 -4.287 9.222 1.00167.99 N ANISOU 430 NE2 HIS A 53 21355 20879 21595 3279 929 -3358 N ATOM 431 N VAL A 54 29.606 -9.331 6.613 1.00141.66 N ANISOU 431 N VAL A 54 21326 14757 17743 336 -242 1288 N ATOM 432 CA VAL A 54 30.669 -10.301 6.435 1.00139.79 C ANISOU 432 CA VAL A 54 21371 14919 16826 -157 -161 843 C ATOM 433 C VAL A 54 30.467 -11.056 5.109 1.00149.02 C ANISOU 433 C VAL A 54 21482 17505 17635 -656 -506 597 C ATOM 434 O VAL A 54 29.325 -11.303 4.693 1.00137.81 O ANISOU 434 O VAL A 54 19190 16531 16639 -607 -419 399 O ATOM 435 CB VAL A 54 30.681 -11.292 7.594 1.00146.23 C ANISOU 435 CB VAL A 54 22804 14900 17858 -98 780 37 C ATOM 436 CG1 VAL A 54 30.291 -12.675 7.108 1.00155.31 C ANISOU 436 CG1 VAL A 54 23256 16840 18913 -500 1119 -756 C ATOM 437 CG2 VAL A 54 32.047 -11.302 8.250 1.00119.08 C ANISOU 437 CG2 VAL A 54 20470 10849 13926 -184 864 54 C ATOM 438 N PRO A 55 31.578 -11.395 4.433 1.00148.18 N ANISOU 438 N PRO A 55 21447 18109 16746 -1129 -918 631 N ATOM 439 CA PRO A 55 31.654 -12.030 3.102 1.00151.82 C ANISOU 439 CA PRO A 55 21004 19962 16720 -1642 -1364 491 C ATOM 440 C PRO A 55 31.465 -13.563 3.060 1.00147.97 C ANISOU 440 C PRO A 55 20185 19891 16145 -1998 -795 -452 C ATOM 441 O PRO A 55 32.292 -14.273 2.472 1.00156.84 O ANISOU 441 O PRO A 55 21248 21739 16605 -2481 -983 -687 O ATOM 442 CB PRO A 55 33.072 -11.668 2.629 1.00150.90 C ANISOU 442 CB PRO A 55 21338 20196 15801 -1944 -1984 950 C ATOM 443 CG PRO A 55 33.519 -10.521 3.555 1.00143.19 C ANISOU 443 CG PRO A 55 21334 18074 14997 -1508 -2021 1528 C ATOM 444 CD PRO A 55 32.883 -10.861 4.855 1.00136.11 C ANISOU 444 CD PRO A 55 20912 16055 14749 -1135 -1137 1018 C ATOM 445 N TRP A 56 30.387 -14.066 3.654 1.00137.04 N ANISOU 445 N TRP A 56 18574 18076 15417 -1765 -122 -978 N ATOM 446 CA TRP A 56 30.137 -15.508 3.685 1.00128.72 C ANISOU 446 CA TRP A 56 17216 17349 14342 -2069 459 -1885 C ATOM 447 C TRP A 56 30.175 -16.194 2.299 1.00130.34 C ANISOU 447 C TRP A 56 16456 19008 14060 -2595 -2 -2049 C ATOM 448 O TRP A 56 30.808 -17.246 2.111 1.00127.35 O ANISOU 448 O TRP A 56 16130 19069 13189 -3024 165 -2584 O ATOM 449 CB TRP A 56 28.810 -15.791 4.419 1.00131.79 C ANISOU 449 CB TRP A 56 17372 17119 15584 -1697 1172 -2327 C ATOM 450 CG TRP A 56 27.552 -15.164 3.812 1.00143.00 C ANISOU 450 CG TRP A 56 17856 18942 17538 -1455 864 -1976 C ATOM 451 CD1 TRP A 56 26.979 -13.958 4.139 1.00144.93 C ANISOU 451 CD1 TRP A 56 18192 18587 18289 -961 694 -1365 C ATOM 452 CD2 TRP A 56 26.727 -15.726 2.791 1.00150.89 C ANISOU 452 CD2 TRP A 56 17705 21016 18611 -1693 697 -2229 C ATOM 453 NE1 TRP A 56 25.852 -13.736 3.375 1.00151.88 N ANISOU 453 NE1 TRP A 56 18047 20114 19546 -885 431 -1223 N ATOM 454 CE2 TRP A 56 25.675 -14.811 2.536 1.00155.81 C ANISOU 454 CE2 TRP A 56 17765 21645 19790 -1328 427 -1749 C ATOM 455 CE3 TRP A 56 26.771 -16.919 2.059 1.00155.17 C ANISOU 455 CE3 TRP A 56 17631 22526 18801 -2180 745 -2818 C ATOM 456 CZ2 TRP A 56 24.686 -15.053 1.582 1.00168.32 C ANISOU 456 CZ2 TRP A 56 18208 24161 21586 -1435 208 -1843 C ATOM 457 CZ3 TRP A 56 25.788 -17.157 1.118 1.00162.65 C ANISOU 457 CZ3 TRP A 56 17445 24390 19963 -2281 527 -2908 C ATOM 458 CH2 TRP A 56 24.761 -16.234 0.889 1.00167.98 C ANISOU 458 CH2 TRP A 56 17589 25043 21194 -1911 265 -2428 C ATOM 459 N HIS A 57 29.500 -15.574 1.341 1.00138.18 N ANISOU 459 N HIS A 57 16581 20731 15192 -2549 -587 -1579 N ATOM 460 CA HIS A 57 29.280 -16.168 0.030 1.00148.61 C ANISOU 460 CA HIS A 57 16868 23408 16188 -2973 -1001 -1731 C ATOM 461 C HIS A 57 30.593 -16.572 -0.627 1.00141.79 C ANISOU 461 C HIS A 57 16188 23264 14424 -3484 -1424 -1711 C ATOM 462 O HIS A 57 30.721 -17.668 -1.177 1.00142.37 O ANISOU 462 O HIS A 57 15821 24119 14154 -3910 -1341 -2260 O ATOM 463 CB HIS A 57 28.553 -15.163 -0.856 1.00152.58 C ANISOU 463 CB HIS A 57 16579 24477 16917 -2799 -1675 -1051 C ATOM 464 CG HIS A 57 29.068 -13.773 -0.734 1.00154.49 C ANISOU 464 CG HIS A 57 17351 24269 17077 -2526 -2199 -174 C ATOM 465 ND1 HIS A 57 29.733 -13.319 0.413 1.00141.91 N ANISOU 465 ND1 HIS A 57 16888 21508 15523 -2264 -1902 -26 N ATOM 466 CD2 HIS A 57 29.062 -12.726 -1.576 1.00150.17 C ANISOU 466 CD2 HIS A 57 16411 24242 16405 -2469 -2992 604 C ATOM 467 CE1 HIS A 57 30.084 -12.074 0.243 1.00143.33 C ANISOU 467 CE1 HIS A 57 17306 21541 15611 -2065 -2496 797 C ATOM 468 NE2 HIS A 57 29.686 -11.671 -0.960 1.00148.38 N ANISOU 468 NE2 HIS A 57 17035 23191 16150 -2182 -3171 1206 N ATOM 469 N ARG A 58 31.575 -15.683 -0.550 1.00142.81 N ANISOU 469 N ARG A 58 16980 23109 14172 -3436 -1874 -1076 N ATOM 470 CA ARG A 58 32.830 -15.911 -1.243 1.00147.77 C ANISOU 470 CA ARG A 58 17762 24445 13939 -3900 -2366 -946 C ATOM 471 C ARG A 58 33.760 -16.852 -0.503 1.00140.01 C ANISOU 471 C ARG A 58 17593 23019 12585 -4134 -1827 -1547 C ATOM 472 O ARG A 58 34.883 -16.484 -0.180 1.00133.14 O ANISOU 472 O ARG A 58 17543 21766 11280 -4182 -1993 -1259 O ATOM 473 CB ARG A 58 33.529 -14.594 -1.560 1.00149.50 C ANISOU 473 CB ARG A 58 18306 24633 13863 -3786 -3114 -12 C ATOM 474 CG ARG A 58 33.666 -13.623 -0.427 1.00136.10 C ANISOU 474 CG ARG A 58 17534 21644 12533 -3300 -2914 385 C ATOM 475 CD ARG A 58 33.926 -12.243 -1.018 1.00138.69 C ANISOU 475 CD ARG A 58 17800 22176 12720 -3152 -3746 1360 C ATOM 476 NE ARG A 58 34.726 -11.423 -0.118 1.00133.30 N ANISOU 476 NE ARG A 58 18201 20457 11990 -2885 -3733 1784 N ATOM 477 CZ ARG A 58 34.887 -10.108 -0.229 1.00138.85 C ANISOU 477 CZ ARG A 58 19089 20933 12734 -2618 -4288 2620 C ATOM 478 NH1 ARG A 58 34.299 -9.438 -1.207 1.00136.51 N ANISOU 478 NH1 ARG A 58 17966 21375 12525 -2578 -4908 3138 N ATOM 479 NH2 ARG A 58 35.638 -9.462 0.649 1.00151.19 N ANISOU 479 NH2 ARG A 58 21673 21519 14254 -2385 -4220 2937 N ATOM 480 N VAL A 59 33.285 -18.069 -0.257 1.00137.88 N ANISOU 480 N VAL A 59 17078 22823 12487 -4284 -1189 -2383 N ATOM 481 CA VAL A 59 34.027 -19.073 0.487 1.00122.85 C ANISOU 481 CA VAL A 59 15892 20489 10298 -4496 -591 -3048 C ATOM 482 C VAL A 59 33.530 -20.418 0.028 1.00132.40 C ANISOU 482 C VAL A 59 16375 22458 11474 -4843 -265 -3833 C ATOM 483 O VAL A 59 32.320 -20.602 -0.088 1.00158.71 O ANISOU 483 O VAL A 59 18995 25930 15379 -4683 -44 -4055 O ATOM 484 CB VAL A 59 33.702 -18.982 1.969 1.00116.26 C ANISOU 484 CB VAL A 59 15860 18252 10063 -4047 190 -3301 C ATOM 485 CG1 VAL A 59 34.708 -19.781 2.775 1.00104.15 C ANISOU 485 CG1 VAL A 59 15247 16178 8147 -4239 703 -3830 C ATOM 486 CG2 VAL A 59 33.675 -17.537 2.404 1.00113.56 C ANISOU 486 CG2 VAL A 59 15977 17142 10028 -3575 -97 -2507 C ATOM 487 N ILE A 60 34.433 -21.363 -0.227 1.00121.35 N ANISOU 487 N ILE A 60 19942 14796 11369 5279 -259 -516 N ATOM 488 CA ILE A 60 34.005 -22.650 -0.780 1.00122.57 C ANISOU 488 CA ILE A 60 19327 14940 12303 4768 594 -1010 C ATOM 489 C ILE A 60 34.795 -23.862 -0.313 1.00126.46 C ANISOU 489 C ILE A 60 19623 14808 13618 4112 1451 -224 C ATOM 490 O ILE A 60 35.707 -23.759 0.517 1.00131.41 O ANISOU 490 O ILE A 60 20702 14982 14245 4024 1430 759 O ATOM 491 CB ILE A 60 34.056 -22.655 -2.318 1.00131.66 C ANISOU 491 CB ILE A 60 20397 16073 13557 4791 394 -1589 C ATOM 492 CG1 ILE A 60 35.513 -22.720 -2.787 1.00149.61 C ANISOU 492 CG1 ILE A 60 23172 17592 16082 4581 287 -729 C ATOM 493 CG2 ILE A 60 33.330 -21.453 -2.873 1.00119.99 C ANISOU 493 CG2 ILE A 60 19132 15185 11273 5437 -471 -2367 C ATOM 494 CD1 ILE A 60 35.716 -22.317 -4.218 1.00160.77 C ANISOU 494 CD1 ILE A 60 24748 18979 17357 4767 -193 -1167 C ATOM 495 N ASN A 61 34.409 -25.015 -0.857 1.00122.83 N ANISOU 495 N ASN A 61 18471 14341 13856 3656 2208 -686 N ATOM 496 CA ASN A 61 35.086 -26.265 -0.580 1.00138.24 C ANISOU 496 CA ASN A 61 20155 15721 16649 3002 3073 -56 C ATOM 497 C ASN A 61 36.309 -26.397 -1.479 1.00143.06 C ANISOU 497 C ASN A 61 21121 15689 17547 2802 2970 466 C ATOM 498 O ASN A 61 36.341 -25.842 -2.568 1.00117.19 O ANISOU 498 O ASN A 61 18027 12501 13997 3069 2438 40 O ATOM 499 CB ASN A 61 34.128 -27.446 -0.763 1.00145.93 C ANISOU 499 CB ASN A 61 20227 16973 18245 2599 3934 -784 C ATOM 500 CG ASN A 61 33.449 -27.440 -2.117 1.00148.45 C ANISOU 500 CG ASN A 61 20198 17648 18559 2718 3794 -1811 C ATOM 501 OD1 ASN A 61 32.460 -28.131 -2.331 1.00151.47 O ANISOU 501 OD1 ASN A 61 19880 18413 19260 2540 4310 -2588 O ATOM 502 ND2 ASN A 61 33.984 -26.662 -3.035 1.00125.32 N ANISOU 502 ND2 ASN A 61 17755 14590 15271 3017 3097 -1815 N ATOM 503 N SER A 62 37.316 -27.122 -1.010 1.00135.58 N ANISOU 503 N SER A 62 20276 14096 17142 2338 3473 1394 N ATOM 504 CA SER A 62 38.543 -27.307 -1.761 1.00136.42 C ANISOU 504 CA SER A 62 20726 13548 17559 2111 3425 1981 C ATOM 505 C SER A 62 38.270 -27.764 -3.189 1.00137.53 C ANISOU 505 C SER A 62 20467 13754 18035 1971 3572 1231 C ATOM 506 O SER A 62 39.147 -27.660 -4.048 1.00138.48 O ANISOU 506 O SER A 62 20915 13449 18250 1923 3331 1516 O ATOM 507 CB SER A 62 39.437 -28.318 -1.050 1.00143.81 C ANISOU 507 CB SER A 62 21613 13844 19184 1529 4166 2932 C ATOM 508 OG SER A 62 38.639 -29.283 -0.387 1.00148.49 O ANISOU 508 OG SER A 62 21521 14667 20231 1186 4977 2648 O ATOM 509 N ARG A 63 37.062 -28.256 -3.458 1.00133.03 N ANISOU 509 N ARG A 63 19197 13712 17636 1913 3956 272 N ATOM 510 CA ARG A 63 36.706 -28.660 -4.820 1.00126.79 C ANISOU 510 CA ARG A 63 18004 13038 17134 1808 4079 -513 C ATOM 511 C ARG A 63 36.483 -27.482 -5.767 1.00124.25 C ANISOU 511 C ARG A 63 18049 13042 16117 2387 3149 -1084 C ATOM 512 O ARG A 63 36.274 -27.662 -6.967 1.00117.83 O ANISOU 512 O ARG A 63 16999 12307 15463 2362 3130 -1706 O ATOM 513 CB ARG A 63 35.468 -29.539 -4.787 1.00136.25 C ANISOU 513 CB ARG A 63 18340 14708 18720 1573 4774 -1364 C ATOM 514 CG ARG A 63 35.776 -30.930 -4.289 1.00156.15 C ANISOU 514 CG ARG A 63 20405 16822 22102 899 5788 -905 C ATOM 515 CD ARG A 63 34.543 -31.635 -3.733 1.00173.68 C ANISOU 515 CD ARG A 63 21876 19542 24571 729 6431 -1550 C ATOM 516 NE ARG A 63 33.431 -31.692 -4.688 1.00182.98 N ANISOU 516 NE ARG A 63 22535 21281 25710 868 6415 -2726 N ATOM 517 CZ ARG A 63 32.271 -32.285 -4.405 1.00180.98 C ANISOU 517 CZ ARG A 63 21591 21511 25663 745 6939 -3431 C ATOM 518 NH1 ARG A 63 32.109 -32.855 -3.205 1.00180.95 N ANISOU 518 NH1 ARG A 63 21355 21482 25916 482 7507 -3054 N ATOM 519 NH2 ARG A 63 31.280 -32.315 -5.298 1.00183.51 N ANISOU 519 NH2 ARG A 63 21454 22334 25937 880 6904 -4497 N ATOM 520 N GLY A 64 36.545 -26.275 -5.229 1.00115.89 N ANISOU 520 N GLY A 64 17579 12166 14288 2907 2377 -861 N ATOM 521 CA GLY A 64 36.195 -25.114 -6.010 1.00114.94 C ANISOU 521 CA GLY A 64 17782 12434 13455 3491 1489 -1458 C ATOM 522 C GLY A 64 34.769 -25.189 -6.533 1.00124.13 C ANISOU 522 C GLY A 64 18329 14314 14521 3656 1562 -2689 C ATOM 523 O GLY A 64 34.535 -24.994 -7.727 1.00118.99 O ANISOU 523 O GLY A 64 17597 13820 13794 3803 1285 -3340 O ATOM 524 N THR A 65 33.824 -25.492 -5.643 1.00129.99 N ANISOU 524 N THR A 65 18629 15482 15278 3622 1950 -3005 N ATOM 525 CA THR A 65 32.395 -25.396 -5.937 1.00129.66 C ANISOU 525 CA THR A 65 18058 16188 15018 3858 1934 -4153 C ATOM 526 C THR A 65 31.607 -24.947 -4.705 1.00134.37 C ANISOU 526 C THR A 65 18628 17266 15163 4133 1833 -4240 C ATOM 527 O THR A 65 32.091 -25.003 -3.571 1.00128.98 O ANISOU 527 O THR A 65 18181 16321 14505 4020 1990 -3437 O ATOM 528 CB THR A 65 31.814 -26.734 -6.452 1.00134.78 C ANISOU 528 CB THR A 65 17860 16895 16456 3345 2834 -4738 C ATOM 529 OG1 THR A 65 31.598 -27.642 -5.360 1.00132.88 O ANISOU 529 OG1 THR A 65 17207 16598 16683 2939 3624 -4430 O ATOM 530 CG2 THR A 65 32.765 -27.366 -7.441 1.00127.90 C ANISOU 530 CG2 THR A 65 17016 15426 16154 2962 3083 -4429 C ATOM 531 N ILE A 66 30.384 -24.495 -4.935 1.00134.06 N ANISOU 531 N ILE A 66 16735 19658 14543 -5284 1454 -1760 N ATOM 532 CA ILE A 66 29.456 -24.252 -3.842 1.00148.26 C ANISOU 532 CA ILE A 66 18613 21123 16595 -5247 2051 -1493 C ATOM 533 C ILE A 66 29.121 -25.578 -3.169 1.00153.01 C ANISOU 533 C ILE A 66 19257 21685 17197 -5446 1755 -1575 C ATOM 534 O ILE A 66 28.501 -26.447 -3.792 1.00151.08 O ANISOU 534 O ILE A 66 18592 21687 17124 -5476 1311 -1398 O ATOM 535 CB ILE A 66 28.154 -23.632 -4.357 1.00153.54 C ANISOU 535 CB ILE A 66 18775 21839 17726 -5024 2387 -920 C ATOM 536 CG1 ILE A 66 28.413 -22.223 -4.870 1.00151.40 C ANISOU 536 CG1 ILE A 66 18494 21554 17478 -4818 2777 -814 C ATOM 537 CG2 ILE A 66 27.139 -23.570 -3.258 1.00168.68 C ANISOU 537 CG2 ILE A 66 20738 23442 19911 -5005 2923 -644 C ATOM 538 CD1 ILE A 66 27.140 -21.481 -5.159 1.00156.88 C ANISOU 538 CD1 ILE A 66 18766 22221 18620 -4595 3226 -259 C ATOM 539 N SER A 67 29.527 -25.755 -1.913 1.00127.14 N ANISOU 539 N SER A 67 16478 18102 13727 -5584 1988 -1842 N ATOM 540 CA SER A 67 29.219 -27.007 -1.215 1.00135.93 C ANISOU 540 CA SER A 67 17653 19162 14835 -5778 1725 -1925 C ATOM 541 C SER A 67 27.706 -27.211 -1.227 1.00140.24 C ANISOU 541 C SER A 67 17739 19707 15839 -5686 1903 -1406 C ATOM 542 O SER A 67 26.966 -26.236 -1.336 1.00132.87 O ANISOU 542 O SER A 67 16606 18687 15193 -5485 2412 -1028 O ATOM 543 CB SER A 67 29.757 -26.992 0.217 1.00130.99 C ANISOU 543 CB SER A 67 17626 18167 13978 -5910 2070 -2233 C ATOM 544 OG SER A 67 31.175 -26.943 0.244 1.00130.55 O ANISOU 544 OG SER A 67 17999 18122 13483 -6016 1849 -2738 O ATOM 545 N LYS A 68 27.243 -28.459 -1.128 1.00153.13 N ANISOU 545 N LYS A 68 19202 21439 17542 -5829 1488 -1383 N ATOM 546 CA LYS A 68 25.799 -28.745 -1.211 1.00158.36 C ANISOU 546 CA LYS A 68 19399 22130 18640 -5750 1598 -892 C ATOM 547 C LYS A 68 24.989 -28.000 -0.140 1.00160.72 C ANISOU 547 C LYS A 68 19829 22059 19178 -5653 2378 -610 C ATOM 548 O LYS A 68 24.007 -27.310 -0.457 1.00168.69 O ANISOU 548 O LYS A 68 20489 23065 20542 -5458 2747 -162 O ATOM 549 CB LYS A 68 25.521 -30.261 -1.128 1.00155.42 C ANISOU 549 CB LYS A 68 18891 21891 18269 -5944 1031 -962 C ATOM 550 CG LYS A 68 24.034 -30.652 -1.132 1.00157.00 C ANISOU 550 CG LYS A 68 18634 22111 18909 -5881 1129 -474 C ATOM 551 CD LYS A 68 23.299 -30.018 -2.313 1.00153.05 C ANISOU 551 CD LYS A 68 17587 21841 18725 -5655 1173 -53 C ATOM 552 CE LYS A 68 22.002 -30.767 -2.607 1.00154.58 C ANISOU 552 CE LYS A 68 17271 22170 19294 -5636 999 350 C ATOM 553 NZ LYS A 68 21.237 -30.275 -3.792 1.00141.83 N ANISOU 553 NZ LYS A 68 15091 20801 17996 -5425 988 765 N ATOM 554 N ARG A 69 25.424 -28.152 1.116 1.00155.33 N ANISOU 554 N ARG A 69 19650 21073 18294 -5790 2615 -881 N ATOM 555 CA ARG A 69 24.745 -27.607 2.304 1.00153.51 C ANISOU 555 CA ARG A 69 19609 20469 18246 -5737 3321 -676 C ATOM 556 C ARG A 69 23.323 -28.142 2.467 1.00142.54 C ANISOU 556 C ARG A 69 17826 19077 17257 -5712 3395 -239 C ATOM 557 O ARG A 69 22.493 -27.535 3.155 1.00143.81 O ANISOU 557 O ARG A 69 17982 18988 17672 -5607 4002 65 O ATOM 558 CB ARG A 69 24.754 -26.075 2.307 1.00157.83 C ANISOU 558 CB ARG A 69 20238 20855 18875 -5522 3963 -518 C ATOM 559 CG ARG A 69 23.474 -25.437 1.826 1.00153.91 C ANISOU 559 CG ARG A 69 19252 20398 18827 -5302 4310 42 C ATOM 560 CD ARG A 69 23.745 -24.409 0.760 1.00154.97 C ANISOU 560 CD ARG A 69 19195 20701 18986 -5111 4373 140 C ATOM 561 NE ARG A 69 24.765 -23.450 1.165 1.00147.75 N ANISOU 561 NE ARG A 69 18751 19594 17795 -5083 4716 -152 N ATOM 562 CZ ARG A 69 25.940 -23.323 0.561 1.00146.95 C ANISOU 562 CZ ARG A 69 18816 19650 17368 -5120 4383 -506 C ATOM 563 NH1 ARG A 69 26.236 -24.102 -0.468 1.00155.17 N ANISOU 563 NH1 ARG A 69 19591 21046 18321 -5186 3696 -610 N ATOM 564 NH2 ARG A 69 26.816 -22.420 0.985 1.00147.17 N ANISOU 564 NH2 ARG A 69 19275 19482 17160 -5089 4734 -755 N ATOM 565 N ASP A 70 23.086 -29.299 1.846 1.00154.36 N ANISOU 565 N ASP A 70 19005 20851 18795 -5816 2764 -227 N ATOM 566 CA ASP A 70 21.764 -29.916 1.732 1.00181.41 C ANISOU 566 CA ASP A 70 21975 24353 22599 -5792 2703 187 C ATOM 567 C ASP A 70 20.602 -28.968 2.063 1.00196.79 C ANISOU 567 C ASP A 70 23732 26104 24936 -5591 3406 672 C ATOM 568 O ASP A 70 19.846 -28.535 1.169 1.00215.06 O ANISOU 568 O ASP A 70 25575 28593 27546 -5411 3454 1053 O ATOM 569 CB ASP A 70 21.662 -31.226 2.554 1.00187.01 C ANISOU 569 CB ASP A 70 22837 24986 23232 -6024 2415 24 C ATOM 570 CG ASP A 70 22.138 -31.079 4.023 1.00177.19 C ANISOU 570 CG ASP A 70 22188 23357 21779 -6136 2835 -244 C ATOM 571 OD1 ASP A 70 23.331 -31.363 4.290 1.00189.40 O ANISOU 571 OD1 ASP A 70 24153 24879 22933 -6286 2585 -720 O ATOM 572 OD2 ASP A 70 21.311 -30.730 4.909 1.00164.85 O ANISOU 572 OD2 ASP A 70 20667 21524 20444 -6081 3393 18 O ATOM 573 N ILE A 71 20.459 -28.658 3.353 1.00158.26 N ANISOU 573 N ILE A 71 23038 17679 19414 -642 -896 -5229 N ATOM 574 CA ILE A 71 19.379 -27.800 3.810 1.00143.24 C ANISOU 574 CA ILE A 71 20592 16078 17754 -624 -761 -4897 C ATOM 575 C ILE A 71 19.649 -26.339 3.471 1.00136.74 C ANISOU 575 C ILE A 71 19270 15520 17165 -143 -761 -4571 C ATOM 576 O ILE A 71 20.277 -25.622 4.243 1.00134.95 O ANISOU 576 O ILE A 71 19128 14962 17186 296 -624 -4490 O ATOM 577 CB ILE A 71 19.178 -27.954 5.311 1.00133.16 C ANISOU 577 CB ILE A 71 19601 14330 16665 -601 -525 -4936 C ATOM 578 CG1 ILE A 71 20.541 -27.928 6.011 1.00149.45 C ANISOU 578 CG1 ILE A 71 22207 15758 18819 -184 -451 -5109 C ATOM 579 CG2 ILE A 71 18.427 -29.237 5.593 1.00123.61 C ANISOU 579 CG2 ILE A 71 18676 13041 15251 -1160 -512 -5159 C ATOM 580 CD1 ILE A 71 20.474 -27.982 7.555 1.00159.67 C ANISOU 580 CD1 ILE A 71 23803 16544 20321 -93 -209 -5141 C ATOM 581 N SER A 72 19.173 -25.918 2.300 1.00126.80 N ANISOU 581 N SER A 72 17494 14862 15821 -233 -919 -4388 N ATOM 582 CA SER A 72 19.262 -24.524 1.867 1.00127.23 C ANISOU 582 CA SER A 72 17006 15251 16082 173 -935 -4052 C ATOM 583 C SER A 72 18.903 -24.255 0.395 1.00132.45 C ANISOU 583 C SER A 72 17192 16555 16579 42 -1153 -3911 C ATOM 584 O SER A 72 18.597 -25.165 -0.384 1.00124.31 O ANISOU 584 O SER A 72 16239 15738 15257 -372 -1306 -4080 O ATOM 585 CB SER A 72 20.648 -23.960 2.173 1.00127.54 C ANISOU 585 CB SER A 72 17329 14867 16263 716 -888 -4093 C ATOM 586 OG SER A 72 20.901 -22.785 1.425 1.00136.18 O ANISOU 586 OG SER A 72 17954 16317 17472 1069 -962 -3823 O ATOM 587 N ALA A 73 18.935 -22.972 0.052 1.00137.70 N ANISOU 587 N ALA A 73 17360 17519 17441 407 -1159 -3594 N ATOM 588 CA ALA A 73 18.794 -22.489 -1.310 1.00137.72 C ANISOU 588 CA ALA A 73 16906 18091 17329 404 -1357 -3428 C ATOM 589 C ALA A 73 19.449 -21.126 -1.326 1.00125.89 C ANISOU 589 C ALA A 73 15139 16608 16085 972 -1315 -3172 C ATOM 590 O ALA A 73 19.097 -20.258 -2.121 1.00118.96 O ANISOU 590 O ALA A 73 13717 16227 15257 1080 -1407 -2896 O ATOM 591 CB ALA A 73 17.348 -22.378 -1.710 1.00147.86 C ANISOU 591 CB ALA A 73 17635 19952 18592 49 -1400 -3219 C ATOM 592 N GLY A 74 20.382 -20.932 -0.403 1.00118.63 N ANISOU 592 N GLY A 74 14602 15136 15337 1339 -1170 -3263 N ATOM 593 CA GLY A 74 21.198 -19.733 -0.389 1.00118.05 C ANISOU 593 CA GLY A 74 14367 14995 15491 1900 -1127 -3073 C ATOM 594 C GLY A 74 22.411 -19.983 -1.260 1.00126.15 C ANISOU 594 C GLY A 74 15696 15919 16316 2045 -1285 -3270 C ATOM 595 O GLY A 74 23.180 -19.076 -1.582 1.00121.50 O ANISOU 595 O GLY A 74 14974 15344 15844 2474 -1303 -3141 O ATOM 596 N GLU A 75 22.585 -21.246 -1.622 1.00131.92 N ANISOU 596 N GLU A 75 16848 16533 16742 1678 -1397 -3596 N ATOM 597 CA GLU A 75 23.571 -21.634 -2.609 1.00144.49 C ANISOU 597 CA GLU A 75 18695 18110 18093 1714 -1578 -3801 C ATOM 598 C GLU A 75 23.466 -20.657 -3.788 1.00150.83 C ANISOU 598 C GLU A 75 18929 19483 18897 1870 -1719 -3518 C ATOM 599 O GLU A 75 24.432 -20.395 -4.518 1.00109.34 O ANISOU 599 O GLU A 75 13750 14228 13564 2112 -1827 -3569 O ATOM 600 CB GLU A 75 23.267 -23.068 -3.042 1.00157.34 C ANISOU 600 CB GLU A 75 20640 19760 19381 1173 -1705 -4106 C ATOM 601 CG GLU A 75 22.011 -23.661 -2.367 1.00167.45 C ANISOU 601 CG GLU A 75 21864 21094 20667 750 -1610 -4099 C ATOM 602 CD GLU A 75 21.767 -25.128 -2.739 1.00173.47 C ANISOU 602 CD GLU A 75 22984 21834 21094 220 -1726 -4422 C ATOM 603 OE1 GLU A 75 22.583 -25.682 -3.515 1.00169.44 O ANISOU 603 OE1 GLU A 75 22765 21264 20351 184 -1882 -4652 O ATOM 604 OE2 GLU A 75 20.769 -25.717 -2.249 1.00177.04 O ANISOU 604 OE2 GLU A 75 23423 22324 21519 -159 -1658 -4448 O ATOM 605 N GLN A 76 22.269 -20.103 -3.940 1.00147.47 N ANISOU 605 N GLN A 76 17927 19538 18565 1733 -1712 -3217 N ATOM 606 CA GLN A 76 21.998 -19.155 -5.007 1.00138.74 C ANISOU 606 CA GLN A 76 16238 19006 17472 1853 -1840 -2919 C ATOM 607 C GLN A 76 22.443 -17.747 -4.617 1.00124.33 C ANISOU 607 C GLN A 76 14143 17120 15977 2415 -1723 -2637 C ATOM 608 O GLN A 76 23.101 -17.052 -5.411 1.00120.72 O ANISOU 608 O GLN A 76 13521 16833 15514 2704 -1820 -2531 O ATOM 609 CB GLN A 76 20.508 -19.160 -5.388 1.00141.16 C ANISOU 609 CB GLN A 76 16027 19875 17734 1462 -1896 -2717 C ATOM 610 CG GLN A 76 20.175 -18.305 -6.618 1.00144.52 C ANISOU 610 CG GLN A 76 15857 20929 18125 1529 -2060 -2429 C ATOM 611 CD GLN A 76 20.638 -18.955 -7.923 1.00155.87 C ANISOU 611 CD GLN A 76 17431 22578 19213 1325 -2293 -2617 C ATOM 612 OE1 GLN A 76 20.821 -18.285 -8.951 1.00159.91 O ANISOU 612 OE1 GLN A 76 17607 23474 19676 1473 -2432 -2445 O ATOM 613 NE2 GLN A 76 20.815 -20.270 -7.887 1.00160.74 N ANISOU 613 NE2 GLN A 76 18542 22948 19585 977 -2337 -2972 N ATOM 614 N ARG A 77 22.064 -17.316 -3.415 1.00141.48 N ANISOU 614 N ARG A 77 17068 22325 14362 -384 -832 299 N ATOM 615 CA ARG A 77 22.519 -16.020 -2.934 1.00145.79 C ANISOU 615 CA ARG A 77 18028 22635 14730 90 -148 -451 C ATOM 616 C ARG A 77 24.033 -15.953 -3.061 1.00136.91 C ANISOU 616 C ARG A 77 17507 20790 13724 -201 -274 -1348 C ATOM 617 O ARG A 77 24.590 -14.930 -3.445 1.00135.81 O ANISOU 617 O ARG A 77 17852 20070 13682 70 122 -2003 O ATOM 618 CB ARG A 77 22.085 -15.778 -1.488 1.00164.61 C ANISOU 618 CB ARG A 77 20144 25746 16653 401 247 -377 C ATOM 619 CG ARG A 77 20.818 -14.916 -1.356 1.00175.03 C ANISOU 619 CG ARG A 77 21165 27518 17820 1022 813 55 C ATOM 620 CD ARG A 77 20.447 -14.679 0.110 1.00173.43 C ANISOU 620 CD ARG A 77 20717 28026 17154 1327 1201 98 C ATOM 621 NE ARG A 77 20.259 -15.932 0.853 1.00177.56 N ANISOU 621 NE ARG A 77 20801 29151 17512 921 720 595 N ATOM 622 CZ ARG A 77 20.226 -16.056 2.182 1.00191.71 C ANISOU 622 CZ ARG A 77 22411 31511 18921 1002 877 574 C ATOM 623 NH1 ARG A 77 20.369 -14.999 2.978 1.00194.07 N ANISOU 623 NH1 ARG A 77 22921 31875 18941 1484 1513 75 N ATOM 624 NH2 ARG A 77 20.050 -17.262 2.714 1.00198.82 N ANISOU 624 NH2 ARG A 77 22911 32915 19716 593 385 1059 N ATOM 625 N GLN A 78 24.685 -17.067 -2.748 1.00134.09 N ANISOU 625 N GLN A 78 17112 20477 13359 -760 -839 -1363 N ATOM 626 CA GLN A 78 26.125 -17.186 -2.887 1.00129.28 C ANISOU 626 CA GLN A 78 17038 19208 12873 -1113 -1054 -2152 C ATOM 627 C GLN A 78 26.487 -16.997 -4.360 1.00125.06 C ANISOU 627 C GLN A 78 16844 17892 12782 -1230 -1233 -2324 C ATOM 628 O GLN A 78 27.397 -16.230 -4.692 1.00127.29 O ANISOU 628 O GLN A 78 17678 17507 13180 -1130 -986 -3095 O ATOM 629 CB GLN A 78 26.583 -18.558 -2.391 1.00127.06 C ANISOU 629 CB GLN A 78 16572 19179 12526 -1723 -1702 -1981 C ATOM 630 CG GLN A 78 28.005 -18.596 -1.849 1.00131.81 C ANISOU 630 CG GLN A 78 17649 19385 13046 -1982 -1763 -2840 C ATOM 631 CD GLN A 78 28.341 -19.923 -1.195 1.00142.84 C ANISOU 631 CD GLN A 78 18812 21142 14317 -2536 -2352 -2631 C ATOM 632 OE1 GLN A 78 27.454 -20.715 -0.871 1.00150.97 O ANISOU 632 OE1 GLN A 78 19294 22832 15235 -2652 -2614 -1863 O ATOM 633 NE2 GLN A 78 29.626 -20.173 -1.000 1.00118.70 N ANISOU 633 NE2 GLN A 78 16171 17651 11278 -2883 -2564 -3315 N ATOM 634 N LYS A 79 25.772 -17.676 -5.252 1.00124.16 N ANISOU 634 N LYS A 79 16405 17852 12919 -1431 -1653 -1608 N ATOM 635 CA LYS A 79 26.048 -17.477 -6.657 1.00132.41 C ANISOU 635 CA LYS A 79 17754 18173 14384 -1514 -1808 -1738 C ATOM 636 C LYS A 79 25.794 -16.028 -7.008 1.00138.68 C ANISOU 636 C LYS A 79 18816 18669 15207 -903 -1112 -2074 C ATOM 637 O LYS A 79 26.716 -15.291 -7.372 1.00134.17 O ANISOU 637 O LYS A 79 18797 17419 14761 -820 -885 -2839 O ATOM 638 CB LYS A 79 25.168 -18.352 -7.545 1.00140.56 C ANISOU 638 CB LYS A 79 18357 19382 15668 -1754 -2316 -858 C ATOM 639 CG LYS A 79 25.449 -18.165 -9.067 1.00137.80 C ANISOU 639 CG LYS A 79 18328 18255 15774 -1844 -2496 -978 C ATOM 640 CD LYS A 79 24.180 -18.329 -9.911 1.00136.48 C ANISOU 640 CD LYS A 79 17742 18313 15802 -1710 -2603 -128 C ATOM 641 CE LYS A 79 24.375 -17.877 -11.359 1.00131.18 C ANISOU 641 CE LYS A 79 17413 16878 15552 -1664 -2628 -300 C ATOM 642 NZ LYS A 79 23.086 -17.746 -12.114 1.00125.01 N ANISOU 642 NZ LYS A 79 16264 16306 14927 -1399 -2568 446 N ATOM 643 N ASP A 80 24.535 -15.619 -6.916 1.00153.29 N ANISOU 643 N ASP A 80 20273 21026 16945 -476 -776 -1496 N ATOM 644 CA ASP A 80 24.160 -14.305 -7.415 1.00153.93 C ANISOU 644 CA ASP A 80 20566 20829 17092 94 -163 -1708 C ATOM 645 C ASP A 80 24.952 -13.179 -6.777 1.00143.88 C ANISOU 645 C ASP A 80 19774 19271 15622 437 429 -2603 C ATOM 646 O ASP A 80 24.789 -12.010 -7.142 1.00131.16 O ANISOU 646 O ASP A 80 18409 17374 14053 913 968 -2896 O ATOM 647 CB ASP A 80 22.657 -14.091 -7.299 1.00163.69 C ANISOU 647 CB ASP A 80 21272 22722 18199 493 100 -925 C ATOM 648 CG ASP A 80 21.893 -14.961 -8.271 1.00161.94 C ANISOU 648 CG ASP A 80 20677 22586 18269 225 -423 -113 C ATOM 649 OD1 ASP A 80 22.236 -14.939 -9.488 1.00159.05 O ANISOU 649 OD1 ASP A 80 20584 21567 18282 76 -639 -240 O ATOM 650 OD2 ASP A 80 20.986 -15.689 -7.806 1.00165.55 O ANISOU 650 OD2 ASP A 80 20572 23753 18574 150 -631 638 O ATOM 651 N ARG A 81 25.826 -13.549 -5.842 1.00142.72 N ANISOU 651 N ARG A 81 19768 19192 15268 183 312 -3040 N ATOM 652 CA ARG A 81 26.710 -12.598 -5.174 1.00146.31 C ANISOU 652 CA ARG A 81 20696 19361 15535 443 810 -3926 C ATOM 653 C ARG A 81 27.953 -12.328 -6.020 1.00154.01 C ANISOU 653 C ARG A 81 22291 19407 16820 232 696 -4680 C ATOM 654 O ARG A 81 28.350 -11.185 -6.207 1.00169.53 O ANISOU 654 O ARG A 81 24684 20918 18814 599 1197 -5294 O ATOM 655 CB ARG A 81 27.092 -13.097 -3.766 1.00139.17 C ANISOU 655 CB ARG A 81 19670 18945 14263 280 750 -4070 C ATOM 656 CG ARG A 81 26.079 -12.737 -2.658 1.00151.98 C ANISOU 656 CG ARG A 81 20872 21389 15485 727 1196 -3681 C ATOM 657 CD ARG A 81 26.307 -11.320 -2.114 1.00157.52 C ANISOU 657 CD ARG A 81 21923 21954 15974 1306 1958 -4338 C ATOM 658 NE ARG A 81 25.264 -10.828 -1.194 1.00154.87 N ANISOU 658 NE ARG A 81 21209 22356 15279 1802 2439 -3962 N ATOM 659 CZ ARG A 81 25.443 -10.579 0.104 1.00151.47 C ANISOU 659 CZ ARG A 81 20765 22317 14469 1988 2747 -4234 C ATOM 660 NH1 ARG A 81 26.625 -10.787 0.669 1.00145.09 N ANISOU 660 NH1 ARG A 81 20296 21248 13585 1717 2624 -4888 N ATOM 661 NH2 ARG A 81 24.431 -10.129 0.837 1.00152.93 N ANISOU 661 NH2 ARG A 81 20595 23160 14352 2448 3174 -3846 N ATOM 662 N LEU A 82 28.562 -13.378 -6.549 1.00172.29 N ANISOU 662 N LEU A 82 24552 17061 23850 1740 437 561 N ATOM 663 CA LEU A 82 29.847 -13.196 -7.204 1.00163.33 C ANISOU 663 CA LEU A 82 24247 15976 21835 1116 150 48 C ATOM 664 C LEU A 82 29.761 -12.920 -8.696 1.00153.50 C ANISOU 664 C LEU A 82 23162 14741 20420 1014 -641 -101 C ATOM 665 O LEU A 82 30.688 -12.350 -9.275 1.00142.24 O ANISOU 665 O LEU A 82 22636 13264 18145 657 -821 -461 O ATOM 666 CB LEU A 82 30.790 -14.356 -6.898 1.00164.39 C ANISOU 666 CB LEU A 82 24095 16383 21983 446 124 -297 C ATOM 667 CG LEU A 82 31.208 -14.435 -5.420 1.00167.23 C ANISOU 667 CG LEU A 82 24610 16703 22226 444 957 -251 C ATOM 668 CD1 LEU A 82 30.068 -14.912 -4.508 1.00164.57 C ANISOU 668 CD1 LEU A 82 23317 16374 22838 962 1334 228 C ATOM 669 CD2 LEU A 82 32.440 -15.316 -5.260 1.00166.83 C ANISOU 669 CD2 LEU A 82 24621 16886 21880 -308 914 -698 C ATOM 670 N GLU A 83 28.661 -13.321 -9.327 1.00158.08 N ANISOU 670 N GLU A 83 22878 15388 21797 1318 -1117 172 N ATOM 671 CA GLU A 83 28.435 -12.885 -10.700 1.00160.73 C ANISOU 671 CA GLU A 83 23406 15687 21978 1332 -1814 96 C ATOM 672 C GLU A 83 28.152 -11.400 -10.557 1.00160.22 C ANISOU 672 C GLU A 83 24202 15286 21387 1850 -1447 291 C ATOM 673 O GLU A 83 28.221 -10.637 -11.520 1.00163.90 O ANISOU 673 O GLU A 83 25241 15639 21396 1870 -1839 184 O ATOM 674 CB GLU A 83 27.276 -13.638 -11.369 1.00164.52 C ANISOU 674 CB GLU A 83 22750 16308 23453 1568 -2384 367 C ATOM 675 CG GLU A 83 27.707 -14.490 -12.572 1.00158.46 C ANISOU 675 CG GLU A 83 21649 15797 22761 989 -3217 19 C ATOM 676 CD GLU A 83 26.581 -15.368 -13.118 1.00163.16 C ANISOU 676 CD GLU A 83 21043 16555 24396 1195 -3742 290 C ATOM 677 OE1 GLU A 83 26.750 -15.960 -14.214 1.00157.97 O ANISOU 677 OE1 GLU A 83 20088 16081 23851 812 -4471 61 O ATOM 678 OE2 GLU A 83 25.530 -15.468 -12.445 1.00170.78 O ANISOU 678 OE2 GLU A 83 21361 17465 26065 1739 -3420 734 O ATOM 679 N GLU A 84 27.849 -11.010 -9.317 1.00154.89 N ANISOU 679 N GLU A 84 23615 14454 20780 2261 -679 576 N ATOM 680 CA GLU A 84 27.741 -9.611 -8.931 1.00157.53 C ANISOU 680 CA GLU A 84 24845 14467 20541 2714 -186 739 C ATOM 681 C GLU A 84 29.140 -9.090 -8.605 1.00154.22 C ANISOU 681 C GLU A 84 25542 13985 19071 2261 152 332 C ATOM 682 O GLU A 84 29.434 -7.913 -8.796 1.00153.04 O ANISOU 682 O GLU A 84 26364 13607 18177 2395 287 271 O ATOM 683 CB GLU A 84 26.788 -9.466 -7.738 1.00161.30 C ANISOU 683 CB GLU A 84 24892 14814 21582 3348 485 1226 C ATOM 684 CG GLU A 84 26.920 -8.157 -6.985 1.00172.67 C ANISOU 684 CG GLU A 84 27294 15943 22371 3723 1178 1350 C ATOM 685 CD GLU A 84 26.713 -8.294 -5.459 1.00189.13 C ANISOU 685 CD GLU A 84 29156 17973 24734 3997 2009 1611 C ATOM 686 OE1 GLU A 84 25.549 -8.277 -4.988 1.00197.88 O ANISOU 686 OE1 GLU A 84 29635 19002 26547 4591 2239 2068 O ATOM 687 OE2 GLU A 84 27.725 -8.416 -4.722 1.00181.54 O ANISOU 687 OE2 GLU A 84 28655 17045 23277 3613 2438 1356 O ATOM 688 N GLU A 85 29.998 -9.999 -8.135 1.00158.66 N ANISOU 688 N GLU A 85 25942 14756 19586 1715 268 51 N ATOM 689 CA GLU A 85 31.410 -9.713 -7.844 1.00165.14 C ANISOU 689 CA GLU A 85 27724 15565 19456 1192 540 -375 C ATOM 690 C GLU A 85 32.259 -9.683 -9.111 1.00174.28 C ANISOU 690 C GLU A 85 29376 16818 20022 638 -142 -829 C ATOM 691 O GLU A 85 33.469 -9.441 -9.056 1.00173.78 O ANISOU 691 O GLU A 85 30136 16757 19134 162 -20 -1219 O ATOM 692 CB GLU A 85 32.000 -10.743 -6.872 1.00157.64 C ANISOU 692 CB GLU A 85 26376 14813 18708 806 906 -505 C ATOM 693 CG GLU A 85 31.443 -10.655 -5.469 1.00161.90 C ANISOU 693 CG GLU A 85 26659 15237 19618 1274 1697 -127 C ATOM 694 CD GLU A 85 32.459 -10.165 -4.430 1.00165.20 C ANISOU 694 CD GLU A 85 27957 15544 19269 1083 2420 -307 C ATOM 695 OE1 GLU A 85 33.544 -10.779 -4.289 1.00171.58 O ANISOU 695 OE1 GLU A 85 28931 16524 19740 460 2415 -690 O ATOM 696 OE2 GLU A 85 32.161 -9.167 -3.738 1.00150.36 O ANISOU 696 OE2 GLU A 85 26595 13402 17131 1561 3002 -59 O ATOM 697 N GLY A 86 31.621 -9.938 -10.249 1.00173.41 N ANISOU 697 N GLY A 86 28757 16789 20342 699 -860 -775 N ATOM 698 CA GLY A 86 32.322 -9.996 -11.518 1.00166.51 C ANISOU 698 CA GLY A 86 28238 16023 19006 187 -1565 -1185 C ATOM 699 C GLY A 86 32.927 -11.368 -11.742 1.00148.16 C ANISOU 699 C GLY A 86 25303 14027 16963 -457 -1940 -1495 C ATOM 700 O GLY A 86 33.263 -11.733 -12.870 1.00141.37 O ANISOU 700 O GLY A 86 24388 13315 16010 -861 -2638 -1779 O ATOM 701 N VAL A 87 33.075 -12.134 -10.668 1.00131.24 N ANISOU 701 N VAL A 87 22702 12001 15162 -559 -1479 -1446 N ATOM 702 CA VAL A 87 33.496 -13.520 -10.805 1.00132.70 C ANISOU 702 CA VAL A 87 22166 12506 15748 -1111 -1816 -1684 C ATOM 703 C VAL A 87 32.552 -14.295 -11.718 1.00139.93 C ANISOU 703 C VAL A 87 22050 13586 17530 -1011 -2520 -1524 C ATOM 704 O VAL A 87 31.338 -14.353 -11.485 1.00143.88 O ANISOU 704 O VAL A 87 21851 14033 18785 -447 -2444 -1080 O ATOM 705 CB VAL A 87 33.504 -14.230 -9.461 1.00130.66 C ANISOU 705 CB VAL A 87 21408 12331 15904 -1100 -1199 -1549 C ATOM 706 CG1 VAL A 87 33.981 -15.667 -9.627 1.00128.76 C ANISOU 706 CG1 VAL A 87 20444 12425 16055 -1694 -1563 -1813 C ATOM 707 CG2 VAL A 87 34.377 -13.489 -8.485 1.00128.03 C ANISOU 707 CG2 VAL A 87 22047 11833 14766 -1171 -469 -1677 C ATOM 708 N GLU A 88 33.108 -14.914 -12.750 1.00174.45 N ANISOU 708 N GLU A 88 32789 21202 12293 5457 564 -2938 N ATOM 709 CA GLU A 88 32.258 -15.635 -13.672 1.00176.60 C ANISOU 709 CA GLU A 88 32050 22330 12720 5257 566 -2920 C ATOM 710 C GLU A 88 31.938 -17.023 -13.145 1.00190.55 C ANISOU 710 C GLU A 88 32262 24622 15514 4849 451 -2680 C ATOM 711 O GLU A 88 32.838 -17.787 -12.792 1.00154.34 O ANISOU 711 O GLU A 88 27178 19462 12003 3979 421 -2950 O ATOM 712 CB GLU A 88 32.907 -15.718 -15.042 1.00158.67 C ANISOU 712 CB GLU A 88 29934 19591 10761 4341 679 -3605 C ATOM 713 CG GLU A 88 32.035 -16.360 -16.108 1.00161.65 C ANISOU 713 CG GLU A 88 29378 20830 11211 4156 692 -3623 C ATOM 714 CD GLU A 88 32.599 -16.104 -17.479 1.00169.06 C ANISOU 714 CD GLU A 88 30796 21298 12140 3491 820 -4263 C ATOM 715 OE1 GLU A 88 33.608 -15.369 -17.536 1.00166.30 O ANISOU 715 OE1 GLU A 88 31546 19986 11656 3266 897 -4646 O ATOM 716 OE2 GLU A 88 32.055 -16.624 -18.480 1.00176.53 O ANISOU 716 OE2 GLU A 88 31042 22817 13214 3198 844 -4385 O ATOM 717 N ILE A 89 30.645 -17.334 -13.111 1.00189.20 N ANISOU 717 N ILE A 89 31339 25552 14998 5486 392 -2175 N ATOM 718 CA ILE A 89 30.160 -18.589 -12.554 1.00174.34 C ANISOU 718 CA ILE A 89 27983 24297 13960 5268 281 -1858 C ATOM 719 C ILE A 89 29.481 -19.459 -13.600 1.00164.30 C ANISOU 719 C ILE A 89 25601 23777 13051 4834 290 -1957 C ATOM 720 O ILE A 89 28.560 -19.017 -14.296 1.00164.19 O ANISOU 720 O ILE A 89 25750 24432 12203 5417 326 -1802 O ATOM 721 CB ILE A 89 29.143 -18.339 -11.435 1.00173.19 C ANISOU 721 CB ILE A 89 27739 24881 13186 6429 184 -1096 C ATOM 722 CG1 ILE A 89 29.473 -17.028 -10.710 1.00186.47 C ANISOU 722 CG1 ILE A 89 30879 26011 13961 7219 203 -945 C ATOM 723 CG2 ILE A 89 29.078 -19.547 -10.495 1.00160.54 C ANISOU 723 CG2 ILE A 89 24845 23547 12608 6115 68 -820 C ATOM 724 CD1 ILE A 89 28.330 -16.476 -9.844 1.00198.99 C ANISOU 724 CD1 ILE A 89 32644 28372 14591 8543 131 -198 C ATOM 725 N TYR A 90 29.928 -20.708 -13.680 1.00161.28 N ANISOU 725 N TYR A 90 24071 23293 13914 3821 255 -2204 N ATOM 726 CA TYR A 90 29.330 -21.667 -14.598 1.00170.17 C ANISOU 726 CA TYR A 90 24017 25119 15520 3331 253 -2299 C ATOM 727 C TYR A 90 28.601 -22.828 -13.907 1.00182.48 C ANISOU 727 C TYR A 90 24112 27476 17745 3364 137 -1844 C ATOM 728 O TYR A 90 29.185 -23.579 -13.108 1.00154.78 O ANISOU 728 O TYR A 90 20007 23630 15172 2852 77 -1847 O ATOM 729 CB TYR A 90 30.337 -22.140 -15.680 1.00191.07 C ANISOU 729 CB TYR A 90 26532 27089 18978 2065 334 -3048 C ATOM 730 CG TYR A 90 31.626 -22.805 -15.197 1.00184.95 C ANISOU 730 CG TYR A 90 25492 25405 19377 1052 317 -3418 C ATOM 731 CD1 TYR A 90 32.819 -22.079 -15.087 1.00180.77 C ANISOU 731 CD1 TYR A 90 26115 23768 18800 762 380 -3817 C ATOM 732 CD2 TYR A 90 31.660 -24.169 -14.899 1.00180.31 C ANISOU 732 CD2 TYR A 90 23495 25062 19954 358 244 -3388 C ATOM 733 CE1 TYR A 90 34.004 -22.692 -14.664 1.00173.57 C ANISOU 733 CE1 TYR A 90 24960 22023 18966 -178 366 -4166 C ATOM 734 CE2 TYR A 90 32.832 -24.789 -14.476 1.00174.82 C ANISOU 734 CE2 TYR A 90 22545 23547 20332 -577 231 -3730 C ATOM 735 CZ TYR A 90 34.002 -24.053 -14.360 1.00167.37 C ANISOU 735 CZ TYR A 90 22758 21513 19321 -846 291 -4119 C ATOM 736 OH TYR A 90 35.156 -24.680 -13.934 1.00146.57 O ANISOU 736 OH TYR A 90 19856 18076 17758 -1772 278 -4455 O ATOM 737 N GLN A 91 27.310 -22.947 -14.218 1.00183.82 N ANISOU 737 N GLN A 91 23729 28710 17405 3991 110 -1448 N ATOM 738 CA GLN A 91 26.514 -24.076 -13.754 1.00179.95 C ANISOU 738 CA GLN A 91 21788 29066 17518 4006 11 -1039 C ATOM 739 C GLN A 91 27.091 -25.337 -14.406 1.00176.84 C ANISOU 739 C GLN A 91 20286 28489 18415 2706 20 -1520 C ATOM 740 O GLN A 91 27.943 -25.225 -15.292 1.00178.83 O ANISOU 740 O GLN A 91 20959 28069 18922 1933 105 -2124 O ATOM 741 CB GLN A 91 25.028 -23.872 -14.084 1.00180.82 C ANISOU 741 CB GLN A 91 21615 30331 16758 4931 -10 -563 C ATOM 742 CG GLN A 91 24.420 -22.623 -13.455 1.00187.00 C ANISOU 742 CG GLN A 91 23484 31326 16241 6234 -18 -74 C ATOM 743 CD GLN A 91 23.018 -22.318 -13.969 1.00199.74 C ANISOU 743 CD GLN A 91 24953 34014 16926 7100 -19 315 C ATOM 744 OE1 GLN A 91 22.313 -21.447 -13.426 1.00199.96 O ANISOU 744 OE1 GLN A 91 25645 34411 15919 8218 -40 801 O ATOM 745 NE2 GLN A 91 22.605 -23.032 -15.019 1.00205.25 N ANISOU 745 NE2 GLN A 91 24782 35219 17983 6590 3 105 N ATOM 746 N THR A 92 26.657 -26.522 -13.973 1.00176.12 N ANISOU 746 N THR A 92 18807 28970 19142 2453 -63 -1263 N ATOM 747 CA THR A 92 27.320 -27.764 -14.399 1.00165.90 C ANISOU 747 CA THR A 92 16452 27414 19170 1189 -61 -1703 C ATOM 748 C THR A 92 26.380 -28.925 -14.744 1.00169.09 C ANISOU 748 C THR A 92 15331 28811 20105 995 -112 -1500 C ATOM 749 O THR A 92 25.225 -28.962 -14.299 1.00170.28 O ANISOU 749 O THR A 92 15041 29870 19786 1847 -175 -919 O ATOM 750 CB THR A 92 28.362 -28.229 -13.349 1.00149.59 C ANISOU 750 CB THR A 92 14238 24582 18016 643 -103 -1788 C ATOM 751 OG1 THR A 92 29.516 -27.389 -13.435 1.00149.23 O ANISOU 751 OG1 THR A 92 15461 23452 17790 371 -33 -2226 O ATOM 752 CG2 THR A 92 28.781 -29.680 -13.563 1.00146.20 C ANISOU 752 CG2 THR A 92 12446 24123 18980 -516 -124 -2073 C ATOM 753 N SER A 93 26.871 -29.847 -15.577 1.00166.99 N ANISOU 753 N SER A 93 22009 23102 18336 2915 858 -3553 N ATOM 754 CA SER A 93 26.219 -31.146 -15.806 1.00162.68 C ANISOU 754 CA SER A 93 21081 21833 18895 4212 812 -3449 C ATOM 755 C SER A 93 25.698 -31.708 -14.475 1.00163.86 C ANISOU 755 C SER A 93 20782 22213 19263 3882 1118 -3349 C ATOM 756 O SER A 93 26.319 -31.508 -13.424 1.00157.01 O ANISOU 756 O SER A 93 19541 22617 17500 2835 1338 -2868 O ATOM 757 CB SER A 93 27.217 -32.115 -16.452 1.00151.42 C ANISOU 757 CB SER A 93 18993 21260 17281 5047 628 -2458 C ATOM 758 OG SER A 93 28.453 -32.097 -15.738 1.00156.48 O ANISOU 758 OG SER A 93 19046 23684 16724 4175 752 -1539 O ATOM 759 N LEU A 94 24.573 -32.418 -14.528 1.00159.52 N ANISOU 759 N LEU A 94 20263 20452 19895 4779 1129 -3787 N ATOM 760 CA LEU A 94 23.804 -32.729 -13.321 1.00170.50 C ANISOU 760 CA LEU A 94 21444 21705 21632 4425 1414 -3980 C ATOM 761 C LEU A 94 24.118 -31.725 -12.196 1.00174.11 C ANISOU 761 C LEU A 94 22020 23046 21089 2835 1674 -4052 C ATOM 762 O LEU A 94 24.824 -32.037 -11.218 1.00170.80 O ANISOU 762 O LEU A 94 20955 24007 19936 2177 1866 -3301 O ATOM 763 CB LEU A 94 23.977 -34.189 -12.864 1.00169.75 C ANISOU 763 CB LEU A 94 20432 22220 21844 5121 1484 -3153 C ATOM 764 CG LEU A 94 22.843 -34.820 -12.018 1.00172.39 C ANISOU 764 CG LEU A 94 20609 21842 23049 5352 1688 -3498 C ATOM 765 CD1 LEU A 94 23.170 -36.250 -11.590 1.00167.64 C ANISOU 765 CD1 LEU A 94 19057 22004 22634 5996 1741 -2586 C ATOM 766 CD2 LEU A 94 22.452 -33.992 -10.776 1.00151.23 C ANISOU 766 CD2 LEU A 94 18160 19350 19953 4026 1991 -3941 C ATOM 767 N GLY A 95 23.593 -30.510 -12.369 1.00177.61 N ANISOU 767 N GLY A 95 23301 22673 21511 2234 1673 -4961 N ATOM 768 CA GLY A 95 23.736 -29.449 -11.390 1.00182.37 C ANISOU 768 CA GLY A 95 24147 23876 21269 756 1908 -5194 C ATOM 769 C GLY A 95 25.174 -29.051 -11.104 1.00182.91 C ANISOU 769 C GLY A 95 23868 25670 19957 -174 1934 -4373 C ATOM 770 O GLY A 95 26.114 -29.503 -11.777 1.00186.13 O ANISOU 770 O GLY A 95 23903 26796 20022 322 1745 -3646 O ATOM 771 N GLU A 96 25.325 -28.183 -10.103 1.00175.57 N ANISOU 771 N GLU A 96 23081 25383 18243 -1534 2171 -4510 N ATOM 772 CA GLU A 96 26.620 -27.717 -9.596 1.00180.66 C ANISOU 772 CA GLU A 96 23409 27714 17520 -2623 2251 -3774 C ATOM 773 C GLU A 96 27.101 -26.368 -10.179 1.00182.72 C ANISOU 773 C GLU A 96 24350 28033 17041 -3352 2121 -4135 C ATOM 774 O GLU A 96 27.144 -26.162 -11.408 1.00181.97 O ANISOU 774 O GLU A 96 24652 27269 17219 -2674 1840 -4378 O ATOM 775 CB GLU A 96 27.688 -28.807 -9.724 1.00186.38 C ANISOU 775 CB GLU A 96 23251 29679 17887 -2078 2170 -2594 C ATOM 776 CG GLU A 96 28.634 -28.884 -8.543 1.00195.84 C ANISOU 776 CG GLU A 96 23798 32613 17999 -3133 2406 -1746 C ATOM 777 CD GLU A 96 29.381 -30.206 -8.505 1.00199.57 C ANISOU 777 CD GLU A 96 23328 34085 18416 -2434 2369 -651 C ATOM 778 OE1 GLU A 96 29.339 -30.928 -9.537 1.00204.10 O ANISOU 778 OE1 GLU A 96 23804 34100 19644 -1183 2127 -518 O ATOM 779 OE2 GLU A 96 29.997 -30.521 -7.453 1.00202.98 O ANISOU 779 OE2 GLU A 96 23125 35836 18163 -3128 2581 66 O ATOM 780 N TYR A 97 27.435 -25.453 -9.266 1.00181.51 N ANISOU 780 N TYR A 97 24331 28671 15963 -4746 2333 -4180 N ATOM 781 CA TYR A 97 28.022 -24.159 -9.603 1.00177.29 C ANISOU 781 CA TYR A 97 24353 28462 14547 -5636 2250 -4406 C ATOM 782 C TYR A 97 29.524 -24.206 -9.311 1.00181.88 C ANISOU 782 C TYR A 97 24346 30898 13864 -6274 2263 -3326 C ATOM 783 O TYR A 97 29.950 -24.145 -8.167 1.00185.92 O ANISOU 783 O TYR A 97 24467 32527 13648 -7242 2513 -2893 O ATOM 784 CB TYR A 97 27.331 -23.024 -8.824 1.00178.46 C ANISOU 784 CB TYR A 97 25122 28149 14536 -6778 2471 -5260 C ATOM 785 CG TYR A 97 25.863 -22.851 -9.173 1.00189.13 C ANISOU 785 CG TYR A 97 27129 27636 17097 -6204 2447 -6376 C ATOM 786 CD1 TYR A 97 25.414 -21.748 -9.914 1.00207.48 C ANISOU 786 CD1 TYR A 97 30346 28912 19573 -6355 2304 -7272 C ATOM 787 CD2 TYR A 97 24.926 -23.813 -8.787 1.00189.44 C ANISOU 787 CD2 TYR A 97 26886 26953 18142 -5478 2558 -6523 C ATOM 788 CE1 TYR A 97 24.061 -21.608 -10.250 1.00210.69 C ANISOU 788 CE1 TYR A 97 31348 27592 21111 -5803 2278 -8288 C ATOM 789 CE2 TYR A 97 23.573 -23.688 -9.113 1.00192.59 C ANISOU 789 CE2 TYR A 97 27871 25635 19669 -4920 2534 -7530 C ATOM 790 CZ TYR A 97 23.142 -22.588 -9.842 1.00202.98 C ANISOU 790 CZ TYR A 97 30070 25928 21124 -5085 2396 -8409 C ATOM 791 OH TYR A 97 21.799 -22.491 -10.152 1.00200.63 O ANISOU 791 OH TYR A 97 30336 23937 21956 -4523 2376 -9389 O ATOM 792 N LYS A 98 30.323 -24.356 -10.361 1.00181.32 N ANISOU 792 N LYS A 98 24191 31147 13554 -5692 1989 -2875 N ATOM 793 CA LYS A 98 31.775 -24.445 -10.211 1.00187.77 C ANISOU 793 CA LYS A 98 24446 33689 13208 -6184 1970 -1827 C ATOM 794 C LYS A 98 32.495 -23.260 -10.875 1.00192.52 C ANISOU 794 C LYS A 98 25586 34599 12962 -6813 1798 -1959 C ATOM 795 O LYS A 98 31.874 -22.447 -11.573 1.00198.07 O ANISOU 795 O LYS A 98 27083 34125 14048 -6731 1663 -2845 O ATOM 796 CB LYS A 98 32.297 -25.791 -10.758 1.00190.30 C ANISOU 796 CB LYS A 98 24033 34430 13843 -4992 1815 -963 C ATOM 797 CG LYS A 98 33.808 -25.969 -10.616 1.00200.54 C ANISOU 797 CG LYS A 98 24701 37521 13972 -5432 1793 167 C ATOM 798 CD LYS A 98 34.332 -27.359 -10.987 1.00199.97 C ANISOU 798 CD LYS A 98 23825 37973 14181 -4327 1681 1078 C ATOM 799 CE LYS A 98 35.866 -27.330 -11.072 1.00208.89 C ANISOU 799 CE LYS A 98 24481 40773 14116 -4766 1610 2102 C ATOM 800 NZ LYS A 98 36.479 -26.335 -10.113 1.00220.83 N ANISOU 800 NZ LYS A 98 26070 43410 14426 -6346 1814 2238 N ATOM 801 N LEU A 99 33.800 -23.157 -10.644 1.00166.13 N ANISOU 801 N LEU A 99 17855 24396 20870 -6116 5129 -1691 N ATOM 802 CA LEU A 99 34.584 -22.093 -11.258 1.00169.24 C ANISOU 802 CA LEU A 99 18527 25030 20747 -6130 4846 -2145 C ATOM 803 C LEU A 99 36.089 -22.210 -10.988 1.00169.48 C ANISOU 803 C LEU A 99 18541 24524 21328 -5887 4810 -2126 C ATOM 804 O LEU A 99 36.506 -22.686 -9.934 1.00157.10 O ANISOU 804 O LEU A 99 16872 22603 20215 -5468 4799 -1530 O ATOM 805 CB LEU A 99 34.020 -20.717 -10.858 1.00168.77 C ANISOU 805 CB LEU A 99 18842 25787 19495 -5786 4332 -1871 C ATOM 806 CG LEU A 99 34.793 -19.410 -11.077 1.00164.76 C ANISOU 806 CG LEU A 99 18687 25635 18278 -5593 3904 -2091 C ATOM 807 CD1 LEU A 99 35.878 -19.323 -10.015 1.00159.08 C ANISOU 807 CD1 LEU A 99 18023 24611 17810 -5014 3689 -1560 C ATOM 808 CD2 LEU A 99 35.353 -19.194 -12.516 1.00143.93 C ANISOU 808 CD2 LEU A 99 16081 22916 15691 -6129 4038 -3005 C ATOM 809 N ASN A 100 36.883 -21.786 -11.971 1.00156.26 N ANISOU 809 N ASN A 100 16964 22792 19615 -6167 4799 -2795 N ATOM 810 CA ASN A 100 38.339 -21.721 -11.869 1.00153.12 C ANISOU 810 CA ASN A 100 16596 21962 19622 -5971 4727 -2874 C ATOM 811 C ASN A 100 38.845 -21.451 -10.455 1.00152.36 C ANISOU 811 C ASN A 100 16608 21829 19453 -5265 4409 -2080 C ATOM 812 O ASN A 100 38.970 -20.300 -10.047 1.00149.18 O ANISOU 812 O ASN A 100 16526 21918 18235 -4889 3955 -1860 O ATOM 813 CB ASN A 100 38.870 -20.666 -12.857 1.00158.50 C ANISOU 813 CB ASN A 100 17542 22964 19718 -6179 4509 -3528 C ATOM 814 CG ASN A 100 40.307 -20.243 -12.565 1.00162.07 C ANISOU 814 CG ASN A 100 18124 23157 20299 -5846 4289 -3496 C ATOM 815 OD1 ASN A 100 40.944 -20.708 -11.604 1.00150.23 O ANISOU 815 OD1 ASN A 100 16525 21239 19316 -5441 4285 -2978 O ATOM 816 ND2 ASN A 100 40.828 -19.354 -13.409 1.00174.74 N ANISOU 816 ND2 ASN A 100 19953 25010 21429 -6021 4103 -4061 N ATOM 817 N LEU A 101 39.147 -22.509 -9.715 1.00157.11 N ANISOU 817 N LEU A 101 16943 21842 20908 -5087 4645 -1654 N ATOM 818 CA LEU A 101 39.580 -22.332 -8.329 1.00172.16 C ANISOU 818 CA LEU A 101 18932 23692 22789 -4418 4364 -869 C ATOM 819 C LEU A 101 40.791 -21.409 -8.180 1.00166.93 C ANISOU 819 C LEU A 101 18529 23071 21824 -4085 4004 -905 C ATOM 820 O LEU A 101 40.777 -20.481 -7.356 1.00165.61 O ANISOU 820 O LEU A 101 18632 23340 20954 -3580 3567 -420 O ATOM 821 CB LEU A 101 39.898 -23.676 -7.677 1.00187.50 C ANISOU 821 CB LEU A 101 20530 24908 25802 -4325 4707 -494 C ATOM 822 CG LEU A 101 40.690 -23.539 -6.382 1.00184.64 C ANISOU 822 CG LEU A 101 20240 24356 25559 -3667 4445 204 C ATOM 823 CD1 LEU A 101 39.838 -22.796 -5.371 1.00162.75 C ANISOU 823 CD1 LEU A 101 17684 22201 21952 -3195 4061 883 C ATOM 824 CD2 LEU A 101 41.103 -24.908 -5.867 1.00196.44 C ANISOU 824 CD2 LEU A 101 21382 25080 28174 -3629 4813 487 C ATOM 825 N PRO A 102 41.852 -21.671 -8.965 1.00156.45 N ANISOU 825 N PRO A 102 17120 21287 21036 -4364 4188 -1475 N ATOM 826 CA PRO A 102 43.109 -20.992 -8.649 1.00151.03 C ANISOU 826 CA PRO A 102 16633 20517 20234 -3996 3883 -1414 C ATOM 827 C PRO A 102 43.241 -19.591 -9.265 1.00149.73 C ANISOU 827 C PRO A 102 16835 20963 19093 -4024 3501 -1809 C ATOM 828 O PRO A 102 44.270 -18.954 -9.056 1.00153.68 O ANISOU 828 O PRO A 102 17519 21433 19438 -3732 3232 -1788 O ATOM 829 CB PRO A 102 44.181 -21.954 -9.199 1.00154.16 C ANISOU 829 CB PRO A 102 16763 20129 21681 -4285 4266 -1840 C ATOM 830 CG PRO A 102 43.431 -23.212 -9.643 1.00158.74 C ANISOU 830 CG PRO A 102 16988 20362 22963 -4753 4772 -2021 C ATOM 831 CD PRO A 102 42.046 -22.744 -9.955 1.00158.14 C ANISOU 831 CD PRO A 102 17023 20943 22119 -4947 4694 -2077 C ATOM 832 N GLU A 103 42.239 -19.098 -9.984 1.00148.85 N ANISOU 832 N GLU A 103 16834 21398 18325 -4353 3466 -2148 N ATOM 833 CA GLU A 103 42.300 -17.698 -10.378 1.00154.23 C ANISOU 833 CA GLU A 103 17888 22710 18004 -4293 3049 -2403 C ATOM 834 C GLU A 103 42.141 -16.829 -9.131 1.00148.20 C ANISOU 834 C GLU A 103 17387 22396 16527 -3625 2569 -1649 C ATOM 835 O GLU A 103 42.583 -15.675 -9.100 1.00138.04 O ANISOU 835 O GLU A 103 16419 21503 14527 -3383 2162 -1683 O ATOM 836 CB GLU A 103 41.225 -17.360 -11.413 1.00165.13 C ANISOU 836 CB GLU A 103 19328 24587 18827 -4792 3114 -2924 C ATOM 837 CG GLU A 103 41.213 -15.903 -11.899 1.00170.87 C ANISOU 837 CG GLU A 103 20441 25992 18489 -4771 2690 -3228 C ATOM 838 CD GLU A 103 40.164 -15.628 -13.004 1.00176.05 C ANISOU 838 CD GLU A 103 21140 27106 18644 -5309 2785 -3792 C ATOM 839 OE1 GLU A 103 39.791 -14.445 -13.216 1.00179.53 O ANISOU 839 OE1 GLU A 103 21897 28210 18105 -5247 2419 -3896 O ATOM 840 OE2 GLU A 103 39.723 -16.594 -13.664 1.00174.17 O ANISOU 840 OE2 GLU A 103 20620 26562 18994 -5795 3225 -4135 O ATOM 841 N TYR A 104 41.541 -17.406 -8.086 1.00169.99 N ANISOU 841 N TYR A 104 20906 22478 21207 -1576 9527 842 N ATOM 842 CA TYR A 104 41.056 -16.614 -6.946 1.00175.53 C ANISOU 842 CA TYR A 104 22153 22788 21754 -1117 9321 840 C ATOM 843 C TYR A 104 41.436 -17.019 -5.518 1.00163.99 C ANISOU 843 C TYR A 104 20960 20945 20402 -959 8901 434 C ATOM 844 O TYR A 104 40.932 -16.423 -4.559 1.00164.60 O ANISOU 844 O TYR A 104 21491 20745 20303 -551 8741 446 O ATOM 845 CB TYR A 104 39.539 -16.532 -6.979 1.00189.77 C ANISOU 845 CB TYR A 104 24106 25057 22942 -711 9551 1201 C ATOM 846 CG TYR A 104 38.939 -16.341 -8.341 1.00198.42 C ANISOU 846 CG TYR A 104 24922 26651 23818 -817 9982 1614 C ATOM 847 CD1 TYR A 104 38.725 -17.428 -9.184 1.00198.51 C ANISOU 847 CD1 TYR A 104 24466 27283 23675 -1058 10205 1676 C ATOM 848 CD2 TYR A 104 38.550 -15.081 -8.779 1.00203.10 C ANISOU 848 CD2 TYR A 104 25720 27105 24342 -662 10169 1946 C ATOM 849 CE1 TYR A 104 38.154 -17.262 -10.430 1.00200.06 C ANISOU 849 CE1 TYR A 104 24408 27948 23660 -1144 10599 2054 C ATOM 850 CE2 TYR A 104 37.976 -14.909 -10.032 1.00201.64 C ANISOU 850 CE2 TYR A 104 25281 27390 23943 -748 10569 2330 C ATOM 851 CZ TYR A 104 37.778 -16.006 -10.847 1.00195.57 C ANISOU 851 CZ TYR A 104 24050 27234 23025 -986 10780 2380 C ATOM 852 OH TYR A 104 37.199 -15.851 -12.085 1.00178.04 O ANISOU 852 OH TYR A 104 21576 25485 20585 -1065 11173 2757 O ATOM 853 N MET A 105 42.282 -18.022 -5.345 1.00161.70 N ANISOU 853 N MET A 105 20409 20646 20385 -1258 8721 81 N ATOM 854 CA MET A 105 42.790 -18.292 -4.005 1.00163.62 C ANISOU 854 CA MET A 105 20919 20452 20799 -1132 8306 -321 C ATOM 855 C MET A 105 43.446 -17.020 -3.402 1.00202.64 C ANISOU 855 C MET A 105 26259 24640 26095 -1034 8070 -425 C ATOM 856 O MET A 105 43.758 -16.085 -4.139 1.00216.06 O ANISOU 856 O MET A 105 27935 26153 28004 -1176 8222 -239 O ATOM 857 CB MET A 105 43.765 -19.464 -4.047 1.00174.35 C ANISOU 857 CB MET A 105 21904 21870 22470 -1531 8161 -685 C ATOM 858 CG MET A 105 43.957 -20.143 -2.706 1.00175.38 C ANISOU 858 CG MET A 105 22238 21789 22609 -1361 7790 -1067 C ATOM 859 SD MET A 105 42.437 -20.313 -1.731 1.00156.76 S ANISOU 859 SD MET A 105 20259 19697 19605 -757 7771 -921 S ATOM 860 CE MET A 105 41.336 -21.110 -2.912 1.00182.07 C ANISOU 860 CE MET A 105 23048 23803 22326 -815 8224 -548 C ATOM 861 N TRP A 106 43.644 -16.975 -2.078 1.00189.64 N ANISOU 861 N TRP A 106 24977 22564 24513 -790 7705 -716 N ATOM 862 CA TRP A 106 44.207 -15.781 -1.400 1.00177.89 C ANISOU 862 CA TRP A 106 23898 20354 23336 -658 7460 -826 C ATOM 863 C TRP A 106 45.630 -15.983 -0.789 1.00193.25 C ANISOU 863 C TRP A 106 25831 21749 25845 -923 7088 -1301 C ATOM 864 O TRP A 106 45.933 -17.046 -0.244 1.00190.71 O ANISOU 864 O TRP A 106 25393 21512 25557 -996 6893 -1608 O ATOM 865 CB TRP A 106 43.225 -15.242 -0.338 1.00172.87 C ANISOU 865 CB TRP A 106 23783 19582 22318 -100 7341 -731 C ATOM 866 CG TRP A 106 43.816 -14.153 0.532 1.00179.73 C ANISOU 866 CG TRP A 106 25090 19700 23498 58 7039 -901 C ATOM 867 CD1 TRP A 106 43.523 -12.815 0.487 1.00186.35 C ANISOU 867 CD1 TRP A 106 26250 20235 24319 271 7109 -657 C ATOM 868 CD2 TRP A 106 44.853 -14.302 1.542 1.00181.24 C ANISOU 868 CD2 TRP A 106 25433 19341 24090 -5 6620 -1357 C ATOM 869 NE1 TRP A 106 44.292 -12.123 1.425 1.00193.96 N ANISOU 869 NE1 TRP A 106 27562 20494 25640 353 6756 -933 N ATOM 870 CE2 TRP A 106 45.091 -13.003 2.073 1.00187.18 C ANISOU 870 CE2 TRP A 106 26607 19479 25033 193 6458 -1356 C ATOM 871 CE3 TRP A 106 45.543 -15.398 2.057 1.00173.86 C ANISOU 871 CE3 TRP A 106 24327 18387 23346 -189 6374 -1754 C ATOM 872 CZ2 TRP A 106 46.040 -12.807 3.103 1.00186.49 C ANISOU 872 CZ2 TRP A 106 26762 18757 25336 198 6046 -1757 C ATOM 873 CZ3 TRP A 106 46.481 -15.182 3.071 1.00173.83 C ANISOU 873 CZ3 TRP A 106 24567 17752 23727 -181 5970 -2146 C ATOM 874 CH2 TRP A 106 46.715 -13.906 3.579 1.00179.24 C ANISOU 874 CH2 TRP A 106 25664 17838 24603 11 5810 -2145 C ATOM 875 N LYS A 107 46.480 -14.948 -0.850 1.00196.40 N ANISOU 875 N LYS A 107 26364 21577 26681 -1050 6985 -1360 N ATOM 876 CA LYS A 107 47.896 -15.057 -0.426 1.00195.90 C ANISOU 876 CA LYS A 107 26254 20986 27193 -1344 6662 -1787 C ATOM 877 C LYS A 107 48.462 -13.815 0.284 1.00199.27 C ANISOU 877 C LYS A 107 27104 20663 27947 -1201 6403 -1907 C ATOM 878 O LYS A 107 48.276 -12.700 -0.224 1.00195.09 O ANISOU 878 O LYS A 107 26701 19984 27442 -1144 6576 -1627 O ATOM 879 CB LYS A 107 48.778 -15.333 -1.648 1.00188.56 C ANISOU 879 CB LYS A 107 24828 20183 26633 -1883 6844 -1789 C ATOM 880 CG LYS A 107 48.133 -16.172 -2.730 1.00181.68 C ANISOU 880 CG LYS A 107 23528 20061 25441 -2042 7212 -1531 C ATOM 881 CD LYS A 107 47.188 -15.357 -3.622 1.00187.14 C ANISOU 881 CD LYS A 107 24248 21039 25818 -1897 7592 -1039 C ATOM 882 CE LYS A 107 46.827 -16.124 -4.908 1.00188.55 C ANISOU 882 CE LYS A 107 23929 21908 25803 -2164 7968 -802 C ATOM 883 NZ LYS A 107 48.025 -16.409 -5.763 1.00169.90 N ANISOU 883 NZ LYS A 107 21146 19476 23930 -2699 8009 -947 N ATOM 884 N PRO A 108 49.208 -14.011 1.412 1.00203.54 N ANISOU 884 N PRO A 108 27844 20730 28763 -1164 5993 -2328 N ATOM 885 CA PRO A 108 49.751 -12.893 2.224 1.00213.94 C ANISOU 885 CA PRO A 108 29586 21314 30387 -1003 5706 -2481 C ATOM 886 C PRO A 108 50.634 -11.883 1.444 1.00204.69 C ANISOU 886 C PRO A 108 28326 19752 29693 -1308 5787 -2415 C ATOM 887 O PRO A 108 50.160 -11.125 0.592 1.00205.44 O ANISOU 887 O PRO A 108 28399 19988 29670 -1293 6094 -2042 O ATOM 888 CB PRO A 108 50.584 -13.603 3.323 1.00183.74 C ANISOU 888 CB PRO A 108 25829 17156 26829 -1048 5283 -2983 C ATOM 889 CG PRO A 108 50.032 -14.988 3.415 1.00178.61 C ANISOU 889 CG PRO A 108 24953 17085 25826 -1027 5335 -3036 C ATOM 890 CD PRO A 108 49.561 -15.330 1.989 1.00187.36 C ANISOU 890 CD PRO A 108 25626 18823 26739 -1268 5778 -2685 C TER 891 PRO A 108 ATOM 892 O5' DG B 1 31.585 -41.468 25.833 1.00140.56 O ANISOU 892 O5' DG B 1 18425 20479 14504 5030 4616 2080 O ATOM 893 C5' DG B 1 31.968 -42.506 26.736 1.00146.68 C ANISOU 893 C5' DG B 1 19342 21121 15267 5445 4912 2555 C ATOM 894 C4' DG B 1 30.810 -43.448 27.027 1.00150.65 C ANISOU 894 C4' DG B 1 20130 21636 15475 4845 4956 3082 C ATOM 895 O4' DG B 1 29.973 -42.924 28.092 1.00148.09 O ANISOU 895 O4' DG B 1 19026 22356 14884 4979 4571 3291 O ATOM 896 C3' DG B 1 29.888 -43.738 25.839 1.00154.72 C ANISOU 896 C3' DG B 1 21266 21632 15890 3825 4973 3028 C ATOM 897 O3' DG B 1 30.279 -44.947 25.185 1.00159.83 O ANISOU 897 O3' DG B 1 22831 21239 16656 3538 5444 3190 O ATOM 898 C2' DG B 1 28.517 -43.897 26.482 1.00151.33 C ANISOU 898 C2' DG B 1 20555 21836 15108 3401 4724 3426 C ATOM 899 C1' DG B 1 28.634 -42.911 27.638 1.00148.95 C ANISOU 899 C1' DG B 1 19253 22594 14747 4121 4369 3373 C ATOM 900 N9 DG B 1 28.336 -41.534 27.280 1.00156.29 N ANISOU 900 N9 DG B 1 19629 24083 15672 4044 3943 2906 N ATOM 901 C8 DG B 1 29.141 -40.443 27.531 1.00159.59 C ANISOU 901 C8 DG B 1 19432 24947 16260 4729 3746 2512 C ATOM 902 N7 DG B 1 28.624 -39.328 27.108 1.00159.85 N ANISOU 902 N7 DG B 1 19059 25435 16241 4471 3359 2142 N ATOM 903 C5 DG B 1 27.410 -39.713 26.545 1.00155.50 C ANISOU 903 C5 DG B 1 18882 24723 15479 3561 3300 2302 C ATOM 904 C6 DG B 1 26.422 -38.919 25.934 1.00154.00 C ANISOU 904 C6 DG B 1 18505 24853 15154 2935 2933 2053 C ATOM 905 O6 DG B 1 26.452 -37.693 25.772 1.00147.88 O ANISOU 905 O6 DG B 1 17184 24577 14425 3078 2585 1630 O ATOM 906 N1 DG B 1 25.341 -39.677 25.482 1.00157.88 N ANISOU 906 N1 DG B 1 19516 25022 15449 2080 2996 2336 N ATOM 907 C2 DG B 1 25.218 -41.038 25.618 1.00165.30 C ANISOU 907 C2 DG B 1 21074 25408 16323 1858 3366 2809 C ATOM 908 N2 DG B 1 24.097 -41.582 25.124 1.00143.58 N ANISOU 908 N2 DG B 1 18752 22425 13378 1001 3360 3022 N ATOM 909 N3 DG B 1 26.141 -41.803 26.195 1.00162.88 N ANISOU 909 N3 DG B 1 20951 24795 16139 2442 3714 3050 N ATOM 910 C4 DG B 1 27.207 -41.071 26.636 1.00159.53 C ANISOU 910 C4 DG B 1 20026 24678 15912 3280 3656 2773 C ATOM 911 P DC B 2 30.657 -44.934 23.620 1.00162.32 P ANISOU 911 P DC B 2 23857 20628 17187 3044 5637 2765 P ATOM 912 OP1 DC B 2 30.997 -46.328 23.226 1.00172.78 O ANISOU 912 OP1 DC B 2 26076 20976 18596 2815 6132 3051 O ATOM 913 OP2 DC B 2 31.624 -43.828 23.400 1.00153.86 O ANISOU 913 OP2 DC B 2 22381 19717 16364 3603 5510 2230 O ATOM 914 O5' DC B 2 29.282 -44.507 22.894 1.00153.96 O ANISOU 914 O5' DC B 2 22837 19760 15902 2117 5322 2666 O ATOM 915 C5' DC B 2 28.444 -45.462 22.236 1.00156.04 C ANISOU 915 C5' DC B 2 23831 19432 16026 1263 5497 2932 C ATOM 916 C4' DC B 2 27.049 -44.884 22.115 1.00152.77 C ANISOU 916 C4' DC B 2 23105 19603 15340 615 5083 2929 C ATOM 917 O4' DC B 2 26.953 -43.727 22.979 1.00148.98 O ANISOU 917 O4' DC B 2 21647 20170 14788 1131 4663 2785 O ATOM 918 C3' DC B 2 26.664 -44.356 20.745 1.00151.66 C ANISOU 918 C3' DC B 2 23299 19082 15244 -90 4962 2503 C ATOM 919 O3' DC B 2 26.091 -45.438 20.053 1.00154.95 O ANISOU 919 O3' DC B 2 24541 18754 15579 -847 5223 2762 O ATOM 920 C2' DC B 2 25.648 -43.248 21.039 1.00148.50 C ANISOU 920 C2' DC B 2 22151 19641 14631 -285 4427 2375 C ATOM 921 C1' DC B 2 25.980 -42.830 22.478 1.00149.69 C ANISOU 921 C1' DC B 2 21457 20681 14737 575 4260 2530 C ATOM 922 N1 DC B 2 26.532 -41.438 22.662 1.00144.90 N ANISOU 922 N1 DC B 2 20100 20701 14256 1151 3938 2061 N ATOM 923 C2 DC B 2 25.792 -40.330 22.221 1.00142.93 C ANISOU 923 C2 DC B 2 19449 20945 13914 770 3506 1721 C ATOM 924 O2 DC B 2 24.691 -40.506 21.676 1.00139.67 O ANISOU 924 O2 DC B 2 19308 20439 13321 -41 3393 1806 O ATOM 925 N3 DC B 2 26.303 -39.084 22.397 1.00139.89 N ANISOU 925 N3 DC B 2 18386 21122 13642 1298 3217 1301 N ATOM 926 C4 DC B 2 27.498 -38.929 22.980 1.00142.89 C ANISOU 926 C4 DC B 2 18494 21576 14221 2169 3349 1218 C ATOM 927 N4 DC B 2 27.970 -37.683 23.123 1.00141.49 N ANISOU 927 N4 DC B 2 17651 21954 14153 2665 3053 799 N ATOM 928 C5 DC B 2 28.264 -40.039 23.443 1.00145.93 C ANISOU 928 C5 DC B 2 19272 21471 14706 2573 3784 1560 C ATOM 929 C6 DC B 2 27.753 -41.264 23.266 1.00145.42 C ANISOU 929 C6 DC B 2 19874 20853 14526 2046 4065 1972 C ATOM 930 P DC B 3 26.938 -46.216 18.921 1.00189.70 P ANISOU 930 P DC B 3 29895 21947 20233 -1049 5694 2616 P ATOM 931 OP1 DC B 3 26.259 -47.515 18.647 1.00195.98 O ANISOU 931 OP1 DC B 3 31430 22146 20888 -1708 5964 3056 O ATOM 932 OP2 DC B 3 28.376 -46.179 19.311 1.00191.51 O ANISOU 932 OP2 DC B 3 30005 22028 20733 -166 5923 2481 O ATOM 933 O5' DC B 3 26.720 -45.321 17.612 1.00172.31 O ANISOU 933 O5' DC B 3 27835 19528 18108 -1592 5492 2067 O ATOM 934 C5' DC B 3 25.448 -45.394 16.981 1.00167.50 C ANISOU 934 C5' DC B 3 27484 18871 17287 -2506 5318 2131 C ATOM 935 C4' DC B 3 24.727 -44.049 16.972 1.00155.10 C ANISOU 935 C4' DC B 3 25205 18129 15597 -2654 4785 1817 C ATOM 936 O4' DC B 3 25.226 -43.115 17.985 1.00157.57 O ANISOU 936 O4' DC B 3 24609 19314 15947 -1815 4531 1688 O ATOM 937 C3' DC B 3 24.806 -43.292 15.640 1.00148.08 C ANISOU 937 C3' DC B 3 24562 16860 14844 -3086 4673 1261 C ATOM 938 O3' DC B 3 23.515 -42.906 15.124 1.00142.33 O ANISOU 938 O3' DC B 3 23809 16365 13907 -3888 4343 1211 O ATOM 939 C2' DC B 3 25.610 -42.051 16.001 1.00149.36 C ANISOU 939 C2' DC B 3 23978 17609 15161 -2338 4434 841 C ATOM 940 C1' DC B 3 25.062 -41.826 17.409 1.00153.72 C ANISOU 940 C1' DC B 3 23733 19177 15498 -1948 4159 1177 C ATOM 941 N1 DC B 3 25.676 -40.700 18.221 1.00146.08 N ANISOU 941 N1 DC B 3 21859 19034 14609 -1110 3883 926 N ATOM 942 C2 DC B 3 24.962 -39.495 18.280 1.00139.34 C ANISOU 942 C2 DC B 3 20333 18977 13632 -1246 3382 667 C ATOM 943 O2 DC B 3 23.887 -39.432 17.678 1.00140.09 O ANISOU 943 O2 DC B 3 20613 19051 13564 -2032 3199 662 O ATOM 944 N3 DC B 3 25.455 -38.443 18.977 1.00137.02 N ANISOU 944 N3 DC B 3 19218 19443 13402 -528 3111 431 N ATOM 945 C4 DC B 3 26.622 -38.562 19.613 1.00136.42 C ANISOU 945 C4 DC B 3 18976 19352 13507 309 3323 448 C ATOM 946 N4 DC B 3 27.092 -37.519 20.316 1.00137.95 N ANISOU 946 N4 DC B 3 18350 20307 13759 1017 3047 221 N ATOM 947 C5 DC B 3 27.366 -39.781 19.568 1.00131.51 C ANISOU 947 C5 DC B 3 19027 17922 13016 463 3832 709 C ATOM 948 C6 DC B 3 26.874 -40.818 18.870 1.00138.37 C ANISOU 948 C6 DC B 3 20710 18042 13822 -252 4099 939 C ATOM 949 P DA B 4 23.134 -43.214 13.586 1.00175.11 P ANISOU 949 P DA B 4 28816 19621 18096 -4806 4467 1008 P ATOM 950 OP1 DA B 4 22.053 -44.221 13.573 1.00181.97 O ANISOU 950 OP1 DA B 4 30132 20272 18736 -5496 4554 1478 O ATOM 951 OP2 DA B 4 24.398 -43.443 12.838 1.00157.60 O ANISOU 951 OP2 DA B 4 27136 16566 16179 -4554 4838 721 O ATOM 952 O5' DA B 4 22.518 -41.834 13.056 1.00148.56 O ANISOU 952 O5' DA B 4 24978 16786 14681 -5131 3968 544 O ATOM 953 C5' DA B 4 21.306 -41.301 13.548 1.00150.90 C ANISOU 953 C5' DA B 4 24704 17911 14718 -5424 3534 666 C ATOM 954 C4' DA B 4 21.387 -39.802 13.362 1.00143.18 C ANISOU 954 C4' DA B 4 23069 17530 13801 -5236 3110 142 C ATOM 955 O4' DA B 4 22.250 -39.205 14.374 1.00149.46 O ANISOU 955 O4' DA B 4 23138 18954 14696 -4269 3034 64 O ATOM 956 C3' DA B 4 21.988 -39.387 12.037 1.00134.97 C ANISOU 956 C3' DA B 4 22488 15810 12984 -5470 3191 -379 C ATOM 957 O3' DA B 4 21.362 -38.215 11.567 1.00144.79 O ANISOU 957 O3' DA B 4 23334 17511 14168 -5809 2738 -764 O ATOM 958 C2' DA B 4 23.432 -39.093 12.411 1.00128.98 C ANISOU 958 C2' DA B 4 21487 15040 12479 -4550 3367 -593 C ATOM 959 C1' DA B 4 23.239 -38.404 13.754 1.00133.43 C ANISOU 959 C1' DA B 4 21058 16721 12920 -3937 3028 -471 C ATOM 960 N9 DA B 4 24.478 -38.419 14.531 1.00135.89 N ANISOU 960 N9 DA B 4 21081 17139 13413 -2984 3225 -465 N ATOM 961 C8 DA B 4 25.290 -39.506 14.644 1.00148.18 C ANISOU 961 C8 DA B 4 23173 18028 15099 -2703 3707 -217 C ATOM 962 N7 DA B 4 26.355 -39.300 15.376 1.00150.48 N ANISOU 962 N7 DA B 4 23077 18546 15551 -1822 3801 -267 N ATOM 963 C5 DA B 4 26.249 -37.981 15.776 1.00144.15 C ANISOU 963 C5 DA B 4 21423 18626 14722 -1491 3354 -568 C ATOM 964 C6 DA B 4 27.080 -37.173 16.583 1.00145.44 C ANISOU 964 C6 DA B 4 20851 19404 15006 -596 3213 -751 C ATOM 965 N6 DA B 4 28.219 -37.622 17.131 1.00142.47 N ANISOU 965 N6 DA B 4 20508 18815 14811 139 3530 -649 N ATOM 966 N1 DA B 4 26.684 -35.889 16.787 1.00144.89 N ANISOU 966 N1 DA B 4 20020 20166 14864 -499 2731 -1045 N ATOM 967 C2 DA B 4 25.538 -35.474 16.218 1.00142.16 C ANISOU 967 C2 DA B 4 19668 20004 14343 -1252 2420 -1143 C ATOM 968 N3 DA B 4 24.683 -36.151 15.448 1.00139.03 N ANISOU 968 N3 DA B 4 19924 19078 13825 -2122 2512 -989 N ATOM 969 C4 DA B 4 25.096 -37.414 15.259 1.00136.59 C ANISOU 969 C4 DA B 4 20360 17953 13587 -2200 2992 -698 C ATOM 970 P DT B 5 20.442 -38.276 10.240 1.00147.91 P ANISOU 970 P DT B 5 18123 18252 19823 -6206 2480 -3602 P ATOM 971 OP1 DT B 5 19.019 -38.348 10.684 1.00147.75 O ANISOU 971 OP1 DT B 5 17712 18448 19976 -6601 2561 -3667 O ATOM 972 OP2 DT B 5 21.028 -39.302 9.323 1.00143.71 O ANISOU 972 OP2 DT B 5 18065 17556 18982 -6136 2131 -3579 O ATOM 973 O5' DT B 5 20.711 -36.861 9.495 1.00150.65 O ANISOU 973 O5' DT B 5 18104 18740 20397 -5695 2537 -3506 O ATOM 974 C5' DT B 5 22.022 -36.327 9.262 1.00141.45 C ANISOU 974 C5' DT B 5 17137 17431 19178 -5271 2574 -3413 C ATOM 975 C4' DT B 5 22.320 -35.245 10.288 1.00135.19 C ANISOU 975 C4' DT B 5 16132 16639 18596 -5149 2894 -3387 C ATOM 976 O4' DT B 5 23.258 -35.696 11.296 1.00126.57 O ANISOU 976 O4' DT B 5 15468 15254 17371 -5232 3023 -3403 O ATOM 977 C3' DT B 5 22.930 -33.997 9.676 1.00139.34 C ANISOU 977 C3' DT B 5 16445 17232 19265 -4659 2909 -3260 C ATOM 978 O3' DT B 5 21.909 -33.020 9.566 1.00160.71 O ANISOU 978 O3' DT B 5 18606 20220 22236 -4625 2963 -3279 O ATOM 979 C2' DT B 5 24.051 -33.563 10.626 1.00125.75 C ANISOU 979 C2' DT B 5 14930 15286 17564 -4496 3111 -3191 C ATOM 980 C1' DT B 5 24.012 -34.592 11.743 1.00124.00 C ANISOU 980 C1' DT B 5 15050 14858 17206 -4905 3209 -3306 C ATOM 981 N1 DT B 5 25.349 -35.067 12.176 1.00124.95 N ANISOU 981 N1 DT B 5 15684 14624 17166 -4821 3215 -3279 N ATOM 982 C2 DT B 5 26.220 -34.201 12.804 1.00130.00 C ANISOU 982 C2 DT B 5 16348 15098 17947 -4554 3378 -3178 C ATOM 983 O2 DT B 5 25.954 -33.025 13.019 1.00128.04 O ANISOU 983 O2 DT B 5 15724 14995 17932 -4367 3508 -3100 O ATOM 984 N3 DT B 5 27.419 -34.761 13.186 1.00135.70 N ANISOU 984 N3 DT B 5 17563 15464 18532 -4508 3356 -3171 N ATOM 985 C4 DT B 5 27.845 -36.062 13.004 1.00133.15 C ANISOU 985 C4 DT B 5 17708 14952 17933 -4687 3185 -3271 C ATOM 986 O4 DT B 5 28.953 -36.455 13.386 1.00134.68 O ANISOU 986 O4 DT B 5 18323 14816 18035 -4619 3165 -3276 O ATOM 987 C5 DT B 5 26.871 -36.903 12.335 1.00125.02 C ANISOU 987 C5 DT B 5 16633 14129 16740 -4956 3005 -3368 C ATOM 988 C7 DT B 5 27.141 -38.351 12.055 1.00126.80 C ANISOU 988 C7 DT B 5 17350 14195 16636 -5168 2758 -3478 C ATOM 989 C6 DT B 5 25.697 -36.376 11.967 1.00122.19 C ANISOU 989 C6 DT B 5 15794 14100 16534 -5011 3031 -3359 C ATOM 990 P DG B 6 21.695 -32.211 8.186 1.00148.28 P ANISOU 990 P DG B 6 16737 18834 20768 -4289 2762 -3219 P ATOM 991 OP1 DG B 6 21.681 -30.765 8.507 1.00159.73 O ANISOU 991 OP1 DG B 6 17804 20426 22460 -4033 2898 -3170 O ATOM 992 OP2 DG B 6 20.542 -32.811 7.477 1.00130.52 O ANISOU 992 OP2 DG B 6 14346 16717 18528 -4525 2561 -3310 O ATOM 993 O5' DG B 6 23.005 -32.564 7.315 1.00153.55 O ANISOU 993 O5' DG B 6 17833 19306 21201 -3984 2608 -3101 O ATOM 994 C5' DG B 6 24.368 -32.283 7.699 1.00142.33 C ANISOU 994 C5' DG B 6 16670 17691 19718 -3730 2723 -2986 C ATOM 995 C4' DG B 6 24.600 -30.918 8.310 1.00123.11 C ANISOU 995 C4' DG B 6 13936 15319 17520 -3505 2900 -2901 C ATOM 996 O4' DG B 6 25.367 -31.053 9.531 1.00123.30 O ANISOU 996 O4' DG B 6 14218 15101 17529 -3560 3093 -2873 O ATOM 997 C3' DG B 6 25.464 -30.057 7.421 1.00118.58 C ANISOU 997 C3' DG B 6 13325 14766 16966 -3061 2810 -2736 C ATOM 998 O3' DG B 6 25.131 -28.694 7.571 1.00112.59 O ANISOU 998 O3' DG B 6 12148 14185 16444 -2880 2853 -2686 O ATOM 999 C2' DG B 6 26.899 -30.393 7.834 1.00119.31 C ANISOU 999 C2' DG B 6 13832 14569 16933 -2921 2889 -2624 C ATOM 1000 C1' DG B 6 26.747 -30.972 9.235 1.00125.08 C ANISOU 1000 C1' DG B 6 14730 15128 17666 -3251 3061 -2728 C ATOM 1001 N9 DG B 6 27.342 -32.289 9.395 1.00127.24 N ANISOU 1001 N9 DG B 6 15500 15151 17696 -3425 3020 -2791 N ATOM 1002 C8 DG B 6 27.032 -33.470 8.783 1.00110.29 C ANISOU 1002 C8 DG B 6 13585 13002 15319 -3622 2848 -2894 C ATOM 1003 N7 DG B 6 27.772 -34.459 9.173 1.00109.58 N ANISOU 1003 N7 DG B 6 13958 12647 15029 -3733 2824 -2941 N ATOM 1004 C5 DG B 6 28.620 -33.891 10.098 1.00126.59 C ANISOU 1004 C5 DG B 6 16187 14600 17312 -3607 3004 -2867 C ATOM 1005 C6 DG B 6 29.649 -34.452 10.869 1.00122.01 C ANISOU 1005 C6 DG B 6 16047 13669 16644 -3643 3050 -2886 C ATOM 1006 O6 DG B 6 30.017 -35.624 10.882 1.00127.79 O ANISOU 1006 O6 DG B 6 17202 14215 17137 -3806 2932 -2993 O ATOM 1007 N1 DG B 6 30.274 -33.509 11.691 1.00113.89 N ANISOU 1007 N1 DG B 6 14953 12485 15837 -3460 3220 -2771 N ATOM 1008 C2 DG B 6 29.935 -32.181 11.761 1.00112.72 C ANISOU 1008 C2 DG B 6 14369 12521 15940 -3262 3319 -2647 C ATOM 1009 N2 DG B 6 30.629 -31.416 12.609 1.00100.49 N ANISOU 1009 N2 DG B 6 12848 10761 14574 -3092 3440 -2527 N ATOM 1010 N3 DG B 6 28.968 -31.645 11.040 1.00118.08 N ANISOU 1010 N3 DG B 6 14630 13550 16686 -3229 3271 -2646 N ATOM 1011 C4 DG B 6 28.369 -32.558 10.243 1.00120.14 C ANISOU 1011 C4 DG B 6 14951 13941 16757 -3411 3121 -2761 C HETATM 1012 OP2 EHG B 7 23.514 -27.930 5.703 1.00143.07 O ANISOU 1012 OP2 EHG B 7 15450 18460 20450 -2791 2516 -2797 O HETATM 1013 P EHG B 7 24.984 -27.776 6.267 1.00149.30 P ANISOU 1013 P EHG B 7 16531 19036 21161 -2576 2654 -2621 P HETATM 1014 OP1 EHG B 7 25.395 -26.309 6.642 1.00108.46 O ANISOU 1014 OP1 EHG B 7 11103 13931 16175 -2281 2702 -2486 O HETATM 1015 O5' EHG B 7 25.973 -28.422 5.261 1.00113.09 O ANISOU 1015 O5' EHG B 7 12323 14306 16338 -2394 2538 -2522 O HETATM 1016 C5' EHG B 7 27.350 -28.156 5.286 1.00114.27 C ANISOU 1016 C5' EHG B 7 12689 14300 16429 -2112 2598 -2338 C HETATM 1017 C4' EHG B 7 27.872 -27.561 4.092 1.00125.99 C ANISOU 1017 C4' EHG B 7 14141 15861 17871 -1776 2465 -2202 C HETATM 1018 C3' EHG B 7 29.290 -27.230 4.234 1.00112.54 C ANISOU 1018 C3' EHG B 7 12613 14005 16142 -1499 2548 -1992 C HETATM 1019 O3' EHG B 7 29.912 -27.470 3.034 1.00104.72 O ANISOU 1019 O3' EHG B 7 11804 13011 14972 -1277 2448 -1903 O HETATM 1020 C2' EHG B 7 29.277 -25.801 4.548 1.00105.90 C ANISOU 1020 C2' EHG B 7 11428 13282 15526 -1321 2553 -1878 C HETATM 1021 O4' EHG B 7 27.160 -26.310 3.895 1.00107.09 O ANISOU 1021 O4' EHG B 7 11315 13691 15684 -1680 2387 -2206 O HETATM 1022 C1' EHG B 7 28.118 -25.318 3.755 1.00110.46 C ANISOU 1022 C1' EHG B 7 11693 14111 16164 -1352 2387 -1996 C HETATM 1023 N9 EHG B 7 27.522 -24.109 4.197 1.00106.36 N ANISOU 1023 N9 EHG B 7 10785 13759 15868 -1308 2355 -2004 N HETATM 1024 C8 EHG B 7 26.404 -24.078 4.946 1.00105.86 C ANISOU 1024 C8 EHG B 7 10488 13796 15938 -1554 2403 -2180 C HETATM 1025 N7 EHG B 7 26.066 -22.776 5.197 1.00106.89 N ANISOU 1025 N7 EHG B 7 10271 14089 16255 -1411 2335 -2151 N HETATM 1026 C5 EHG B 7 27.019 -21.972 4.556 1.00103.45 C ANISOU 1026 C5 EHG B 7 9864 13646 15795 -1079 2220 -1938 C HETATM 1027 C4 EHG B 7 27.926 -22.783 3.924 1.00103.13 C ANISOU 1027 C4 EHG B 7 10170 13450 15565 -1013 2250 -1841 C HETATM 1028 C6 EHG B 7 27.191 -20.546 4.454 1.00102.12 C ANISOU 1028 C6 EHG B 7 9446 13605 15749 -816 2070 -1810 C HETATM 1029 N1 EHG B 7 28.217 -20.043 3.761 1.00100.66 N ANISOU 1029 N1 EHG B 7 9361 13386 15500 -540 1975 -1586 N HETATM 1030 C2 EHG B 7 29.104 -20.846 3.149 1.00100.50 C ANISOU 1030 C2 EHG B 7 9659 13220 15305 -483 2042 -1484 C HETATM 1031 N2 EHG B 7 30.184 -20.238 2.442 1.00 99.16 N ANISOU 1031 N2 EHG B 7 9559 13038 15082 -186 1962 -1232 N HETATM 1032 N3 EHG B 7 28.982 -22.205 3.216 1.00101.68 N ANISOU 1032 N3 EHG B 7 10063 13244 15325 -702 2175 -1614 N HETATM 1033 O6 EHG B 7 26.294 -19.732 5.113 1.00102.48 O ANISOU 1033 O6 EHG B 7 9157 13811 15969 -856 2022 -1917 O HETATM 1034 C1X EHG B 7 26.343 -18.351 4.938 1.00101.40 C ANISOU 1034 C1X EHG B 7 8780 13817 15929 -608 1814 -1819 C HETATM 1035 C2X EHG B 7 25.009 -17.601 4.936 1.00102.93 C ANISOU 1035 C2X EHG B 7 8574 14269 16265 -664 1651 -2041 C HETATM 1036 OX EHG B 7 24.184 -17.727 6.008 1.00103.94 O ANISOU 1036 OX EHG B 7 8540 14448 16504 -846 1797 -2195 O ATOM 1037 P DC B 8 31.071 -28.584 2.932 1.00 51.96 P ANISOU 1037 P DC B 8 18257 18763 20719 -1212 2503 -1849 P ATOM 1038 OP1 DC B 8 31.250 -28.945 1.499 1.00 61.13 O ANISOU 1038 OP1 DC B 8 19575 19983 21663 -1025 2364 -1818 O ATOM 1039 OP2 DC B 8 30.755 -29.661 3.899 1.00 32.39 O ANISOU 1039 OP2 DC B 8 15995 16128 18179 -1554 2565 -2019 O ATOM 1040 O5' DC B 8 32.379 -27.796 3.399 1.00 1.61 O ANISOU 1040 O5' DC B 8 11876 12269 14462 -940 2626 -1613 O ATOM 1041 C5' DC B 8 32.764 -27.763 4.761 1.00 2.79 C ANISOU 1041 C5' DC B 8 12084 12219 14751 -1045 2764 -1597 C ATOM 1042 C4' DC B 8 34.097 -28.451 4.890 1.00 4.25 C ANISOU 1042 C4' DC B 8 12642 12144 14822 -926 2833 -1508 C ATOM 1043 O4' DC B 8 33.866 -29.779 5.376 1.00 99.78 O ANISOU 1043 O4' DC B 8 12401 11415 14094 -1220 2842 -1718 O ATOM 1044 C3' DC B 8 34.824 -28.672 3.576 1.00 5.21 C ANISOU 1044 C3' DC B 8 12896 12328 14750 -648 2771 -1399 C ATOM 1045 O3' DC B 8 36.207 -28.427 3.718 1.00 11.44 O ANISOU 1045 O3' DC B 8 13797 12951 15592 -393 2855 -1190 O ATOM 1046 C2' DC B 8 34.621 -30.146 3.304 1.00 1.01 C ANISOU 1046 C2' DC B 8 12725 11714 13940 -829 2709 -1596 C ATOM 1047 C1' DC B 8 34.800 -30.587 4.734 1.00 99.82 C ANISOU 1047 C1' DC B 8 12739 11308 13879 -1069 2808 -1688 C ATOM 1048 N1 DC B 8 34.353 -31.929 4.909 1.00 8.43 N ANISOU 1048 N1 DC B 8 14142 12305 14753 -1361 2737 -1914 N ATOM 1049 C2 DC B 8 35.237 -32.878 5.400 1.00 16.45 C ANISOU 1049 C2 DC B 8 15566 13040 15638 -1404 2751 -1973 C ATOM 1050 O2 DC B 8 36.379 -32.521 5.677 1.00 19.92 O ANISOU 1050 O2 DC B 8 16070 13312 16182 -1183 2839 -1826 O ATOM 1051 N3 DC B 8 34.814 -34.156 5.563 1.00 22.59 N ANISOU 1051 N3 DC B 8 16663 13729 16187 -1692 2642 -2189 N ATOM 1052 C4 DC B 8 33.559 -34.478 5.238 1.00 15.87 C ANISOU 1052 C4 DC B 8 15710 13061 15255 -1928 2533 -2317 C ATOM 1053 N4 DC B 8 33.165 -35.745 5.404 1.00 8.11 N ANISOU 1053 N4 DC B 8 15051 11985 14041 -2219 2396 -2508 N ATOM 1054 C5 DC B 8 32.649 -33.499 4.728 1.00 17.40 C ANISOU 1054 C5 DC B 8 15464 13531 15610 -1877 2533 -2255 C ATOM 1055 C6 DC B 8 33.081 -32.244 4.578 1.00 3.19 C ANISOU 1055 C6 DC B 8 13371 11817 14019 -1592 2631 -2065 C ATOM 1056 P DT B 9 37.110 -28.205 2.410 1.00 23.83 P ANISOU 1056 P DT B 9 15393 14625 17032 -28 2838 -992 P ATOM 1057 OP1 DT B 9 38.355 -27.528 2.824 1.00 96.18 O ANISOU 1057 OP1 DT B 9 11849 10981 13712 206 2931 -735 O ATOM 1058 OP2 DT B 9 36.236 -27.642 1.358 1.00 11.53 O ANISOU 1058 OP2 DT B 9 13600 13352 15424 24 2722 -1003 O ATOM 1059 O5' DT B 9 37.491 -29.692 1.973 1.00 20.75 O ANISOU 1059 O5' DT B 9 15433 14117 16331 -54 2821 -1133 O ATOM 1060 C5' DT B 9 37.760 -30.571 3.060 1.00 19.65 C ANISOU 1060 C5' DT B 9 15572 13704 16186 -266 2863 -1272 C ATOM 1061 C4' DT B 9 39.238 -30.692 3.330 1.00 20.21 C ANISOU 1061 C4' DT B 9 15831 13544 16298 -49 2956 -1126 C ATOM 1062 O4' DT B 9 39.486 -32.061 3.713 1.00 18.85 O ANISOU 1062 O4' DT B 9 16080 13149 15928 -214 2917 -1336 O ATOM 1063 C3' DT B 9 40.012 -30.597 2.034 1.00 30.99 C ANISOU 1063 C3' DT B 9 17210 15052 17510 309 2967 -957 C ATOM 1064 O3' DT B 9 41.396 -30.661 2.278 1.00 30.08 O ANISOU 1064 O3' DT B 9 17225 14736 17464 520 3063 -810 O ATOM 1065 C2' DT B 9 39.480 -31.851 1.351 1.00 29.50 C ANISOU 1065 C2' DT B 9 17325 14912 16968 206 2847 -1183 C ATOM 1066 C1' DT B 9 39.490 -32.825 2.523 1.00 26.03 C ANISOU 1066 C1' DT B 9 17180 14192 16512 -89 2825 -1394 C ATOM 1067 N1 DT B 9 38.317 -33.725 2.502 1.00 21.53 N ANISOU 1067 N1 DT B 9 16763 13670 15741 -406 2676 -1648 N ATOM 1068 C2 DT B 9 38.434 -34.956 3.096 1.00 32.42 C ANISOU 1068 C2 DT B 9 18536 14828 16949 -624 2595 -1856 C ATOM 1069 O2 DT B 9 39.448 -35.336 3.656 1.00 38.12 O ANISOU 1069 O2 DT B 9 19492 15302 17684 -569 2639 -1863 O ATOM 1070 N3 DT B 9 37.299 -35.724 3.011 1.00 34.91 N ANISOU 1070 N3 DT B 9 18964 15211 17084 -922 2435 -2057 N ATOM 1071 C4 DT B 9 36.103 -35.373 2.403 1.00 31.04 C ANISOU 1071 C4 DT B 9 18223 14968 16600 -1006 2358 -2068 C ATOM 1072 O4 DT B 9 35.120 -36.104 2.362 1.00 5.96 O ANISOU 1072 O4 DT B 9 15151 11826 13281 -1281 2202 -2235 O ATOM 1073 C5 DT B 9 36.059 -34.073 1.805 1.00 16.67 C ANISOU 1073 C5 DT B 9 16007 13352 14971 -759 2449 -1870 C ATOM 1074 C7 DT B 9 34.802 -33.632 1.137 1.00 5.62 C ANISOU 1074 C7 DT B 9 14338 12191 13602 -837 2347 -1898 C ATOM 1075 C6 DT B 9 37.156 -33.324 1.874 1.00 15.80 C ANISOU 1075 C6 DT B 9 15796 13195 15008 -477 2598 -1669 C ATOM 1076 P DA B 10 42.435 -30.670 1.053 1.00152.48 P ANISOU 1076 P DA B 10 20107 17687 20141 912 3121 -621 P ATOM 1077 OP1 DA B 10 43.575 -29.779 1.419 1.00143.97 O ANISOU 1077 OP1 DA B 10 18850 16504 19349 1132 3236 -331 O ATOM 1078 OP2 DA B 10 41.671 -30.439 -0.191 1.00148.36 O ANISOU 1078 OP2 DA B 10 19471 17471 19428 993 3054 -617 O ATOM 1079 O5' DA B 10 42.942 -32.184 1.014 1.00103.57 O ANISOU 1079 O5' DA B 10 14375 11314 13663 896 3084 -825 O ATOM 1080 C5' DA B 10 43.441 -32.771 2.198 1.00110.78 C ANISOU 1080 C5' DA B 10 15519 11892 14682 735 3087 -945 C ATOM 1081 C4' DA B 10 43.758 -34.233 1.960 1.00118.96 C ANISOU 1081 C4' DA B 10 17005 12811 15382 721 2991 -1171 C ATOM 1082 O4' DA B 10 42.527 -34.997 1.926 1.00131.64 O ANISOU 1082 O4' DA B 10 18773 14485 16759 418 2828 -1426 O ATOM 1083 C3' DA B 10 44.415 -34.522 0.615 1.00117.39 C ANISOU 1083 C3' DA B 10 16896 12790 14915 1090 3015 -1073 C ATOM 1084 O3' DA B 10 45.015 -35.827 0.628 1.00109.24 O ANISOU 1084 O3' DA B 10 16301 11583 13620 1122 2924 -1266 O ATOM 1085 C2' DA B 10 43.172 -34.537 -0.256 1.00119.61 C ANISOU 1085 C2' DA B 10 17120 13342 14986 1012 2905 -1141 C ATOM 1086 C1' DA B 10 42.416 -35.516 0.618 1.00125.62 C ANISOU 1086 C1' DA B 10 18147 13926 15656 615 2744 -1441 C ATOM 1087 N9 DA B 10 41.043 -35.634 0.188 1.00125.82 N ANISOU 1087 N9 DA B 10 18123 14133 15551 414 2605 -1554 N ATOM 1088 C8 DA B 10 40.363 -34.711 -0.544 1.00143.65 C ANISOU 1088 C8 DA B 10 20055 16642 17884 493 2626 -1424 C ATOM 1089 N7 DA B 10 39.130 -35.055 -0.819 1.00136.71 N ANISOU 1089 N7 DA B 10 19199 15862 16884 273 2463 -1572 N ATOM 1090 C5 DA B 10 39.009 -36.289 -0.224 1.00121.83 C ANISOU 1090 C5 DA B 10 17676 13792 14821 29 2330 -1798 C ATOM 1091 C6 DA B 10 37.926 -37.167 -0.169 1.00119.20 C ANISOU 1091 C6 DA B 10 17528 13453 14309 -282 2115 -2007 C ATOM 1092 N6 DA B 10 36.752 -36.906 -0.740 1.00117.80 N ANISOU 1092 N6 DA B 10 17174 13452 14133 -383 2009 -2022 N ATOM 1093 N1 DA B 10 38.101 -38.320 0.489 1.00126.42 N ANISOU 1093 N1 DA B 10 18821 14161 15053 -490 1993 -2200 N ATOM 1094 C2 DA B 10 39.293 -38.552 1.045 1.00123.55 C ANISOU 1094 C2 DA B 10 18639 13595 14711 -380 2083 -2199 C ATOM 1095 N3 DA B 10 40.391 -37.802 1.062 1.00111.49 N ANISOU 1095 N3 DA B 10 16955 12036 13370 -83 2289 -2012 N ATOM 1096 C4 DA B 10 40.175 -36.668 0.398 1.00116.24 C ANISOU 1096 C4 DA B 10 17174 12865 14128 109 2408 -1803 C ATOM 1097 P DG B 11 46.279 -36.157 -0.320 1.00153.66 P ANISOU 1097 P DG B 11 22205 20437 15742 3289 1823 -5352 P ATOM 1098 OP1 DG B 11 47.094 -37.194 0.355 1.00134.34 O ANISOU 1098 OP1 DG B 11 19937 17786 13319 3264 1475 -5395 O ATOM 1099 OP2 DG B 11 46.926 -34.875 -0.677 1.00162.22 O ANISOU 1099 OP2 DG B 11 23346 21597 16692 3450 2004 -5760 O ATOM 1100 O5' DG B 11 45.603 -36.729 -1.679 1.00134.48 O ANISOU 1100 O5' DG B 11 19475 17962 13659 3069 1706 -5261 O ATOM 1101 C5' DG B 11 44.505 -37.658 -1.689 1.00140.56 C ANISOU 1101 C5' DG B 11 20081 18744 14581 2892 1672 -4811 C ATOM 1102 C4' DG B 11 44.846 -39.034 -1.139 1.00140.83 C ANISOU 1102 C4' DG B 11 20218 18573 14719 2787 1341 -4693 C ATOM 1103 O4' DG B 11 43.721 -39.511 -0.362 1.00148.45 O ANISOU 1103 O4' DG B 11 21154 19634 15616 2728 1481 -4182 O ATOM 1104 C3' DG B 11 45.140 -40.114 -2.183 1.00138.70 C ANISOU 1104 C3' DG B 11 19804 18086 14811 2569 990 -4821 C ATOM 1105 O3' DG B 11 46.186 -41.009 -1.719 1.00133.06 O ANISOU 1105 O3' DG B 11 19267 17124 14168 2566 648 -4983 O ATOM 1106 C2' DG B 11 43.799 -40.831 -2.326 1.00141.04 C ANISOU 1106 C2' DG B 11 19895 18454 15240 2384 1054 -4349 C ATOM 1107 C1' DG B 11 42.898 -40.272 -1.219 1.00144.63 C ANISOU 1107 C1' DG B 11 20416 19128 15411 2508 1398 -3971 C ATOM 1108 N9 DG B 11 41.878 -39.472 -1.877 1.00139.02 N ANISOU 1108 N9 DG B 11 19473 18634 14714 2492 1695 -3832 N ATOM 1109 C8 DG B 11 41.997 -38.224 -2.439 1.00131.79 C ANISOU 1109 C8 DG B 11 18503 17849 13721 2612 1901 -4066 C ATOM 1110 N7 DG B 11 40.901 -37.805 -2.992 1.00142.86 N ANISOU 1110 N7 DG B 11 19667 19426 15186 2557 2122 -3836 N ATOM 1111 C5 DG B 11 40.012 -38.856 -2.798 1.00146.15 C ANISOU 1111 C5 DG B 11 19970 19830 15732 2383 2057 -3440 C ATOM 1112 C6 DG B 11 38.656 -38.974 -3.186 1.00152.91 C ANISOU 1112 C6 DG B 11 20556 20836 16706 2255 2216 -3065 C ATOM 1113 O6 DG B 11 37.959 -38.143 -3.814 1.00134.76 O ANISOU 1113 O6 DG B 11 18055 18714 14432 2275 2438 -2999 O ATOM 1114 N1 DG B 11 38.139 -40.208 -2.769 1.00165.68 N ANISOU 1114 N1 DG B 11 22152 22374 18424 2092 2086 -2752 N ATOM 1115 C2 DG B 11 38.828 -41.192 -2.081 1.00159.41 C ANISOU 1115 C2 DG B 11 21570 21378 17622 2060 1834 -2780 C ATOM 1116 N2 DG B 11 38.146 -42.309 -1.777 1.00150.91 N ANISOU 1116 N2 DG B 11 20439 20249 16653 1893 1755 -2441 N ATOM 1117 N3 DG B 11 40.097 -41.084 -1.720 1.00137.78 N ANISOU 1117 N3 DG B 11 19074 18496 14781 2186 1670 -3117 N ATOM 1118 C4 DG B 11 40.604 -39.895 -2.118 1.00143.46 C ANISOU 1118 C4 DG B 11 19812 19297 15399 2339 1799 -3435 C ATOM 1119 P DT B 12 46.985 -41.961 -2.759 1.00171.90 P ANISOU 1119 P DT B 12 24096 21760 19458 2385 264 -5296 P ATOM 1120 OP1 DT B 12 47.926 -42.797 -1.953 1.00179.23 O ANISOU 1120 OP1 DT B 12 25227 22461 20411 2430 -36 -5368 O ATOM 1121 OP2 DT B 12 47.533 -41.109 -3.853 1.00148.58 O ANISOU 1121 OP2 DT B 12 21068 18818 16567 2399 302 -5740 O ATOM 1122 O5' DT B 12 45.813 -42.861 -3.432 1.00136.24 O ANISOU 1122 O5' DT B 12 19321 17253 15190 2123 246 -4937 O ATOM 1123 C5' DT B 12 45.152 -43.834 -2.582 1.00142.04 C ANISOU 1123 C5' DT B 12 20087 17960 15921 2053 205 -4493 C ATOM 1124 C4' DT B 12 43.904 -44.493 -3.149 1.00143.29 C ANISOU 1124 C4' DT B 12 19997 18183 16265 1823 263 -4134 C ATOM 1125 O4' DT B 12 42.813 -43.548 -3.302 1.00142.76 O ANISOU 1125 O4' DT B 12 19787 18404 16051 1861 618 -3919 O ATOM 1126 C3' DT B 12 44.093 -45.153 -4.507 1.00152.71 C ANISOU 1126 C3' DT B 12 20986 19222 17814 1581 47 -4344 C ATOM 1127 O3' DT B 12 43.333 -46.381 -4.495 1.00170.23 O ANISOU 1127 O3' DT B 12 23091 21371 20220 1368 -45 -3992 O ATOM 1128 C2' DT B 12 43.498 -44.091 -5.430 1.00139.87 C ANISOU 1128 C2' DT B 12 19171 17823 16149 1569 289 -4405 C ATOM 1129 C1' DT B 12 42.281 -43.728 -4.593 1.00139.73 C ANISOU 1129 C1' DT B 12 19130 18049 15911 1651 596 -3934 C ATOM 1130 N1 DT B 12 41.596 -42.506 -5.060 1.00146.02 N ANISOU 1130 N1 DT B 12 19786 19104 16590 1723 902 -3901 N ATOM 1131 C2 DT B 12 40.302 -42.603 -5.518 1.00148.73 C ANISOU 1131 C2 DT B 12 19876 19614 17020 1577 1054 -3558 C ATOM 1132 O2 DT B 12 39.674 -43.646 -5.549 1.00151.93 O ANISOU 1132 O2 DT B 12 20171 19972 17583 1386 962 -3285 O ATOM 1133 N3 DT B 12 39.766 -41.414 -5.935 1.00140.98 N ANISOU 1133 N3 DT B 12 18772 18858 15937 1667 1324 -3548 N ATOM 1134 C4 DT B 12 40.386 -40.178 -5.946 1.00135.71 C ANISOU 1134 C4 DT B 12 18216 18258 15092 1878 1465 -3845 C ATOM 1135 O4 DT B 12 39.797 -39.183 -6.344 1.00137.73 O ANISOU 1135 O4 DT B 12 18340 18709 15281 1944 1712 -3791 O ATOM 1136 C5 DT B 12 41.746 -40.156 -5.455 1.00130.01 C ANISOU 1136 C5 DT B 12 17764 17357 14276 2013 1303 -4211 C ATOM 1137 C7 DT B 12 42.546 -38.892 -5.415 1.00127.90 C ANISOU 1137 C7 DT B 12 17643 17140 13813 2237 1440 -4573 C ATOM 1138 C6 DT B 12 42.274 -41.309 -5.048 1.00150.04 C ANISOU 1138 C6 DT B 12 20413 19679 16918 1930 1025 -4218 C ATOM 1139 P DA B 13 43.936 -47.738 -5.141 1.00162.26 P ANISOU 1139 P DA B 13 22022 20048 19582 1137 -400 -4154 P ATOM 1140 OP1 DA B 13 43.123 -48.881 -4.633 1.00176.15 O ANISOU 1140 OP1 DA B 13 23745 21762 21423 995 -432 -3716 O ATOM 1141 OP2 DA B 13 45.408 -47.741 -4.919 1.00151.33 O ANISOU 1141 OP2 DA B 13 20836 18435 18226 1267 -635 -4565 O ATOM 1142 O5' DA B 13 43.706 -47.542 -6.721 1.00152.46 O ANISOU 1142 O5' DA B 13 20516 18850 18560 921 -390 -4366 O ATOM 1143 C5' DA B 13 42.495 -46.975 -7.186 1.00153.91 C ANISOU 1143 C5' DA B 13 20496 19310 18674 854 -132 -4116 C ATOM 1144 C4' DA B 13 41.297 -47.809 -6.776 1.00146.66 C ANISOU 1144 C4' DA B 13 19469 18463 17793 718 -57 -3615 C ATOM 1145 O4' DA B 13 40.187 -46.941 -6.459 1.00140.42 O ANISOU 1145 O4' DA B 13 18596 17977 16780 818 269 -3303 O ATOM 1146 C3' DA B 13 40.766 -48.716 -7.880 1.00141.79 C ANISOU 1146 C3' DA B 13 18597 17794 17484 383 -165 -3558 C ATOM 1147 O3' DA B 13 39.973 -49.766 -7.341 1.00140.15 O ANISOU 1147 O3' DA B 13 18349 17558 17342 259 -167 -3153 O ATOM 1148 C2' DA B 13 39.915 -47.752 -8.691 1.00136.24 C ANISOU 1148 C2' DA B 13 17677 17372 16716 345 62 -3499 C ATOM 1149 C1' DA B 13 39.485 -46.706 -7.658 1.00136.76 C ANISOU 1149 C1' DA B 13 17855 17655 16450 635 343 -3290 C ATOM 1150 N9 DA B 13 39.787 -45.378 -8.165 1.00137.60 N ANISOU 1150 N9 DA B 13 17954 17898 16431 778 475 -3556 N ATOM 1151 C8 DA B 13 41.003 -44.796 -8.392 1.00143.77 C ANISOU 1151 C8 DA B 13 18887 18566 17174 901 377 -4012 C ATOM 1152 N7 DA B 13 40.912 -43.588 -8.891 1.00147.09 N ANISOU 1152 N7 DA B 13 19252 19160 17475 1001 557 -4148 N ATOM 1153 C5 DA B 13 39.544 -43.383 -9.003 1.00146.95 C ANISOU 1153 C5 DA B 13 19021 19383 17431 941 775 -3744 C ATOM 1154 C6 DA B 13 38.764 -42.305 -9.471 1.00158.74 C ANISOU 1154 C6 DA B 13 20350 21130 18832 996 1026 -3635 C ATOM 1155 N6 DA B 13 39.349 -41.187 -9.925 1.00169.65 N ANISOU 1155 N6 DA B 13 21788 22558 20115 1131 1101 -3959 N ATOM 1156 N1 DA B 13 37.406 -42.433 -9.444 1.00149.61 N ANISOU 1156 N1 DA B 13 18978 20167 17701 910 1192 -3194 N ATOM 1157 C2 DA B 13 36.877 -43.578 -8.980 1.00138.33 C ANISOU 1157 C2 DA B 13 17512 18677 16369 769 1118 -2897 C ATOM 1158 N3 DA B 13 37.518 -44.652 -8.521 1.00135.89 N ANISOU 1158 N3 DA B 13 17357 18132 16142 704 894 -2961 N ATOM 1159 C4 DA B 13 38.845 -44.479 -8.561 1.00136.70 C ANISOU 1159 C4 DA B 13 17660 18052 16229 801 728 -3387 C TER 1160 DA B 13 ATOM 1161 O5' DC C 14 36.066 -33.027 -14.286 1.00132.58 O ANISOU 1161 O5' DC C 14 16178 19174 15021 1661 2506 -3802 O ATOM 1162 C5' DC C 14 35.489 -33.438 -15.518 1.00130.00 C ANISOU 1162 C5' DC C 14 15602 18907 14885 1371 2327 -3695 C ATOM 1163 C4' DC C 14 34.852 -34.811 -15.394 1.00135.86 C ANISOU 1163 C4' DC C 14 16195 19632 15793 1132 2156 -3406 C ATOM 1164 O4' DC C 14 35.819 -35.866 -15.629 1.00137.27 O ANISOU 1164 O4' DC C 14 16518 19576 16064 935 1849 -3722 O ATOM 1165 C3' DC C 14 34.322 -35.141 -14.016 1.00136.60 C ANISOU 1165 C3' DC C 14 16322 19760 15819 1285 2327 -3082 C ATOM 1166 O3' DC C 14 33.054 -34.596 -13.955 1.00134.01 O ANISOU 1166 O3' DC C 14 15750 19661 15508 1349 2565 -2670 O ATOM 1167 C2' DC C 14 34.237 -36.664 -14.060 1.00139.39 C ANISOU 1167 C2' DC C 14 16625 19996 16339 1009 2063 -2993 C ATOM 1168 C1' DC C 14 35.443 -37.037 -14.912 1.00143.77 C ANISOU 1168 C1' DC C 14 17315 20344 16967 843 1772 -3470 C ATOM 1169 N1 DC C 14 36.577 -37.513 -14.088 1.00125.45 N ANISOU 1169 N1 DC C 14 15290 17795 14580 942 1665 -3748 N ATOM 1170 C2 DC C 14 37.609 -36.643 -13.739 1.00157.14 C ANISOU 1170 C2 DC C 14 19554 21733 18419 1185 1743 -4106 C ATOM 1171 O2 DC C 14 37.565 -35.476 -14.121 1.00164.46 O ANISOU 1171 O2 DC C 14 20463 22779 19247 1317 1916 -4192 O ATOM 1172 N3 DC C 14 38.639 -37.098 -12.991 1.00132.14 N ANISOU 1172 N3 DC C 14 16644 18364 15199 1271 1627 -4352 N ATOM 1173 C4 DC C 14 38.650 -38.365 -12.592 1.00124.48 C ANISOU 1173 C4 DC C 14 15689 17261 14349 1129 1440 -4237 C ATOM 1174 N4 DC C 14 39.685 -38.774 -11.848 1.00124.14 N ANISOU 1174 N4 DC C 14 15897 17016 14256 1226 1315 -4472 N ATOM 1175 C5 DC C 14 37.595 -39.257 -12.944 1.00126.37 C ANISOU 1175 C5 DC C 14 15680 17569 14765 881 1375 -3873 C ATOM 1176 C6 DC C 14 36.590 -38.804 -13.685 1.00126.77 C ANISOU 1176 C6 DC C 14 15476 17829 14863 792 1489 -3645 C ATOM 1177 P DT C 15 32.427 -34.169 -12.541 1.00159.39 P ANISOU 1177 P DT C 15 19000 22973 18586 1616 2906 -2359 P ATOM 1178 OP1 DT C 15 31.278 -33.257 -12.813 1.00159.80 O ANISOU 1178 OP1 DT C 15 18784 23255 18677 1699 3162 -2038 O ATOM 1179 OP2 DT C 15 33.542 -33.730 -11.665 1.00169.07 O ANISOU 1179 OP2 DT C 15 20567 24070 19602 1852 2987 -2675 O ATOM 1180 O5' DT C 15 31.885 -35.557 -11.932 1.00141.10 O ANISOU 1180 O5' DT C 15 16632 20612 16369 1443 2796 -2071 O ATOM 1181 C5' DT C 15 30.849 -36.308 -12.581 1.00145.41 C ANISOU 1181 C5' DT C 15 16875 21257 17119 1180 2690 -1761 C ATOM 1182 C4' DT C 15 30.932 -37.780 -12.219 1.00148.32 C ANISOU 1182 C4' DT C 15 17297 21482 17577 977 2479 -1699 C ATOM 1183 O4' DT C 15 32.332 -38.150 -12.275 1.00144.74 O ANISOU 1183 O4' DT C 15 17118 20794 17084 960 2246 -2133 O ATOM 1184 C3' DT C 15 30.460 -38.162 -10.810 1.00152.90 C ANISOU 1184 C3' DT C 15 17964 22062 18068 1092 2661 -1411 C ATOM 1185 O3' DT C 15 29.126 -38.766 -10.767 1.00161.65 O ANISOU 1185 O3' DT C 15 18802 23305 19314 936 2730 -973 O ATOM 1186 C2' DT C 15 31.522 -39.138 -10.300 1.00151.68 C ANISOU 1186 C2' DT C 15 18092 21658 17883 1042 2428 -1647 C ATOM 1187 C1' DT C 15 32.532 -39.260 -11.429 1.00147.10 C ANISOU 1187 C1' DT C 15 17557 20944 17393 904 2141 -2065 C ATOM 1188 N1 DT C 15 33.883 -39.223 -10.849 1.00147.68 N ANISOU 1188 N1 DT C 15 17965 20812 17333 1055 2049 -2434 N ATOM 1189 C2 DT C 15 34.422 -40.421 -10.421 1.00148.89 C ANISOU 1189 C2 DT C 15 18264 20759 17550 943 1827 -2494 C ATOM 1190 O2 DT C 15 33.845 -41.493 -10.523 1.00151.13 O ANISOU 1190 O2 DT C 15 18417 21016 17988 722 1714 -2269 O ATOM 1191 N3 DT C 15 35.674 -40.302 -9.879 1.00145.32 N ANISOU 1191 N3 DT C 15 18111 20128 16976 1100 1741 -2834 N ATOM 1192 C4 DT C 15 36.400 -39.138 -9.721 1.00142.44 C ANISOU 1192 C4 DT C 15 17911 19781 16429 1344 1867 -3116 C ATOM 1193 O4 DT C 15 37.516 -39.123 -9.227 1.00129.95 O ANISOU 1193 O4 DT C 15 16589 18039 14749 1467 1773 -3418 O ATOM 1194 C5 DT C 15 35.768 -37.928 -10.182 1.00133.19 C ANISOU 1194 C5 DT C 15 16584 18828 15196 1447 2117 -3037 C ATOM 1195 C7 DT C 15 36.496 -36.622 -10.044 1.00128.51 C ANISOU 1195 C7 DT C 15 16159 18260 14407 1707 2283 -3336 C ATOM 1196 C6 DT C 15 34.540 -38.012 -10.721 1.00139.82 C ANISOU 1196 C6 DT C 15 17124 19838 16162 1304 2193 -2694 C ATOM 1197 P DA C 16 28.578 -39.451 -9.398 1.00184.66 P ANISOU 1197 P DA C 16 21800 26195 22169 973 2877 -664 P ATOM 1198 OP1 DA C 16 27.120 -39.185 -9.295 1.00178.67 O ANISOU 1198 OP1 DA C 16 20746 25654 21486 964 3129 -240 O ATOM 1199 OP2 DA C 16 29.457 -39.022 -8.273 1.00189.70 O ANISOU 1199 OP2 DA C 16 22784 26721 22574 1227 2988 -846 O ATOM 1200 O5' DA C 16 28.840 -41.019 -9.627 1.00160.86 O ANISOU 1200 O5' DA C 16 18814 23009 19298 684 2556 -694 O ATOM 1201 C5' DA C 16 30.133 -41.521 -9.342 1.00155.95 C ANISOU 1201 C5' DA C 16 18494 22144 18614 701 2339 -1023 C ATOM 1202 C4' DA C 16 30.140 -42.642 -8.332 1.00153.36 C ANISOU 1202 C4' DA C 16 18326 21676 18270 646 2284 -870 C ATOM 1203 O4' DA C 16 31.545 -42.899 -8.096 1.00154.76 O ANISOU 1203 O4' DA C 16 18804 21617 18379 710 2070 -1239 O ATOM 1204 C3' DA C 16 29.479 -42.417 -6.973 1.00152.42 C ANISOU 1204 C3' DA C 16 18293 21634 17985 816 2582 -559 C ATOM 1205 O3' DA C 16 28.722 -43.613 -6.678 1.00149.05 O ANISOU 1205 O3' DA C 16 17781 21180 17671 610 2540 -256 O ATOM 1206 C2' DA C 16 30.661 -42.171 -6.014 1.00154.82 C ANISOU 1206 C2' DA C 16 18976 21779 18070 1033 2562 -810 C ATOM 1207 C1' DA C 16 31.949 -42.494 -6.794 1.00154.14 C ANISOU 1207 C1' DA C 16 19003 21497 18065 962 2224 -1239 C ATOM 1208 N9 DA C 16 32.972 -41.423 -6.876 1.00146.06 N ANISOU 1208 N9 DA C 16 18150 20449 16895 1180 2245 -1610 N ATOM 1209 C8 DA C 16 32.802 -40.141 -7.342 1.00148.02 C ANISOU 1209 C8 DA C 16 18298 20864 17081 1320 2442 -1687 C ATOM 1210 N7 DA C 16 33.890 -39.392 -7.300 1.00137.27 N ANISOU 1210 N7 DA C 16 17144 19431 15582 1499 2427 -2056 N ATOM 1211 C5 DA C 16 34.863 -40.240 -6.785 1.00137.17 C ANISOU 1211 C5 DA C 16 17378 19192 15549 1477 2189 -2239 C ATOM 1212 C6 DA C 16 36.242 -40.077 -6.491 1.00135.49 C ANISOU 1212 C6 DA C 16 17447 18807 15226 1609 2048 -2635 C ATOM 1213 N6 DA C 16 36.959 -38.965 -6.665 1.00133.36 N ANISOU 1213 N6 DA C 16 17283 18564 14824 1795 2136 -2956 N ATOM 1214 N1 DA C 16 36.902 -41.135 -5.989 1.00146.10 N ANISOU 1214 N1 DA C 16 18967 19938 16605 1544 1804 -2700 N ATOM 1215 C2 DA C 16 36.236 -42.279 -5.789 1.00149.14 C ANISOU 1215 C2 DA C 16 19266 20279 17120 1358 1716 -2391 C ATOM 1216 N3 DA C 16 34.949 -42.553 -6.020 1.00145.05 N ANISOU 1216 N3 DA C 16 18499 19910 16704 1216 1843 -2019 N ATOM 1217 C4 DA C 16 34.311 -41.488 -6.523 1.00144.72 C ANISOU 1217 C4 DA C 16 18272 20083 16630 1285 2074 -1962 C ATOM 1218 P DC C 17 27.974 -43.797 -5.253 1.00178.43 P ANISOU 1218 P DC C 17 21602 24939 21253 695 2804 96 P ATOM 1219 OP1 DC C 17 26.858 -44.765 -5.448 1.00187.61 O ANISOU 1219 OP1 DC C 17 22530 26158 22594 446 2804 424 O ATOM 1220 OP2 DC C 17 27.697 -42.451 -4.683 1.00170.70 O ANISOU 1220 OP2 DC C 17 20646 24117 20095 957 3143 149 O ATOM 1221 O5' DC C 17 29.107 -44.433 -4.309 1.00159.19 O ANISOU 1221 O5' DC C 17 19556 22253 18675 761 2635 -75 O ATOM 1222 C5' DC C 17 29.954 -45.502 -4.751 1.00162.77 C ANISOU 1222 C5' DC C 17 20101 22484 19262 597 2275 -282 C ATOM 1223 C4' DC C 17 31.179 -45.579 -3.859 1.00165.30 C ANISOU 1223 C4' DC C 17 20796 22605 19407 761 2157 -504 C ATOM 1224 O4' DC C 17 32.117 -44.512 -4.213 1.00161.76 O ANISOU 1224 O4' DC C 17 20438 22162 18863 949 2140 -871 O ATOM 1225 C3' DC C 17 30.880 -45.413 -2.361 1.00163.53 C ANISOU 1225 C3' DC C 17 20790 22408 18937 916 2393 -267 C ATOM 1226 O3' DC C 17 31.577 -46.377 -1.537 1.00166.22 O ANISOU 1226 O3' DC C 17 21416 22523 19219 895 2194 -282 O ATOM 1227 C2' DC C 17 31.391 -43.993 -2.122 1.00160.41 C ANISOU 1227 C2' DC C 17 20506 22110 18332 1186 2574 -477 C ATOM 1228 C1' DC C 17 32.649 -44.051 -2.982 1.00158.56 C ANISOU 1228 C1' DC C 17 20333 21719 18192 1178 2258 -908 C ATOM 1229 N1 DC C 17 33.432 -42.742 -3.081 1.00148.93 N ANISOU 1229 N1 DC C 17 19219 20554 16813 1414 2349 -1231 N ATOM 1230 C2 DC C 17 34.755 -42.661 -2.593 1.00144.59 C ANISOU 1230 C2 DC C 17 18972 19839 16126 1554 2191 -1550 C ATOM 1231 O2 DC C 17 35.320 -43.641 -2.096 1.00145.49 O ANISOU 1231 O2 DC C 17 19266 19756 16255 1495 1961 -1568 O ATOM 1232 N3 DC C 17 35.415 -41.484 -2.679 1.00142.52 N ANISOU 1232 N3 DC C 17 18799 19634 15719 1758 2295 -1841 N ATOM 1233 C4 DC C 17 34.819 -40.422 -3.211 1.00141.65 C ANISOU 1233 C4 DC C 17 18499 19723 15599 1828 2543 -1816 C ATOM 1234 N4 DC C 17 35.530 -39.298 -3.261 1.00142.65 N ANISOU 1234 N4 DC C 17 18735 19886 15577 2028 2645 -2116 N ATOM 1235 C5 DC C 17 33.484 -40.458 -3.706 1.00142.88 C ANISOU 1235 C5 DC C 17 18343 20045 15900 1700 2697 -1484 C ATOM 1236 C6 DC C 17 32.838 -41.629 -3.621 1.00144.90 C ANISOU 1236 C6 DC C 17 18507 20253 16295 1493 2592 -1207 C ATOM 1237 P DT C 18 32.047 -45.975 -0.045 1.00199.73 P ANISOU 1237 P DT C 18 24175 24819 26894 -2499 3344 -4480 P ATOM 1238 OP1 DT C 18 30.863 -46.084 0.859 1.00181.96 O ANISOU 1238 OP1 DT C 18 22309 22075 24752 -3489 4034 -4687 O ATOM 1239 OP2 DT C 18 32.845 -44.725 -0.143 1.00211.44 O ANISOU 1239 OP2 DT C 18 24724 27038 28578 -1867 2968 -4185 O ATOM 1240 O5' DT C 18 33.076 -47.146 0.386 1.00193.53 O ANISOU 1240 O5' DT C 18 24821 23356 25357 -1975 3073 -4291 O ATOM 1241 C5' DT C 18 33.747 -47.016 1.674 1.00182.90 C ANISOU 1241 C5' DT C 18 24261 21636 23598 -1788 3114 -4001 C ATOM 1242 C4' DT C 18 35.170 -46.488 1.515 1.00160.49 C ANISOU 1242 C4' DT C 18 21173 19236 20571 -773 2490 -3623 C ATOM 1243 O4' DT C 18 35.278 -45.379 0.573 1.00150.08 O ANISOU 1243 O4' DT C 18 18394 18842 19785 -434 2187 -3579 O ATOM 1244 C3' DT C 18 35.765 -45.922 2.785 1.00153.49 C ANISOU 1244 C3' DT C 18 20684 18189 19447 -600 2531 -3322 C ATOM 1245 O3' DT C 18 36.202 -46.982 3.576 1.00158.28 O ANISOU 1245 O3' DT C 18 22729 17995 19414 -528 2587 -3248 O ATOM 1246 C2' DT C 18 36.940 -45.095 2.287 1.00150.09 C ANISOU 1246 C2' DT C 18 19496 18451 19081 334 1911 -3005 C ATOM 1247 C1' DT C 18 36.446 -44.641 0.907 1.00148.94 C ANISOU 1247 C1' DT C 18 18059 19026 19506 320 1774 -3197 C ATOM 1248 N1 DT C 18 36.137 -43.193 0.835 1.00147.53 N ANISOU 1248 N1 DT C 18 16567 19578 19909 216 1831 -3152 N ATOM 1249 C2 DT C 18 37.126 -42.298 1.184 1.00160.23 C ANISOU 1249 C2 DT C 18 17821 21566 21492 856 1481 -2800 C ATOM 1250 O2 DT C 18 38.241 -42.626 1.564 1.00169.17 O ANISOU 1250 O2 DT C 18 19663 22463 22150 1501 1130 -2522 O ATOM 1251 N3 DT C 18 36.758 -40.985 1.078 1.00145.42 N ANISOU 1251 N3 DT C 18 14717 20364 20172 713 1559 -2784 N ATOM 1252 C4 DT C 18 35.545 -40.481 0.667 1.00143.86 C ANISOU 1252 C4 DT C 18 13631 20501 20528 21 1941 -3075 C ATOM 1253 O4 DT C 18 35.335 -39.279 0.606 1.00140.86 O ANISOU 1253 O4 DT C 18 12176 20737 20606 -33 1973 -3026 O ATOM 1254 C5 DT C 18 34.555 -41.464 0.315 1.00133.57 C ANISOU 1254 C5 DT C 18 12753 18773 19225 -624 2293 -3436 C ATOM 1255 C7 DT C 18 33.197 -41.018 -0.149 1.00133.03 C ANISOU 1255 C7 DT C 18 11784 19020 19741 -1404 2722 -3775 C ATOM 1256 C6 DT C 18 34.889 -42.763 0.415 1.00138.42 C ANISOU 1256 C6 DT C 18 14570 18715 19308 -502 2222 -3459 C ATOM 1257 P DA C 19 36.041 -46.894 5.172 1.00182.47 P ANISOU 1257 P DA C 19 26638 20472 22222 -931 3027 -3149 P ATOM 1258 OP1 DA C 19 35.883 -48.278 5.700 1.00193.66 O ANISOU 1258 OP1 DA C 19 29490 20982 23109 -1215 3287 -3268 O ATOM 1259 OP2 DA C 19 34.986 -45.890 5.462 1.00175.12 O ANISOU 1259 OP2 DA C 19 24837 19847 21853 -1625 3471 -3277 O ATOM 1260 O5' DA C 19 37.433 -46.247 5.656 1.00174.20 O ANISOU 1260 O5' DA C 19 25615 19664 20911 -54 2548 -2727 O ATOM 1261 C5' DA C 19 38.562 -46.065 4.779 1.00162.65 C ANISOU 1261 C5' DA C 19 23696 18716 19387 869 1880 -2511 C ATOM 1262 C4' DA C 19 39.350 -44.870 5.292 1.00154.03 C ANISOU 1262 C4' DA C 19 22061 18070 18394 1369 1619 -2179 C ATOM 1263 O4' DA C 19 38.891 -43.642 4.665 1.00142.89 O ANISOU 1263 O4' DA C 19 19157 17475 17659 1255 1600 -2222 O ATOM 1264 C3' DA C 19 39.252 -44.626 6.808 1.00149.71 C ANISOU 1264 C3' DA C 19 22200 17041 17640 1046 1988 -2071 C ATOM 1265 O3' DA C 19 40.574 -44.627 7.400 1.00148.70 O ANISOU 1265 O3' DA C 19 22683 16774 17044 1821 1585 -1724 O ATOM 1266 C2' DA C 19 38.534 -43.273 6.907 1.00145.70 C ANISOU 1266 C2' DA C 19 20487 17109 17763 634 2225 -2105 C ATOM 1267 C1' DA C 19 39.125 -42.655 5.650 1.00144.60 C ANISOU 1267 C1' DA C 19 19183 17808 17950 1287 1672 -2004 C ATOM 1268 N9 DA C 19 38.559 -41.394 5.176 1.00143.73 N ANISOU 1268 N9 DA C 19 17629 18468 18513 1074 1734 -2059 N ATOM 1269 C8 DA C 19 39.213 -40.184 5.109 1.00144.29 C ANISOU 1269 C8 DA C 19 16767 19203 18853 1593 1392 -1799 C ATOM 1270 N7 DA C 19 38.486 -39.205 4.630 1.00134.67 N ANISOU 1270 N7 DA C 19 14312 18612 18243 1259 1539 -1920 N ATOM 1271 C5 DA C 19 37.282 -39.833 4.356 1.00135.96 C ANISOU 1271 C5 DA C 19 14617 18500 18542 473 2001 -2284 C ATOM 1272 C6 DA C 19 36.092 -39.335 3.826 1.00135.78 C ANISOU 1272 C6 DA C 19 13646 18861 19084 -187 2350 -2566 C ATOM 1273 N6 DA C 19 35.946 -38.059 3.481 1.00132.51 N ANISOU 1273 N6 DA C 19 11940 19213 19195 -140 2282 -2516 N ATOM 1274 N1 DA C 19 35.070 -40.210 3.677 1.00142.40 N ANISOU 1274 N1 DA C 19 14933 19256 19918 -892 2772 -2899 N ATOM 1275 C2 DA C 19 35.235 -41.499 4.031 1.00147.25 C ANISOU 1275 C2 DA C 19 16858 19094 19996 -928 2838 -2945 C ATOM 1276 N3 DA C 19 36.311 -42.086 4.539 1.00140.42 N ANISOU 1276 N3 DA C 19 16987 17808 18559 -344 2541 -2702 N ATOM 1277 C4 DA C 19 37.296 -41.182 4.674 1.00139.17 C ANISOU 1277 C4 DA C 19 16340 18111 18426 341 2128 -2377 C ATOM 1278 P DG C 20 40.750 -44.757 9.007 1.00170.04 P ANISOU 1278 P DG C 20 26499 18791 19318 1664 1883 -1588 P ATOM 1279 OP1 DG C 20 41.985 -45.535 9.278 1.00176.74 O ANISOU 1279 OP1 DG C 20 28400 19243 19511 2392 1492 -1363 O ATOM 1280 OP2 DG C 20 39.458 -45.199 9.578 1.00169.62 O ANISOU 1280 OP2 DG C 20 26915 18203 19329 693 2569 -1880 O ATOM 1281 O5' DG C 20 40.936 -43.236 9.493 1.00155.90 O ANISOU 1281 O5' DG C 20 23764 17557 17912 1801 1812 -1372 O ATOM 1282 C5' DG C 20 41.516 -42.286 8.572 1.00149.62 C ANISOU 1282 C5' DG C 20 21721 17627 17502 2389 1311 -1212 C ATOM 1283 C4' DG C 20 41.222 -40.837 8.959 1.00141.05 C ANISOU 1283 C4' DG C 20 19603 17073 16918 2217 1419 -1119 C ATOM 1284 O4' DG C 20 40.182 -40.237 8.154 1.00133.62 O ANISOU 1284 O4' DG C 20 17483 16681 16606 1697 1639 -1356 O ATOM 1285 C3' DG C 20 40.788 -40.656 10.397 1.00140.16 C ANISOU 1285 C3' DG C 20 20141 16447 16667 1718 1888 -1101 C ATOM 1286 O3' DG C 20 41.799 -39.897 11.035 1.00146.41 O ANISOU 1286 O3' DG C 20 20871 17411 17348 2335 1548 -763 O ATOM 1287 C2' DG C 20 39.432 -39.963 10.294 1.00137.21 C ANISOU 1287 C2' DG C 20 18883 16371 16881 879 2378 -1342 C ATOM 1288 C1' DG C 20 39.439 -39.328 8.924 1.00132.44 C ANISOU 1288 C1' DG C 20 16913 16627 16783 1135 2047 -1383 C ATOM 1289 N9 DG C 20 38.106 -39.317 8.353 1.00142.26 N ANISOU 1289 N9 DG C 20 17560 18025 18468 345 2477 -1725 N ATOM 1290 C8 DG C 20 37.229 -40.373 8.393 1.00138.77 C ANISOU 1290 C8 DG C 20 17858 16991 17877 -305 2911 -2016 C ATOM 1291 N7 DG C 20 36.093 -40.113 7.791 1.00138.38 N ANISOU 1291 N7 DG C 20 17020 17239 18319 -943 3233 -2296 N ATOM 1292 C5 DG C 20 36.227 -38.805 7.315 1.00136.23 C ANISOU 1292 C5 DG C 20 15402 17817 18543 -696 3002 -2186 C ATOM 1293 C6 DG C 20 35.318 -37.985 6.582 1.00129.06 C ANISOU 1293 C6 DG C 20 13207 17556 18272 -1123 3178 -2380 C ATOM 1294 O6 DG C 20 34.168 -38.251 6.184 1.00131.45 O ANISOU 1294 O6 DG C 20 13280 17816 18848 -1833 3581 -2700 O ATOM 1295 N1 DG C 20 35.873 -36.736 6.312 1.00128.11 N ANISOU 1295 N1 DG C 20 11991 18201 18484 -633 2829 -2163 N ATOM 1296 C2 DG C 20 37.129 -36.328 6.699 1.00137.60 C ANISOU 1296 C2 DG C 20 13311 19520 19450 156 2368 -1806 C ATOM 1297 N2 DG C 20 37.461 -35.078 6.342 1.00142.63 N ANISOU 1297 N2 DG C 20 12754 20939 20501 515 2092 -1645 N ATOM 1298 N3 DG C 20 37.985 -37.082 7.387 1.00139.80 N ANISOU 1298 N3 DG C 20 14783 19196 19137 560 2195 -1623 N ATOM 1299 C4 DG C 20 37.472 -38.304 7.659 1.00140.93 C ANISOU 1299 C4 DG C 20 16015 18597 18935 101 2533 -1830 C ATOM 1300 P DC C 21 41.420 -38.828 12.179 1.00168.31 P ANISOU 1300 P DC C 21 23392 20218 20339 1985 1860 -667 P ATOM 1301 OP1 DC C 21 42.691 -38.258 12.710 1.00144.19 O ANISOU 1301 OP1 DC C 21 20413 17294 17079 2783 1392 -303 O ATOM 1302 OP2 DC C 21 40.480 -39.486 13.125 1.00138.67 O ANISOU 1302 OP2 DC C 21 20605 15708 16375 1200 2497 -865 O ATOM 1303 O5' DC C 21 40.587 -37.707 11.382 1.00131.29 O ANISOU 1303 O5' DC C 21 17133 16351 16401 1616 1961 -797 O ATOM 1304 C5' DC C 21 41.180 -36.637 10.661 1.00122.60 C ANISOU 1304 C5' DC C 21 14799 16093 15690 2177 1493 -617 C ATOM 1305 C4' DC C 21 40.384 -35.398 11.038 1.00119.53 C ANISOU 1305 C4' DC C 21 13479 16117 15820 1670 1809 -648 C ATOM 1306 O4' DC C 21 39.140 -35.490 10.307 1.00120.30 O ANISOU 1306 O4' DC C 21 12990 16404 16316 952 2193 -984 O ATOM 1307 C3' DC C 21 40.036 -35.290 12.535 1.00122.13 C ANISOU 1307 C3' DC C 21 14591 15874 15938 1236 2235 -601 C ATOM 1308 O3' DC C 21 40.208 -33.949 13.041 1.00117.59 O ANISOU 1308 O3' DC C 21 13252 15756 15670 1362 2155 -397 O ATOM 1309 C2' DC C 21 38.587 -35.743 12.560 1.00125.86 C ANISOU 1309 C2' DC C 21 15208 16042 16572 253 2883 -948 C ATOM 1310 C1' DC C 21 38.073 -35.292 11.202 1.00127.99 C ANISOU 1310 C1' DC C 21 14173 17059 17397 129 2799 -1125 C ATOM 1311 N1 DC C 21 36.895 -36.064 10.730 1.00126.30 N ANISOU 1311 N1 DC C 21 14101 16593 17294 -625 3252 -1489 N ATOM 1312 C2 DC C 21 35.847 -35.390 10.103 1.00142.32 C ANISOU 1312 C2 DC C 21 15007 19156 19911 -1183 3519 -1705 C ATOM 1313 O2 DC C 21 35.941 -34.166 9.950 1.00150.96 O ANISOU 1313 O2 DC C 21 15021 20929 21409 -1025 3370 -1584 O ATOM 1314 N3 DC C 21 34.768 -36.092 9.681 1.00127.54 N ANISOU 1314 N3 DC C 21 13263 17047 18151 -1875 3929 -2041 N ATOM 1315 C4 DC C 21 34.728 -37.405 9.875 1.00133.13 C ANISOU 1315 C4 DC C 21 15158 17015 18410 -2010 4069 -2155 C ATOM 1316 N4 DC C 21 33.647 -38.057 9.437 1.00149.32 N ANISOU 1316 N4 DC C 21 17280 18851 20606 -2697 4466 -2489 N ATOM 1317 C5 DC C 21 35.792 -38.103 10.524 1.00135.49 C ANISOU 1317 C5 DC C 21 16619 16764 18097 -1446 3807 -1936 C ATOM 1318 C6 DC C 21 36.852 -37.406 10.935 1.00131.96 C ANISOU 1318 C6 DC C 21 16040 16559 17540 -764 3404 -1608 C ATOM 1319 P DC C 22 40.276 -33.658 14.632 1.00134.89 P ANISOU 1319 P DC C 22 15383 18812 17058 2006 2023 -116 P ATOM 1320 OP1 DC C 22 41.392 -32.721 14.881 1.00138.08 O ANISOU 1320 OP1 DC C 22 15702 19550 17212 2026 1881 -109 O ATOM 1321 OP2 DC C 22 40.220 -34.949 15.348 1.00124.56 O ANISOU 1321 OP2 DC C 22 14077 17532 15717 2061 2237 228 O ATOM 1322 O5' DC C 22 38.911 -32.896 14.927 1.00120.40 O ANISOU 1322 O5' DC C 22 13476 16957 15312 1819 1997 -492 O ATOM 1323 C5' DC C 22 38.357 -32.065 13.931 1.00123.23 C ANISOU 1323 C5' DC C 22 13888 17066 15866 1759 1836 -863 C ATOM 1324 C4' DC C 22 37.011 -31.626 14.440 1.00122.67 C ANISOU 1324 C4' DC C 22 13728 16991 15890 1588 1867 -1140 C ATOM 1325 O4' DC C 22 35.977 -32.306 13.689 1.00119.58 O ANISOU 1325 O4' DC C 22 13435 16162 15839 1579 1916 -1238 O ATOM 1326 C3' DC C 22 36.791 -32.014 15.893 1.00122.69 C ANISOU 1326 C3' DC C 22 13611 17301 15704 1527 2051 -957 C ATOM 1327 O3' DC C 22 36.130 -30.925 16.521 1.00121.18 O ANISOU 1327 O3' DC C 22 13299 17304 15440 1365 2005 -1249 O ATOM 1328 C2' DC C 22 35.923 -33.266 15.766 1.00119.72 C ANISOU 1328 C2' DC C 22 13302 16609 15578 1542 2232 -844 C ATOM 1329 C1' DC C 22 35.055 -32.854 14.589 1.00119.85 C ANISOU 1329 C1' DC C 22 13387 16231 15918 1492 2100 -1192 C ATOM 1330 N1 DC C 22 34.284 -33.950 13.942 1.00125.96 N ANISOU 1330 N1 DC C 22 14270 16581 17010 1524 2197 -1147 N ATOM 1331 C2 DC C 22 33.231 -33.578 13.107 1.00131.30 C ANISOU 1331 C2 DC C 22 14982 16913 17992 1444 2088 -1486 C ATOM 1332 O2 DC C 22 33.023 -32.379 12.936 1.00136.42 O ANISOU 1332 O2 DC C 22 15576 17628 18630 1360 1924 -1794 O ATOM 1333 N3 DC C 22 32.483 -34.517 12.503 1.00126.76 N ANISOU 1333 N3 DC C 22 14502 15942 17717 1462 2156 -1469 N ATOM 1334 C4 DC C 22 32.766 -35.795 12.742 1.00132.82 C ANISOU 1334 C4 DC C 22 15328 16663 18475 1555 2343 -1124 C ATOM 1335 N4 DC C 22 32.007 -36.713 12.136 1.00136.59 N ANISOU 1335 N4 DC C 22 15902 16743 19254 1567 2408 -1116 N ATOM 1336 C5 DC C 22 33.831 -36.200 13.606 1.00131.53 C ANISOU 1336 C5 DC C 22 15127 16850 17997 1641 2465 -771 C ATOM 1337 C6 DC C 22 34.565 -35.255 14.189 1.00102.89 C ANISOU 1337 C6 DC C 22 11404 13609 14080 1622 2381 -794 C ATOM 1338 P DA C 23 36.044 -30.840 18.121 1.00128.83 P ANISOU 1338 P DA C 23 14141 18679 16129 1274 2148 -1133 P ATOM 1339 OP1 DA C 23 37.179 -30.014 18.593 1.00106.25 O ANISOU 1339 OP1 DA C 23 11221 16212 12937 1289 2024 -1079 O ATOM 1340 OP2 DA C 23 35.848 -32.213 18.633 1.00143.93 O ANISOU 1340 OP2 DA C 23 16089 20525 18072 1329 2375 -819 O ATOM 1341 O5' DA C 23 34.689 -30.023 18.378 1.00103.67 O ANISOU 1341 O5' DA C 23 10870 15441 13080 1089 2155 -1516 O ATOM 1342 C5' DA C 23 34.659 -28.603 18.342 1.00102.30 C ANISOU 1342 C5' DA C 23 10627 15421 12823 990 1987 -1832 C ATOM 1343 C4' DA C 23 33.368 -28.159 17.689 1.00101.22 C ANISOU 1343 C4' DA C 23 10478 14963 13017 886 1940 -2203 C ATOM 1344 O4' DA C 23 33.026 -29.211 16.760 1.00100.97 O ANISOU 1344 O4' DA C 23 10557 14518 13288 974 1976 -2120 O ATOM 1345 C3' DA C 23 32.151 -27.983 18.599 1.00103.27 C ANISOU 1345 C3' DA C 23 10631 15268 13340 727 2096 -2359 C ATOM 1346 O3' DA C 23 31.523 -26.726 18.328 1.00101.31 O ANISOU 1346 O3' DA C 23 10316 14992 13185 606 1959 -2756 O ATOM 1347 C2' DA C 23 31.224 -29.159 18.275 1.00103.57 C ANISOU 1347 C2' DA C 23 10712 14931 13708 743 2247 -2291 C ATOM 1348 C1' DA C 23 31.689 -29.645 16.909 1.00106.78 C ANISOU 1348 C1' DA C 23 11257 15020 14295 882 2110 -2236 C ATOM 1349 N9 DA C 23 31.708 -31.092 16.716 1.00118.78 N ANISOU 1349 N9 DA C 23 12868 16323 15941 986 2258 -1941 N ATOM 1350 C8 DA C 23 32.702 -31.952 17.077 1.00131.43 C ANISOU 1350 C8 DA C 23 14524 18078 17337 1111 2356 -1556 C ATOM 1351 N7 DA C 23 32.461 -33.204 16.769 1.00104.89 N ANISOU 1351 N7 DA C 23 11246 14448 14159 1186 2487 -1357 N ATOM 1352 C5 DA C 23 31.227 -33.153 16.161 1.00125.83 C ANISOU 1352 C5 DA C 23 13898 16747 17165 1102 2465 -1635 C ATOM 1353 C6 DA C 23 30.417 -34.150 15.601 1.00121.52 C ANISOU 1353 C6 DA C 23 13420 15802 16950 1118 2554 -1613 C ATOM 1354 N6 DA C 23 30.750 -35.436 15.583 1.00105.95 N ANISOU 1354 N6 DA C 23 11538 13724 14992 1228 2703 -1285 N ATOM 1355 N1 DA C 23 29.242 -33.788 15.060 1.00112.13 N ANISOU 1355 N1 DA C 23 12201 14318 16085 1015 2482 -1941 N ATOM 1356 C2 DA C 23 28.917 -32.492 15.087 1.00103.17 C ANISOU 1356 C2 DA C 23 10975 13290 14935 908 2336 -2267 C ATOM 1357 N3 DA C 23 29.593 -31.459 15.587 1.00102.58 N ANISOU 1357 N3 DA C 23 10835 13583 14558 881 2252 -2325 N ATOM 1358 C4 DA C 23 30.753 -31.863 16.114 1.00122.77 C ANISOU 1358 C4 DA C 23 13423 16423 16801 981 2321 -1994 C ATOM 1359 P DT C 24 30.617 -26.021 19.444 1.00131.54 P ANISOU 1359 P DT C 24 14010 19017 16951 427 2079 -2952 P ATOM 1360 OP1 DT C 24 30.561 -24.576 19.134 1.00121.25 O ANISOU 1360 OP1 DT C 24 12655 17795 15617 344 1886 -3297 O ATOM 1361 OP2 DT C 24 31.041 -26.542 20.770 1.00104.90 O ANISOU 1361 OP2 DT C 24 10615 15971 13271 425 2276 -2650 O ATOM 1362 O5' DT C 24 29.170 -26.560 19.122 1.00140.97 O ANISOU 1362 O5' DT C 24 15181 19818 18564 362 2191 -3104 O ATOM 1363 C5' DT C 24 28.831 -26.775 17.768 1.00144.38 C ANISOU 1363 C5' DT C 24 15688 19838 19333 419 2046 -3239 C ATOM 1364 C4' DT C 24 27.589 -27.617 17.800 1.00132.29 C ANISOU 1364 C4' DT C 24 14125 17994 18144 367 2214 -3263 C ATOM 1365 O4' DT C 24 27.939 -28.990 17.523 1.00115.15 O ANISOU 1365 O4' DT C 24 12061 15658 16031 495 2311 -2942 O ATOM 1366 C3' DT C 24 27.009 -27.602 19.209 1.00120.29 C ANISOU 1366 C3' DT C 24 12488 16707 16510 246 2460 -3232 C ATOM 1367 O3' DT C 24 25.604 -27.600 19.149 1.00105.76 O ANISOU 1367 O3' DT C 24 10561 14591 15033 133 2542 -3469 O ATOM 1368 C2' DT C 24 27.512 -28.924 19.781 1.00106.95 C ANISOU 1368 C2' DT C 24 10865 15091 14682 341 2664 -2819 C ATOM 1369 C1' DT C 24 27.301 -29.741 18.518 1.00105.99 C ANISOU 1369 C1' DT C 24 10839 14535 14896 438 2583 -2799 C ATOM 1370 N1 DT C 24 27.796 -31.133 18.553 1.00107.11 N ANISOU 1370 N1 DT C 24 11081 14611 15006 564 2724 -2421 N ATOM 1371 C2 DT C 24 27.086 -32.033 17.808 1.00107.24 C ANISOU 1371 C2 DT C 24 11149 14212 15384 594 2763 -2422 C ATOM 1372 O2 DT C 24 26.124 -31.723 17.140 1.00108.90 O ANISOU 1372 O2 DT C 24 11328 14121 15929 523 2673 -2710 O ATOM 1373 N3 DT C 24 27.543 -33.308 17.868 1.00116.62 N ANISOU 1373 N3 DT C 24 12431 15344 16534 709 2904 -2072 N ATOM 1374 C4 DT C 24 28.615 -33.771 18.586 1.00130.06 C ANISOU 1374 C4 DT C 24 14175 17357 17887 800 3003 -1725 C ATOM 1375 O4 DT C 24 28.916 -34.956 18.545 1.00110.26 O ANISOU 1375 O4 DT C 24 11752 14748 15393 903 3130 -1427 O ATOM 1376 C5 DT C 24 29.329 -32.784 19.364 1.00115.74 C ANISOU 1376 C5 DT C 24 12298 15975 15703 764 2944 -1739 C ATOM 1377 C7 DT C 24 30.522 -33.187 20.197 1.00110.39 C ANISOU 1377 C7 DT C 24 11655 15657 14632 856 3023 -1373 C ATOM 1378 C6 DT C 24 28.883 -31.515 19.313 1.00108.10 C ANISOU 1378 C6 DT C 24 11242 15068 14764 646 2811 -2088 C ATOM 1379 P DG C 25 24.749 -26.889 20.305 1.00134.98 P ANISOU 1379 P DG C 25 14114 18477 18696 -40 2712 -3650 P ATOM 1380 OP1 DG C 25 24.817 -25.433 20.075 1.00122.89 O ANISOU 1380 OP1 DG C 25 12529 17074 17090 -111 2509 -3961 O ATOM 1381 OP2 DG C 25 25.152 -27.487 21.603 1.00109.52 O ANISOU 1381 OP2 DG C 25 10900 15554 15160 -38 2963 -3341 O ATOM 1382 O5' DG C 25 23.254 -27.365 19.995 1.00144.53 O ANISOU 1382 O5' DG C 25 15248 19270 20398 -117 2818 -3825 O ATOM 1383 C5' DG C 25 22.995 -28.129 18.800 1.00141.01 C ANISOU 1383 C5' DG C 25 14876 18410 20292 -33 2709 -3820 C ATOM 1384 C4' DG C 25 22.354 -29.476 19.113 1.00130.08 C ANISOU 1384 C4' DG C 25 13490 16814 19120 -25 2961 -3622 C ATOM 1385 O4' DG C 25 23.365 -30.515 19.168 1.00126.06 O ANISOU 1385 O4' DG C 25 13115 16395 18389 118 3027 -3236 O ATOM 1386 C3' DG C 25 21.617 -29.599 20.437 1.00135.49 C ANISOU 1386 C3' DG C 25 14060 17636 19782 -145 3271 -3597 C ATOM 1387 O3' DG C 25 20.580 -30.528 20.295 1.00134.56 O ANISOU 1387 O3' DG C 25 13903 17167 20056 -173 3429 -3594 O ATOM 1388 C2' DG C 25 22.665 -30.221 21.348 1.00113.12 C ANISOU 1388 C2' DG C 25 11315 15144 16522 -65 3433 -3212 C ATOM 1389 C1' DG C 25 23.160 -31.254 20.358 1.00129.25 C ANISOU 1389 C1' DG C 25 13488 16943 18680 87 3340 -3009 C ATOM 1390 N9 DG C 25 24.339 -31.932 20.870 1.00130.88 N ANISOU 1390 N9 DG C 25 13800 17415 18515 205 3424 -2624 N ATOM 1391 C8 DG C 25 25.314 -31.435 21.708 1.00125.31 C ANISOU 1391 C8 DG C 25 13108 17145 17360 219 3427 -2485 C ATOM 1392 N7 DG C 25 26.231 -32.318 22.003 1.00116.43 N ANISOU 1392 N7 DG C 25 12080 16156 16000 340 3506 -2119 N ATOM 1393 C5 DG C 25 25.834 -33.464 21.332 1.00116.81 C ANISOU 1393 C5 DG C 25 12188 15842 16354 409 3573 -2010 C ATOM 1394 C6 DG C 25 26.435 -34.740 21.275 1.00115.95 C ANISOU 1394 C6 DG C 25 12191 15679 16185 546 3677 -1646 C ATOM 1395 O6 DG C 25 27.477 -35.123 21.833 1.00115.90 O ANISOU 1395 O6 DG C 25 12249 15947 15839 639 3728 -1335 O ATOM 1396 N1 DG C 25 25.688 -35.598 20.466 1.00118.98 N ANISOU 1396 N1 DG C 25 12608 15633 16967 568 3716 -1671 N ATOM 1397 C2 DG C 25 24.524 -35.277 19.792 1.00124.15 C ANISOU 1397 C2 DG C 25 13193 15949 18028 473 3646 -2001 C ATOM 1398 N2 DG C 25 23.946 -36.238 19.054 1.00116.67 N ANISOU 1398 N2 DG C 25 12297 14603 17430 510 3683 -1971 N ATOM 1399 N3 DG C 25 23.955 -34.084 19.840 1.00128.30 N ANISOU 1399 N3 DG C 25 13606 16521 18621 349 3541 -2340 N ATOM 1400 C4 DG C 25 24.668 -33.243 20.627 1.00128.93 C ANISOU 1400 C4 DG C 25 13658 17020 18311 325 3519 -2319 C ATOM 1401 P DG C 26 19.487 -30.705 21.475 1.00148.48 P ANISOU 1401 P DG C 26 15533 18940 21943 -313 3766 -3632 P ATOM 1402 OP1 DG C 26 19.384 -29.412 22.205 1.00117.20 O ANISOU 1402 OP1 DG C 26 11476 15264 17790 -431 3771 -3843 O ATOM 1403 OP2 DG C 26 19.865 -31.898 22.296 1.00158.64 O ANISOU 1403 OP2 DG C 26 16899 20341 23035 -251 4043 -3253 O ATOM 1404 O5' DG C 26 18.126 -31.000 20.660 1.00136.27 O ANISOU 1404 O5' DG C 26 13891 16895 20991 -374 3738 -3874 O ATOM 1405 C5' DG C 26 18.120 -31.972 19.603 1.00127.51 C ANISOU 1405 C5' DG C 26 12874 15437 20138 -272 3633 -3778 C ATOM 1406 C4' DG C 26 18.089 -33.383 20.164 1.00126.16 C ANISOU 1406 C4' DG C 26 12755 15214 19966 -225 3926 -3449 C ATOM 1407 O4' DG C 26 19.428 -33.862 20.439 1.00129.49 O ANISOU 1407 O4' DG C 26 13329 15920 19951 -93 3946 -3101 O ATOM 1408 C3' DG C 26 17.346 -33.550 21.482 1.00128.84 C ANISOU 1408 C3' DG C 26 12983 15659 20313 -341 4284 -3421 C ATOM 1409 O3' DG C 26 16.010 -33.965 21.183 1.00127.06 O ANISOU 1409 O3' DG C 26 12641 15029 20608 -423 4375 -3592 O ATOM 1410 C2' DG C 26 18.150 -34.613 22.252 1.00127.83 C ANISOU 1410 C2' DG C 26 12981 15740 19849 -245 4515 -3001 C ATOM 1411 C1' DG C 26 19.322 -34.956 21.333 1.00133.49 C ANISOU 1411 C1' DG C 26 13858 16468 20395 -80 4273 -2816 C ATOM 1412 N9 DG C 26 20.605 -35.110 22.030 1.00145.91 N ANISOU 1412 N9 DG C 26 15541 18440 21457 13 4327 -2501 N ATOM 1413 C8 DG C 26 21.197 -34.175 22.843 1.00146.41 C ANISOU 1413 C8 DG C 26 15587 18913 21130 -26 4314 -2515 C ATOM 1414 N7 DG C 26 22.341 -34.536 23.345 1.00148.18 N ANISOU 1414 N7 DG C 26 15920 19436 20948 75 4350 -2199 N ATOM 1415 C5 DG C 26 22.544 -35.807 22.838 1.00146.81 C ANISOU 1415 C5 DG C 26 15844 19041 20896 194 4402 -1951 C ATOM 1416 C6 DG C 26 23.620 -36.716 23.023 1.00137.67 C ANISOU 1416 C6 DG C 26 14820 18028 19461 340 4457 -1561 C ATOM 1417 O6 DG C 26 24.647 -36.590 23.693 1.00123.97 O ANISOU 1417 O6 DG C 26 13141 16656 17307 397 4461 -1346 O ATOM 1418 N1 DG C 26 23.431 -37.903 22.321 1.00137.87 N ANISOU 1418 N1 DG C 26 14918 17718 19750 426 4508 -1414 N ATOM 1419 C2 DG C 26 22.325 -38.168 21.530 1.00139.58 C ANISOU 1419 C2 DG C 26 15085 17507 20442 372 4493 -1626 C ATOM 1420 N2 DG C 26 22.269 -39.354 20.911 1.00127.74 N ANISOU 1420 N2 DG C 26 13676 15711 19148 462 4545 -1451 N ATOM 1421 N3 DG C 26 21.315 -37.330 21.342 1.00149.95 N ANISOU 1421 N3 DG C 26 16267 18677 22029 237 4426 -1991 N ATOM 1422 C4 DG C 26 21.486 -36.175 22.026 1.00150.34 C ANISOU 1422 C4 DG C 26 16243 19052 21827 156 4390 -2133 C TER 1423 DG C 26 HETATM 1424 O HOH A 201 44.193 -10.939 12.055 1.00 93.82 O HETATM 1425 O HOH A 202 27.651 -8.587 -1.428 1.00 98.95 O HETATM 1426 O HOH A 203 53.179 -9.172 -0.511 1.00107.30 O HETATM 1427 O HOH C 101 24.713 -33.650 24.418 1.00 95.02 O CONECT 998 1013 CONECT 1012 1013 CONECT 1013 998 1012 1014 1015 CONECT 1014 1013 CONECT 1015 1013 1016 CONECT 1016 1015 1017 CONECT 1017 1016 1018 1021 CONECT 1018 1017 1019 1020 CONECT 1019 1018 CONECT 1020 1018 1022 CONECT 1021 1017 1022 CONECT 1022 1020 1021 1023 CONECT 1023 1022 1024 1027 CONECT 1024 1023 1025 CONECT 1025 1024 1026 CONECT 1026 1025 1027 1028 CONECT 1027 1023 1026 1032 CONECT 1028 1026 1029 1033 CONECT 1029 1028 1030 CONECT 1030 1029 1031 1032 CONECT 1031 1030 CONECT 1032 1027 1030 CONECT 1033 1028 1034 CONECT 1034 1033 1035 CONECT 1035 1034 1036 CONECT 1036 1035 MASTER 714 0 1 5 4 0 0 6 1424 3 26 11 END
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Related entries of code: 4enj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4enk
RCSB PDB
PDBbind
13aa, >4ENK_2|Chain... at 100%
4enn
RCSB PDB
PDBbind
13aa, >4ENN_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
4enj
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
S. pombe Atl1
Ligand Name
damaged DNA containing O6-hydroxyethylguanine, O6-HOEtG
EC.Number
E.C.-.-.-.-
Resolution
3.1(Å)
Affinity (Kd/Ki/IC50)
Kd=0.29nM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Mol.Cell Vol. 47: pp. 50-60
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):
Q9UTN9
Entrez Gene ID
NCBI Entrez Gene ID:
2541704
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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