USER MOD reduce.3.24.130724 H: found=0, std=0, add=1872, rem=0, adj=59 USER MOD reduce.3.24.130724 removed 1864 hydrogens (0 hets) HEADER TRANSPORT PROTEIN 16-JUN-15 5C2U TITLE FERREDOXIN-LIKE DOMAIN OF NUCLEOPORIN NUP54 BOUND TO A NANOBODY COMPND MOL_ID: 1; COMPND 2 MOLECULE: NANOBODY; COMPND 3 CHAIN: B; COMPND 4 FRAGMENT: NANOBODY; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: NUP54; COMPND 8 CHAIN: A; COMPND 9 FRAGMENT: NUP54 FERREDOXIN-LIKE DOMAIN, UNP RESIDUES 212-349; COMPND 0 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: CAMELUS DROMEDARIUS; SOURCE 3 ORGANISM_TAXID: 9838; SOURCE 4 GENE: IMMUNOGLOBULIN G; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_VARIANT: NEB SHUFFLE; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PQE-80; SOURCE 0 MOL_ID: 2; SOURCE 1 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS; SOURCE 2 ORGANISM_COMMON: AFRICAN CLAWED FROG; SOURCE 3 ORGANISM_TAXID: 8355; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_VARIANT: NEB EXPRESS; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PQE-80 KEYWDS NUCLEOPORIN NUP54, NUP54 ALPHA-BETA DOMAIN, FERREDOXIN-LIKE FOLD, KEYWDS 2 TRANSPORT PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR H.CHUG,S.TRAKHANOV,B.B.HULSMANN,T.PLEINER,D.GORLICH REVDAT 3 14-OCT-15 5C2U 1 JRNL REVDAT 2 02-SEP-15 5C2U 1 JRNL REVDAT 1 26-AUG-15 5C2U 0 JRNL AUTH H.CHUG,S.TRAKHANOV,B.B.HULSMANN,T.PLEINER,D.GORLICH JRNL TITL CRYSTAL STRUCTURE OF THE METAZOAN NUP62NUP58NUP54 JRNL TITL 2 NUCLEOPORIN COMPLEX. JRNL REF SCIENCE V. 350 106 2015 JRNL REFN ESSN 1095-9203 JRNL PMID 26292704 JRNL DOI 10.1126/SCIENCE.AAC7420 REMARK 2 REMARK 2 RESOLUTION. 1.55 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.55 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.74 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.360 REMARK 3 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 3 NUMBER OF REFLECTIONS : 40060 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.178 REMARK 3 R VALUE (WORKING SET) : 0.176 REMARK 3 FREE R VALUE : 0.205 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 2002 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 29.7464 - 3.7335 1.00 2864 150 0.1516 0.1607 REMARK 3 2 3.7335 - 2.9642 1.00 2763 145 0.1648 0.2172 REMARK 3 3 2.9642 - 2.5898 1.00 2744 144 0.1717 0.2180 REMARK 3 4 2.5898 - 2.3531 1.00 2727 144 0.1791 0.2005 REMARK 3 5 2.3531 - 2.1845 1.00 2706 142 0.1791 0.2156 REMARK 3 6 2.1845 - 2.0557 1.00 2706 143 0.1815 0.2028 REMARK 3 7 2.0557 - 1.9528 1.00 2708 142 0.1841 0.1993 REMARK 3 8 1.9528 - 1.8678 1.00 2717 143 0.1908 0.2152 REMARK 3 9 1.8678 - 1.7959 1.00 2683 142 0.2120 0.2381 REMARK 3 10 1.7959 - 1.7340 1.00 2696 142 0.2265 0.2649 REMARK 3 11 1.7340 - 1.6797 1.00 2685 141 0.2460 0.2943 REMARK 3 12 1.6797 - 1.6317 1.00 2699 142 0.2614 0.3118 REMARK 3 13 1.6317 - 1.5888 1.00 2698 142 0.2727 0.2890 REMARK 3 14 1.5888 - 1.5500 1.00 2662 140 0.3101 0.3104 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.170 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 22.550 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 24.56 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 39.51 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.008 1942 REMARK 3 ANGLE : 1.051 2637 REMARK 3 CHIRALITY : 0.043 287 REMARK 3 PLANARITY : 0.005 347 REMARK 3 DIHEDRAL : 14.477 714 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 12 REMARK 3 TLS GROUP : 1 REMARK 3 SELECTION: CHAIN 'B' AND (RESID 1 THROUGH 35 ) REMARK 3 ORIGIN FOR THE GROUP (A): 18.5932 40.2341 17.8831 REMARK 3 T TENSOR REMARK 3 T11: 0.2537 T22: 0.2380 REMARK 3 T33: 0.1825 T12: 0.0212 REMARK 3 T13: 0.0044 T23: 0.0478 REMARK 3 L TENSOR REMARK 3 L11: 1.1541 L22: 8.7159 REMARK 3 L33: 1.6704 L12: 0.3185 REMARK 3 L13: -0.6697 L23: -2.7593 REMARK 3 S TENSOR REMARK 3 S11: 0.2474 S12: -0.1343 S13: 0.0381 REMARK 3 S21: 0.4385 S22: -0.4590 S23: -0.6903 REMARK 3 S31: -0.1495 S32: 0.2498 S33: 0.1804 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: CHAIN 'B' AND (RESID 36 THROUGH 57 ) REMARK 3 ORIGIN FOR THE GROUP (A): 15.6344 45.4367 9.3551 REMARK 3 T TENSOR REMARK 3 T11: 0.3072 T22: 0.2476 REMARK 3 T33: 0.2038 T12: 0.1369 REMARK 3 T13: 0.0900 T23: 0.0553 REMARK 3 L TENSOR REMARK 3 L11: 4.2672 L22: 6.8565 REMARK 3 L33: 8.1577 L12: -1.3176 REMARK 3 L13: -2.1921 L23: 1.2518 REMARK 3 S TENSOR REMARK 3 S11: -0.0213 S12: 0.1208 S13: 0.3376 REMARK 3 S21: -0.7691 S22: -0.1080 S23: -0.3390 REMARK 3 S31: 0.3042 S32: 0.5471 S33: 0.0534 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: CHAIN 'B' AND (RESID 58 THROUGH 72 ) REMARK 3 ORIGIN FOR THE GROUP (A): 9.9683 43.0353 16.3334 REMARK 3 T TENSOR REMARK 3 T11: 0.3879 T22: 0.2003 REMARK 3 T33: 0.2315 T12: 0.0851 REMARK 3 T13: 0.0589 T23: 0.0185 REMARK 3 L TENSOR REMARK 3 L11: 6.7770 L22: 3.5810 REMARK 3 L33: 8.3342 L12: 1.6051 REMARK 3 L13: 0.2434 L23: 2.4152 REMARK 3 S TENSOR REMARK 3 S11: 0.1937 S12: -0.4440 S13: 0.4310 REMARK 3 S21: -0.0875 S22: -0.1166 S23: 0.5448 REMARK 3 S31: -0.9899 S32: -0.4537 S33: -0.0574 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: CHAIN 'B' AND (RESID 73 THROUGH 87 ) REMARK 3 ORIGIN FOR THE GROUP (A): 12.4251 36.0891 15.4580 REMARK 3 T TENSOR REMARK 3 T11: 0.3045 T22: 0.2079 REMARK 3 T33: 0.1543 T12: 0.0448 REMARK 3 T13: 0.0315 T23: 0.0383 REMARK 3 L TENSOR REMARK 3 L11: 6.0386 L22: 2.9019 REMARK 3 L33: 0.6337 L12: -0.9535 REMARK 3 L13: -0.3640 L23: -2.6449 REMARK 3 S TENSOR REMARK 3 S11: 0.2565 S12: 0.0932 S13: 0.0095 REMARK 3 S21: -0.3539 S22: -0.2234 S23: 0.5073 REMARK 3 S31: -0.2872 S32: -0.0082 S33: 0.0119 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: CHAIN 'B' AND (RESID 88 THROUGH 124 ) REMARK 3 ORIGIN FOR THE GROUP (A): 20.6259 45.5568 10.3475 REMARK 3 T TENSOR REMARK 3 T11: 0.2389 T22: 0.2221 REMARK 3 T33: 0.3004 T12: 0.0797 REMARK 3 T13: 0.0511 T23: 0.0699 REMARK 3 L TENSOR REMARK 3 L11: 0.5635 L22: 3.7169 REMARK 3 L33: 2.0415 L12: -0.5513 REMARK 3 L13: -0.1306 L23: -0.9026 REMARK 3 S TENSOR REMARK 3 S11: 0.1876 S12: 0.1085 S13: 0.1877 REMARK 3 S21: -0.3546 S22: -0.3912 S23: -0.7799 REMARK 3 S31: -0.1138 S32: 0.1689 S33: 0.2479 REMARK 3 TLS GROUP : 6 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 214 THROUGH 226 ) REMARK 3 ORIGIN FOR THE GROUP (A): 21.2268 60.5768 -2.3921 REMARK 3 T TENSOR REMARK 3 T11: 0.2577 T22: 0.2207 REMARK 3 T33: 0.2546 T12: 0.1358 REMARK 3 T13: 0.0508 T23: 0.0031 REMARK 3 L TENSOR REMARK 3 L11: 9.6730 L22: 8.0770 REMARK 3 L33: 8.4798 L12: 4.4480 REMARK 3 L13: 5.2470 L23: 2.2226 REMARK 3 S TENSOR REMARK 3 S11: 0.0846 S12: 0.0803 S13: -0.4056 REMARK 3 S21: 0.1030 S22: -0.0608 S23: -0.4648 REMARK 3 S31: 0.3810 S32: 0.3295 S33: -0.1284 REMARK 3 TLS GROUP : 7 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 227 THROUGH 244 ) REMARK 3 ORIGIN FOR THE GROUP (A): 17.0727 64.8145 -12.6891 REMARK 3 T TENSOR REMARK 3 T11: 0.3228 T22: 0.2293 REMARK 3 T33: 0.1852 T12: -0.0088 REMARK 3 T13: 0.0286 T23: 0.0127 REMARK 3 L TENSOR REMARK 3 L11: 3.1018 L22: 2.5592 REMARK 3 L33: 7.2014 L12: -0.7527 REMARK 3 L13: -0.5165 L23: 2.0690 REMARK 3 S TENSOR REMARK 3 S11: -0.0775 S12: 0.3512 S13: -0.3542 REMARK 3 S21: -0.8403 S22: 0.1859 S23: 0.0793 REMARK 3 S31: 0.3979 S32: -0.0055 S33: 0.0471 REMARK 3 TLS GROUP : 8 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 245 THROUGH 265 ) REMARK 3 ORIGIN FOR THE GROUP (A): 20.7750 64.0756 -7.0115 REMARK 3 T TENSOR REMARK 3 T11: 0.2166 T22: 0.2175 REMARK 3 T33: 0.1770 T12: 0.0584 REMARK 3 T13: 0.0274 T23: 0.0075 REMARK 3 L TENSOR REMARK 3 L11: 2.5335 L22: 7.7568 REMARK 3 L33: 2.3980 L12: 1.2720 REMARK 3 L13: 0.8986 L23: 1.2354 REMARK 3 S TENSOR REMARK 3 S11: -0.0189 S12: 0.1747 S13: -0.4124 REMARK 3 S21: 0.0022 S22: 0.1616 S23: -0.5152 REMARK 3 S31: 0.3723 S32: 0.1950 S33: -0.1626 REMARK 3 TLS GROUP : 9 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 266 THROUGH 280 ) REMARK 3 ORIGIN FOR THE GROUP (A): 25.6172 72.3479 -2.8424 REMARK 3 T TENSOR REMARK 3 T11: 0.2222 T22: 0.2917 REMARK 3 T33: 0.2545 T12: 0.0472 REMARK 3 T13: -0.0217 T23: 0.0129 REMARK 3 L TENSOR REMARK 3 L11: 5.9248 L22: 7.7129 REMARK 3 L33: 4.8257 L12: 3.0808 REMARK 3 L13: 1.2675 L23: 2.3678 REMARK 3 S TENSOR REMARK 3 S11: -0.2179 S12: -0.0661 S13: 0.3881 REMARK 3 S21: -0.0605 S22: 0.1462 S23: -0.6002 REMARK 3 S31: -0.3365 S32: 0.4432 S33: -0.0363 REMARK 3 TLS GROUP : 10 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 281 THROUGH 295 ) REMARK 3 ORIGIN FOR THE GROUP (A): 20.4595 69.7190 4.3019 REMARK 3 T TENSOR REMARK 3 T11: 0.3531 T22: 0.2313 REMARK 3 T33: 0.2191 T12: 0.1161 REMARK 3 T13: -0.0215 T23: 0.0176 REMARK 3 L TENSOR REMARK 3 L11: 7.6394 L22: 6.6955 REMARK 3 L33: 7.0545 L12: 3.0260 REMARK 3 L13: -4.2821 L23: -2.8477 REMARK 3 S TENSOR REMARK 3 S11: -0.0277 S12: -0.7182 S13: -0.1031 REMARK 3 S21: 0.9654 S22: 0.0281 S23: -0.1130 REMARK 3 S31: 0.0304 S32: 0.5288 S33: 0.0658 REMARK 3 TLS GROUP : 11 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 296 THROUGH 305 ) REMARK 3 ORIGIN FOR THE GROUP (A): 8.0957 65.1515 -1.0298 REMARK 3 T TENSOR REMARK 3 T11: 0.2823 T22: 0.1778 REMARK 3 T33: 0.4508 T12: 0.0821 REMARK 3 T13: 0.0766 T23: 0.0788 REMARK 3 L TENSOR REMARK 3 L11: 3.0193 L22: 4.3592 REMARK 3 L33: 8.5663 L12: 1.0755 REMARK 3 L13: -2.3200 L23: 4.3608 REMARK 3 S TENSOR REMARK 3 S11: -0.2372 S12: 0.0196 S13: 0.2032 REMARK 3 S21: -0.0308 S22: 0.1672 S23: 1.0587 REMARK 3 S31: -0.1760 S32: -0.2873 S33: -0.0482 REMARK 3 TLS GROUP : 12 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 306 THROUGH 329 ) REMARK 3 ORIGIN FOR THE GROUP (A): 19.0067 61.9305 13.7795 REMARK 3 T TENSOR REMARK 3 T11: 0.5786 T22: 0.2870 REMARK 3 T33: 0.4220 T12: 0.0723 REMARK 3 T13: 0.0013 T23: 0.0097 REMARK 3 L TENSOR REMARK 3 L11: 1.1912 L22: 1.3989 REMARK 3 L33: 4.3683 L12: 1.1865 REMARK 3 L13: 0.7466 L23: -1.8168 REMARK 3 S TENSOR REMARK 3 S11: 0.1232 S12: -0.3108 S13: 0.1548 REMARK 3 S21: 0.5963 S22: -0.1572 S23: -0.0366 REMARK 3 S31: -0.6979 S32: 0.0433 S33: -0.0121 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 5C2U COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 16-JUN-15. REMARK 100 THE DEPOSITION ID IS D_1000210932. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 24-OCT-14 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 4.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SLS REMARK 200 BEAMLINE : X10SA REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : DOUBLE CRYSTAL FIXED-EXIT REMARK 200 MONOCHROMATOR REMARK 200 OPTICS : DYNAMICALLY BENDABLE MIRROR REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M-F REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 40071 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.550 REMARK 200 RESOLUTION RANGE LOW (A) : 46.500 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 15.90 REMARK 200 R MERGE (I) : 0.06500 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 22.9000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.55 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.59 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.8 REMARK 200 DATA REDUNDANCY IN SHELL : 15.90 REMARK 200 R MERGE FOR SHELL (I) : 2.21200 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 1.700 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: 4KLM REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 52.46 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.59 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 6000, SODIUM ACETATE TRIHYDRATE, REMARK 280 PH 4.6, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 31 2 1 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 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+2/3 REMARK 290 6555 -X,-X+Y,-Z+1/3 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 19.20000 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 38.40000 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 38.40000 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 19.20000 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: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 2180 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 11850 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -9.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH B 286 LIES ON A SPECIAL POSITION. REMARK 375 HOH B 288 LIES ON A SPECIAL POSITION. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 ALA B -6 REMARK 465 GLY B -5 REMARK 465 THR B -4 REMARK 465 GLY B -3 REMARK 465 SER B -2 REMARK 465 GLY B -1 REMARK 465 GLN B 0 REMARK 465 GLY A 207 REMARK 465 SER A 208 REMARK 465 MET A 209 REMARK 465 GLY A 210 REMARK 465 THR A 211 REMARK 465 ASN A 212 REMARK 465 LYS A 213 REMARK 465 SER A 330 REMARK 465 GLY A 331 REMARK 465 VAL A 332 REMARK 465 ASP A 333 REMARK 465 PRO A 334 REMARK 465 ILE A 335 REMARK 465 ILE A 336 REMARK 465 TRP A 337 REMARK 465 GLU A 338 REMARK 465 GLN A 339 REMARK 465 ALA A 340 REMARK 465 LYS A 341 REMARK 465 VAL A 342 REMARK 465 ASP A 343 REMARK 465 ASN A 344 REMARK 465 PRO A 345 REMARK 465 ASP A 346 REMARK 465 PRO A 347 REMARK 465 GLU A 348 REMARK 465 ARG A 349 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 NH1 ARG B 50 O HOH B 201 2.14 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 ALA B 88 168.32 178.10 REMARK 500 ASN A 224 45.57 -85.05 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH B 300 DISTANCE = 6.36 ANGSTROMS DBREF 5C2U B -6 124 PDB 5C2U 5C2U -6 124 DBREF 5C2U A 212 349 UNP K9ZTJ6 K9ZTJ6_XENLA 212 349 SEQADV 5C2U GLY A 207 UNP K9ZTJ6 EXPRESSION TAG SEQADV 5C2U SER A 208 UNP K9ZTJ6 EXPRESSION TAG SEQADV 5C2U MET A 209 UNP K9ZTJ6 EXPRESSION TAG SEQADV 5C2U GLY A 210 UNP K9ZTJ6 EXPRESSION TAG SEQADV 5C2U THR A 211 UNP K9ZTJ6 EXPRESSION TAG SEQADV 5C2U SER A 304 UNP K9ZTJ6 GLN 304 CONFLICT SEQRES 1 B 131 ALA GLY THR GLY SER GLY GLN VAL GLN LEU GLN GLU SER SEQRES 2 B 131 GLY GLY GLY LEU VAL GLN PRO GLY GLY SER LEU ARG LEU SEQRES 3 B 131 SER CYS VAL VAL SER GLY ASP TYR TYR ALA ILE GLY TRP SEQRES 4 B 131 PHE ARG GLN ALA PRO GLY LYS GLU ARG GLU GLY VAL ALA SEQRES 5 B 131 ALA ILE SER SER ARG ASP GLY SER THR TYR TYR PRO ASP SEQRES 6 B 131 ALA VAL LYS GLY ARG PHE THR ILE SER ARG ASP ASN ALA SEQRES 7 B 131 LYS ASN THR VAL TYR LEU GLN MET ASN SER LEU LYS PRO SEQRES 8 B 131 GLU ASP THR ALA VAL TYR TYR CYS ALA ALA ASP ARG ARG SEQRES 9 B 131 GLN ARG TRP GLY PRO TYR TYR TYR LEU SER ALA LEU GLU SEQRES 10 B 131 TYR VAL TYR TRP GLY GLN GLY THR GLN VAL THR VAL SER SEQRES 11 B 131 SER SEQRES 1 A 143 GLY SER MET GLY THR ASN LYS ASP GLU ASP GLY LEU ILE SEQRES 2 A 143 SER LEU ILE PHE ASN LYS LYS GLU SER ASP ILE ARG GLY SEQRES 3 A 143 GLN GLN GLN GLN LEU VAL GLU SER LEU HIS LYS VAL LEU SEQRES 4 A 143 GLY GLY HIS GLN THR LEU THR VAL ASN VAL GLU GLY VAL SEQRES 5 A 143 LYS THR LYS ALA ASP ASN GLN THR GLU VAL ILE ILE TYR SEQRES 6 A 143 VAL VAL GLU ARG SER PRO ASN GLY THR SER ARG ARG VAL SEQRES 7 A 143 GLY ALA SER ALA LEU PHE SER TYR PHE GLU GLN ALA HIS SEQRES 8 A 143 ILE LYS ALA ASN MET GLN SER LEU GLY VAL THR GLY ALA SEQRES 9 A 143 MET ALA GLN THR GLU LEU SER PRO VAL GLN ILE LYS GLN SEQRES 10 A 143 LEU ILE GLN ASN PRO LEU SER GLY VAL ASP PRO ILE ILE SEQRES 11 A 143 TRP GLU GLN ALA LYS VAL ASP ASN PRO ASP PRO GLU ARG FORMUL 3 HOH *198(H2 O) HELIX 1 AA1 PRO B 57 LYS B 61 5 5 HELIX 2 AA2 ASN B 70 LYS B 72 5 3 HELIX 3 AA3 LYS B 83 THR B 87 5 5 HELIX 4 AA4 GLY B 101 SER B 107 1 7 HELIX 5 AA5 ALA B 108 TYR B 111 5 4 HELIX 6 AA6 LYS A 226 GLN A 233 1 8 HELIX 7 AA7 GLN A 233 LEU A 245 1 13 HELIX 8 AA8 GLY A 285 GLN A 295 1 11 HELIX 9 AA9 GLN A 295 LEU A 305 1 11 HELIX 10 AB1 SER A 317 ASN A 327 1 11 SHEET 1 AA1 4 GLN B 2 SER B 6 0 SHEET 2 AA1 4 LEU B 17 SER B 24 -1 O SER B 20 N SER B 6 SHEET 3 AA1 4 THR B 74 MET B 79 -1 O MET B 79 N LEU B 17 SHEET 4 AA1 4 PHE B 64 ASP B 69 -1 N SER B 67 O TYR B 76 SHEET 1 AA2 6 GLY B 9 VAL B 11 0 SHEET 2 AA2 6 THR B 118 VAL B 122 1 O THR B 121 N VAL B 11 SHEET 3 AA2 6 ALA B 88 ASP B 95 -1 N TYR B 90 O THR B 118 SHEET 4 AA2 6 ALA B 29 GLN B 35 -1 N PHE B 33 O TYR B 91 SHEET 5 AA2 6 GLU B 42 SER B 48 -1 O ALA B 45 N TRP B 32 SHEET 6 AA2 6 THR B 54 TYR B 55 -1 O TYR B 55 N ALA B 46 SHEET 1 AA3 4 GLY B 9 VAL B 11 0 SHEET 2 AA3 4 THR B 118 VAL B 122 1 O THR B 121 N VAL B 11 SHEET 3 AA3 4 ALA B 88 ASP B 95 -1 N TYR B 90 O THR B 118 SHEET 4 AA3 4 TYR B 113 TRP B 114 -1 O TYR B 113 N ALA B 94 SHEET 1 AA4 5 ARG B 99 TRP B 100 0 SHEET 2 AA4 5 VAL A 307 ALA A 312 -1 O ALA A 310 N TRP B 100 SHEET 3 AA4 5 ILE A 219 PHE A 223 -1 N SER A 220 O MET A 311 SHEET 4 AA4 5 GLN A 265 ARG A 275 -1 O THR A 266 N PHE A 223 SHEET 5 AA4 5 LEU A 251 ALA A 262 -1 N GLU A 256 O ILE A 269 SHEET 1 AA5 5 ARG B 99 TRP B 100 0 SHEET 2 AA5 5 VAL A 307 ALA A 312 -1 O ALA A 310 N TRP B 100 SHEET 3 AA5 5 ILE A 219 PHE A 223 -1 N SER A 220 O MET A 311 SHEET 4 AA5 5 GLN A 265 ARG A 275 -1 O THR A 266 N PHE A 223 SHEET 5 AA5 5 SER A 281 ARG A 283 -1 O ARG A 282 N GLU A 274 SSBOND *** CYS B 21 CYS B 92 1555 1555 2.05 CRYST1 90.860 90.860 57.600 90.00 90.00 120.00 P 31 2 1 6 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 0.011006 0.006354 0.000000 0.00000 SCALE2 0.000000 0.012709 0.000000 0.00000 SCALE3 0.000000 0.000000 0.017361 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 119 GLN : amide:sc= 1.53 K(o=1.5,f=-0.066) USER MOD Set 1.2: B 121 THR OG1 : rot 180:sc= 0.00433 USER MOD Set 2.1: B 48 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 105 TYR OH : rot 180:sc= -0.377 USER MOD Set 3.1: B 53 SER OG : rot -78:sc= 1.96 USER MOD Set 3.2: B 55 TYR OH : rot -32:sc= 2.42 USER MOD Set 4.1: B 16 SER OG : rot -104:sc= 1.83 USER MOD Set 4.2: B 78 GLN : amide:sc= 0.381 K(o=3.6,f=-0.81!) USER MOD Set 4.3: B 80 ASN : amide:sc= 1.34 K(o=3.6,f=-2.7) USER MOD Set 5.1: B 4 GLN : amide:sc= -2.3 K(o=-6.8,f=-4.6) USER MOD Set 5.2: B 116 GLN : amide:sc= -4.54 K(o=-6.8,f=-2.5) USER MOD Set 6.1: A 317 SER OG : rot -150:sc= -0.249 USER MOD Set 6.2: A 320 GLN : amide:sc= 0.465 K(o=0.22,f=-4.1!) USER MOD Set 7.1: A 311 MET CE :methyl -116:sc= -0.468 (180deg=-1.94) USER MOD Set 7.2: A 313 GLN : amide:sc= -0.747 K(o=-1.2,f=-6.5!) USER MOD Set 8.1: A 278 ASN : amide:sc= 0.0286 K(o=0.55,f=-8.9!) USER MOD Set 8.2: A 280 THR OG1 : rot 78:sc= 0.521 USER MOD Set 9.1: A 225 LYS NZ :NH3+ -174:sc= 0 (180deg=0) USER MOD Set 9.2: A 233 GLN : amide:sc= -0.0904 K(o=-0.09,f=-1.6!) USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 224 ASN : amide:sc= -0.586 K(o=-0.59,f=-3.4!) USER MOD Single : A 226 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 228 SER OG : rot -84:sc= 0 USER MOD Single : A 234 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 235 GLN : amide:sc= 1.39 K(o=1.4,f=-0.21) USER MOD Single : A 236 GLN : amide:sc= -2.84! C(o=-2.8!,f=-6.5!) USER MOD Single : A 240 SER OG A: rot -83:sc= 1.17 USER MOD Single : A 240 SER OG B: rot -41:sc= 1.32 USER MOD Single : A 242 HIS : no HE2:sc= 0.438 K(o=1.5,f=-7.5!) USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 248 HIS : no HD1:sc= 1.06 K(o=1.1,f=-3.3!) USER MOD Single : A 249 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 250 THR OG1 : rot 125:sc= 2.22 USER MOD Single : A 252 THR OG1 : rot 88:sc= 1.21 USER MOD Single : A 254 ASN : amide:sc= 0.118 X(o=0.12,f=0.39) USER MOD Single : A 259 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 260 THR OG1 : rot 180:sc= 0 USER MOD Single : A 261 LYS NZ :NH3+ 143:sc= 0.232 (180deg=0.00466) USER MOD Single : A 264 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 265 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 266 THR OG1 : rot 91:sc= 1.21 USER MOD Single : A 271 TYR OH : rot 180:sc= 0 USER MOD Single : A 276 SER OG : rot 180:sc= 0 USER MOD Single : A 281 SER OG : rot 180:sc= 0 USER MOD Single : A 287 SER OG : rot 70:sc= 1.32 USER MOD Single : A 291 SER OG : rot 180:sc= 0 USER MOD Single : A 292 TYR OH : rot -173:sc= 1.29 USER MOD Single : A 295 GLN : amide:sc= 0.125 X(o=0.13,f=-0.29) USER MOD Single : A 297 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 299 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 301 ASN : amide:sc= 0.00483 K(o=0.0048,f=-1.2) USER MOD Single : A 302 MET CE :methyl 165:sc= 0 (180deg=-0.299) USER MOD Single : A 303 GLN : amide:sc= -0.0139 K(o=-0.014,f=-1) USER MOD Single : A 304 SER OG : rot 180:sc= 0 USER MOD Single : A 308 THR OG1 : rot 180:sc= 0 USER MOD Single : A 314 THR OG1 : rot 179:sc= 0.482 USER MOD Single : A 322 LYS NZ :NH3+ -174:sc= -0.006 (180deg=-0.044) USER MOD Single : A 323 GLN : amide:sc= -0.0113 X(o=-0.011,f=0.011) USER MOD Single : A 326 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 327 ASN : amide:sc= -0.0455 K(o=-0.046,f=-1.4) USER MOD Single : B 1 VAL N :NH3+ -177:sc= -0.234 (180deg=-0.267) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 6 SER OG : rot 180:sc= 0 USER MOD Single : B 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 20 SER OG : rot 87:sc= 1.25 USER MOD Single : B 24 SER OG : rot 37:sc= -0.196 USER MOD Single : B 27 TYR OH : rot 180:sc= 0.502 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 GLN : amide:sc= 0.251 K(o=0.25,f=-0.62) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 SER OG : rot -163:sc= 1.28 USER MOD Single : B 54 THR OG1 : rot 179:sc= 1.45 USER MOD Single : B 56 TYR OH : rot -156:sc= 1.55 USER MOD Single : B 61 LYS NZ :NH3+ -174:sc= 1.41 (180deg=1.29) USER MOD Single : B 65 THR OG1 : rot 86:sc= 0.806 USER MOD Single : B 67 SER OG : rot -93:sc= 1.01 USER MOD Single : B 70 ASN : amide:sc= -0.0151 K(o=-0.015,f=-1.1) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 THR OG1 : rot 60:sc= 0.335 USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 79 MET CE :methyl -164:sc= -1.52 (180deg=-2.01) USER MOD Single : B 81 SER OG : rot 180:sc= 0 USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 THR OG1 : rot 89:sc= 0.654 USER MOD Single : B 90 TYR OH : rot -5:sc= 1.49 USER MOD Single : B 91 TYR OH : rot 180:sc= 0 USER MOD Single : B 92 CYS SG A: rot -163:sc= -0.239 USER MOD Single : B 98 GLN : amide:sc= 1.76 K(o=1.8,f=1.3) USER MOD Single : B 103 TYR OH : rot -15:sc= -0.102 USER MOD Single : B 104 TYR OH : rot -3:sc= 1.17 USER MOD Single : B 107 SER OG : rot 180:sc= 0 USER MOD Single : B 111 TYR OH : rot 26:sc= 1.11 USER MOD Single : B 113 TYR OH : rot 156:sc= 0.0178 USER MOD Single : B 118 THR OG1 : rot 140:sc= 0 USER MOD Single : B 123 SER OG : rot 81:sc= 0.971 USER MOD Single : B 124 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL B 1 28.684 51.961 20.164 1.00 55.35 N ANISOU 1 N VAL B 1 6412 5623 8995 -1699 -2229 1912 N ATOM 2 CA VAL B 1 27.567 51.195 20.788 1.00 52.05 C ANISOU 2 CA VAL B 1 6427 5346 8005 -1651 -2168 1642 C ATOM 3 C VAL B 1 27.823 49.690 20.643 1.00 50.89 C ANISOU 3 C VAL B 1 5992 5321 8024 -1501 -2139 1789 C ATOM 4 O VAL B 1 28.246 49.215 19.589 1.00 58.74 O ANISOU 4 O VAL B 1 6544 6384 9391 -1256 -1831 1955 O ATOM 5 CB VAL B 1 26.172 51.584 20.182 1.00 55.22 C ANISOU 5 CB VAL B 1 7091 5905 7987 -1407 -1640 1316 C ATOM 6 CG1 VAL B 1 26.320 52.547 19.013 1.00 54.31 C ANISOU 6 CG1 VAL B 1 6728 5786 8120 -1253 -1316 1354 C ATOM 7 CG2 VAL B 1 25.360 50.357 19.774 1.00 45.07 C ANISOU 7 CG2 VAL B 1 5774 4837 6513 -1138 -1327 1210 C ATOM 0 H1 VAL B 1 28.553 52.832 20.289 1.00 55.35 H new ATOM 0 H2 VAL B 1 29.455 51.721 20.539 1.00 55.35 H new ATOM 0 H3 VAL B 1 28.712 51.788 19.291 1.00 55.35 H new ATOM 0 HA VAL B 1 27.538 51.425 21.730 1.00 52.05 H new ATOM 0 HB VAL B 1 25.681 52.037 20.885 1.00 55.22 H new ATOM 0 HG11 VAL B 1 25.443 52.767 18.662 1.00 54.31 H new ATOM 0 HG12 VAL B 1 26.760 53.357 19.315 1.00 54.31 H new ATOM 0 HG13 VAL B 1 26.852 52.131 18.316 1.00 54.31 H new ATOM 0 HG21 VAL B 1 24.508 50.640 19.406 1.00 45.07 H new ATOM 0 HG22 VAL B 1 25.849 49.853 19.105 1.00 45.07 H new ATOM 0 HG23 VAL B 1 25.206 49.798 20.551 1.00 45.07 H new ATOM 17 N GLN B 2 27.567 48.955 21.720 1.00 45.50 N ANISOU 17 N GLN B 2 5609 4633 7045 -1646 -2436 1732 N ATOM 18 CA GLN B 2 27.870 47.521 21.790 1.00 44.65 C ANISOU 18 CA GLN B 2 5265 4607 7092 -1551 -2486 1888 C ATOM 19 C GLN B 2 26.603 46.676 21.834 1.00 47.03 C ANISOU 19 C GLN B 2 5856 5098 6914 -1361 -2170 1614 C ATOM 20 O GLN B 2 25.612 47.046 22.471 1.00 43.85 O ANISOU 20 O GLN B 2 5948 4695 6017 -1432 -2136 1347 O ATOM 21 CB GLN B 2 28.726 47.216 23.017 1.00 53.37 C ANISOU 21 CB GLN B 2 6434 5528 8315 -1886 -3148 2109 C ATOM 22 CG GLN B 2 29.943 48.113 23.182 1.00 65.03 C ANISOU 22 CG GLN B 2 7739 6793 10176 -2018 -3462 2369 C ATOM 23 CD GLN B 2 31.125 47.668 22.336 1.00 75.83 C ANISOU 23 CD GLN B 2 8442 8117 12254 -1821 -3336 2744 C ATOM 24 OE1 GLN B 2 31.232 48.019 21.160 1.00 83.78 O ANISOU 24 OE1 GLN B 2 9082 9179 13573 -1623 -2937 2785 O ATOM 25 NE2 GLN B 2 32.025 46.893 22.938 1.00 77.81 N ANISOU 25 NE2 GLN B 2 8590 8214 12761 -1870 -3613 3028 N ATOM 0 H GLN B 2 27.211 49.272 22.436 1.00 45.50 H new ATOM 0 HA GLN B 2 28.360 47.292 20.985 1.00 44.65 H new ATOM 0 HB2 GLN B 2 28.172 47.294 23.810 1.00 53.37 H new ATOM 0 HB3 GLN B 2 29.023 46.294 22.968 1.00 53.37 H new ATOM 0 HG2 GLN B 2 29.704 49.022 22.943 1.00 65.03 H new ATOM 0 HG3 GLN B 2 30.206 48.125 24.116 1.00 65.03 H new ATOM 0 HE21 GLN B 2 31.917 46.668 23.761 1.00 77.81 H new ATOM 0 HE22 GLN B 2 32.714 46.617 22.504 1.00 77.81 H new ATOM 34 N LEU B 3 26.658 45.525 21.169 1.00 44.68 N ANISOU 34 N LEU B 3 5252 4929 6795 -1120 -1925 1700 N ATOM 35 CA LEU B 3 25.511 44.644 21.039 1.00 34.30 C ANISOU 35 CA LEU B 3 4133 3784 5115 -927 -1622 1476 C ATOM 36 C LEU B 3 25.873 43.179 21.336 1.00 34.66 C ANISOU 36 C LEU B 3 4022 3862 5285 -885 -1731 1628 C ATOM 37 O LEU B 3 26.929 42.702 20.934 1.00 47.20 O ANISOU 37 O LEU B 3 5192 5394 7347 -832 -1775 1916 O ATOM 38 CB LEU B 3 24.940 44.766 19.637 1.00 34.97 C ANISOU 38 CB LEU B 3 4078 3992 5216 -627 -1113 1366 C ATOM 39 CG LEU B 3 24.564 46.190 19.202 1.00 35.05 C ANISOU 39 CG LEU B 3 4203 3976 5139 -631 -963 1236 C ATOM 40 CD1 LEU B 3 25.362 46.611 17.976 1.00 46.94 C ANISOU 40 CD1 LEU B 3 5337 5446 7052 -481 -742 1416 C ATOM 41 CD2 LEU B 3 23.078 46.280 18.921 1.00 43.30 C ANISOU 41 CD2 LEU B 3 5525 5138 5789 -488 -658 951 C ATOM 0 H LEU B 3 27.368 45.235 20.780 1.00 44.68 H new ATOM 0 HA LEU B 3 24.848 44.915 21.693 1.00 34.30 H new ATOM 0 HB2 LEU B 3 25.588 44.412 19.008 1.00 34.97 H new ATOM 0 HB3 LEU B 3 24.150 44.206 19.576 1.00 34.97 H new ATOM 0 HG LEU B 3 24.781 46.796 19.927 1.00 35.05 H new ATOM 0 HD11 LEU B 3 25.109 47.512 17.719 1.00 46.94 H new ATOM 0 HD12 LEU B 3 26.309 46.588 18.183 1.00 46.94 H new ATOM 0 HD13 LEU B 3 25.176 46.002 17.244 1.00 46.94 H new ATOM 0 HD21 LEU B 3 22.854 47.183 18.648 1.00 43.30 H new ATOM 0 HD22 LEU B 3 22.845 45.661 18.212 1.00 43.30 H new ATOM 0 HD23 LEU B 3 22.582 46.053 19.723 1.00 43.30 H new ATOM 53 N GLN B 4 24.986 42.478 22.041 1.00 38.27 N ANISOU 53 N GLN B 4 4809 4386 5346 -898 -1740 1453 N ATOM 54 CA GLN B 4 25.167 41.056 22.326 1.00 36.36 C ANISOU 54 CA GLN B 4 4462 4182 5171 -843 -1806 1566 C ATOM 55 C GLN B 4 23.822 40.334 22.320 1.00 41.61 C ANISOU 55 C GLN B 4 5385 4980 5444 -694 -1510 1308 C ATOM 56 O GLN B 4 22.961 40.599 23.163 1.00 40.67 O ANISOU 56 O GLN B 4 5682 4841 4930 -802 -1548 1118 O ATOM 57 CB GLN B 4 25.867 40.855 23.669 1.00 44.55 C ANISOU 57 CB GLN B 4 5638 5075 6214 -1135 -2357 1740 C ATOM 58 CG GLN B 4 26.108 39.396 24.020 1.00 56.10 C ANISOU 58 CG GLN B 4 6982 6563 7771 -1086 -2451 1887 C ATOM 59 CD GLN B 4 26.919 38.673 22.963 1.00 64.43 C ANISOU 59 CD GLN B 4 7478 7639 9362 -862 -2228 2130 C ATOM 60 OE1 GLN B 4 28.114 38.927 22.802 1.00 70.56 O ANISOU 60 OE1 GLN B 4 7910 8285 10615 -939 -2329 2364 O ATOM 61 NE2 GLN B 4 26.268 37.772 22.227 1.00 54.40 N ANISOU 61 NE2 GLN B 4 6168 6497 8005 -597 -1807 2009 N ATOM 0 H GLN B 4 24.264 42.813 22.367 1.00 38.27 H new ATOM 0 HA GLN B 4 25.727 40.679 21.630 1.00 36.36 H new ATOM 0 HB2 GLN B 4 26.718 41.321 23.654 1.00 44.55 H new ATOM 0 HB3 GLN B 4 25.332 41.263 24.368 1.00 44.55 H new ATOM 0 HG2 GLN B 4 26.570 39.343 24.871 1.00 56.10 H new ATOM 0 HG3 GLN B 4 25.255 38.948 24.132 1.00 56.10 H new ATOM 0 HE21 GLN B 4 25.433 37.622 22.370 1.00 54.40 H new ATOM 0 HE22 GLN B 4 26.683 37.340 21.610 1.00 54.40 H new ATOM 70 N GLU B 5 23.659 39.427 21.355 1.00 37.81 N ANISOU 70 N GLU B 5 4672 4598 5095 -446 -1201 1318 N ATOM 71 CA GLU B 5 22.408 38.711 21.145 1.00 29.70 C ANISOU 71 CA GLU B 5 3822 3681 3783 -299 -933 1102 C ATOM 72 C GLU B 5 22.306 37.441 21.962 1.00 30.92 C ANISOU 72 C GLU B 5 4060 3839 3849 -334 -1059 1143 C ATOM 73 O GLU B 5 23.319 36.862 22.371 1.00 37.34 O ANISOU 73 O GLU B 5 4702 4589 4898 -404 -1301 1374 O ATOM 74 CB GLU B 5 22.232 38.315 19.675 1.00 31.92 C ANISOU 74 CB GLU B 5 3901 4029 4197 -36 -573 1081 C ATOM 75 CG GLU B 5 22.358 39.418 18.679 1.00 32.47 C ANISOU 75 CG GLU B 5 3884 4090 4363 42 -399 1063 C ATOM 76 CD GLU B 5 23.767 39.578 18.181 1.00 25.11 C ANISOU 76 CD GLU B 5 2623 3061 3855 73 -404 1331 C ATOM 77 OE1 GLU B 5 24.725 39.211 18.908 1.00 29.17 O ANISOU 77 OE1 GLU B 5 2970 3497 4617 -50 -669 1552 O ATOM 78 OE2 GLU B 5 23.942 40.052 17.062 1.00 29.31 O ANISOU 78 OE2 GLU B 5 3058 3573 4508 222 -143 1352 O ATOM 0 H GLU B 5 24.280 39.211 20.801 1.00 37.81 H new ATOM 0 HA GLU B 5 21.716 39.330 21.426 1.00 29.70 H new ATOM 0 HB2 GLU B 5 22.889 37.634 19.461 1.00 31.92 H new ATOM 0 HB3 GLU B 5 21.358 37.908 19.571 1.00 31.92 H new ATOM 0 HG2 GLU B 5 21.770 39.242 17.928 1.00 32.47 H new ATOM 0 HG3 GLU B 5 22.063 40.250 19.081 1.00 32.47 H new ATOM 85 N SER B 6 21.068 37.006 22.159 1.00 30.46 N ANISOU 85 N SER B 6 4236 3841 3499 -277 -887 942 N ATOM 86 CA SER B 6 20.774 35.698 22.726 1.00 33.04 C ANISOU 86 CA SER B 6 4634 4180 3741 -261 -912 955 C ATOM 87 C SER B 6 19.403 35.205 22.242 1.00 30.11 C ANISOU 87 C SER B 6 4349 3882 3210 -110 -604 756 C ATOM 88 O SER B 6 18.620 35.971 21.673 1.00 28.65 O ANISOU 88 O SER B 6 4210 3724 2952 -52 -422 613 O ATOM 89 CB SER B 6 20.823 35.757 24.256 1.00 43.90 C ANISOU 89 CB SER B 6 6338 5458 4883 -487 -1203 978 C ATOM 90 OG SER B 6 19.780 36.555 24.776 1.00 39.27 O ANISOU 90 OG SER B 6 6120 4829 3970 -550 -1078 775 O ATOM 0 H SER B 6 20.368 37.467 21.965 1.00 30.46 H new ATOM 0 HA SER B 6 21.448 35.068 22.425 1.00 33.04 H new ATOM 0 HB2 SER B 6 20.757 34.860 24.618 1.00 43.90 H new ATOM 0 HB3 SER B 6 21.679 36.115 24.540 1.00 43.90 H new ATOM 0 HG SER B 6 19.829 36.569 25.614 1.00 39.27 H new ATOM 96 N GLY B 7 19.116 33.914 22.446 1.00 30.11 N ANISOU 96 N GLY B 7 4350 3896 3193 -54 -568 770 N ATOM 97 CA GLY B 7 17.781 33.392 22.227 1.00 31.95 C ANISOU 97 CA GLY B 7 4677 4160 3302 39 -347 610 C ATOM 98 C GLY B 7 17.647 32.435 21.056 1.00 32.67 C ANISOU 98 C GLY B 7 4592 4289 3532 214 -197 606 C ATOM 99 O GLY B 7 16.556 31.916 20.809 1.00 31.31 O ANISOU 99 O GLY B 7 4477 4122 3299 272 -71 495 O ATOM 0 H GLY B 7 19.688 33.330 22.712 1.00 30.11 H new ATOM 0 HA2 GLY B 7 17.490 32.937 23.033 1.00 31.95 H new ATOM 0 HA3 GLY B 7 17.176 34.138 22.088 1.00 31.95 H new ATOM 103 N GLY B 8 18.738 32.218 20.333 1.00 28.12 N ANISOU 103 N GLY B 8 3824 3704 3156 293 -200 739 N ATOM 104 CA GLY B 8 18.726 31.327 19.182 1.00 27.74 C ANISOU 104 CA GLY B 8 3704 3638 3199 463 -23 737 C ATOM 105 C GLY B 8 18.438 29.902 19.623 1.00 28.38 C ANISOU 105 C GLY B 8 3825 3697 3262 480 -25 750 C ATOM 106 O GLY B 8 18.385 29.613 20.808 1.00 30.12 O ANISOU 106 O GLY B 8 4103 3920 3421 369 -161 788 O ATOM 0 H GLY B 8 19.501 32.580 20.494 1.00 28.12 H new ATOM 0 HA2 GLY B 8 18.053 31.618 18.547 1.00 27.74 H new ATOM 0 HA3 GLY B 8 19.582 31.365 18.727 1.00 27.74 H new ATOM 110 N GLY B 9 18.253 29.009 18.667 1.00 21.83 N ANISOU 110 N GLY B 9 3012 2819 2463 613 129 720 N ATOM 111 CA GLY B 9 18.006 27.624 18.987 1.00 19.74 C ANISOU 111 CA GLY B 9 2786 2514 2200 636 143 734 C ATOM 112 C GLY B 9 17.595 26.808 17.782 1.00 18.73 C ANISOU 112 C GLY B 9 2769 2301 2048 764 302 653 C ATOM 113 O GLY B 9 17.559 27.288 16.656 1.00 22.91 O ANISOU 113 O GLY B 9 3376 2790 2537 842 401 596 O ATOM 0 H GLY B 9 18.267 29.188 17.826 1.00 21.83 H new ATOM 0 HA2 GLY B 9 18.807 27.238 19.376 1.00 19.74 H new ATOM 0 HA3 GLY B 9 17.310 27.571 19.661 1.00 19.74 H new ATOM 117 N LEU B 10 17.315 25.542 18.077 1.00 21.07 N ANISOU 117 N LEU B 10 3113 2546 2348 774 313 657 N ATOM 118 CA LEU B 10 16.770 24.567 17.137 1.00 23.16 C ANISOU 118 CA LEU B 10 3550 2694 2557 853 411 567 C ATOM 119 C LEU B 10 15.256 24.526 17.285 1.00 21.13 C ANISOU 119 C LEU B 10 3375 2453 2199 754 292 415 C ATOM 120 O LEU B 10 14.766 24.261 18.384 1.00 22.13 O ANISOU 120 O LEU B 10 3439 2625 2346 667 226 426 O ATOM 121 CB LEU B 10 17.356 23.196 17.426 1.00 22.87 C ANISOU 121 CB LEU B 10 3497 2567 2626 915 495 679 C ATOM 122 CG LEU B 10 16.853 22.049 16.546 1.00 25.60 C ANISOU 122 CG LEU B 10 4077 2751 2900 983 595 587 C ATOM 123 CD1 LEU B 10 17.279 22.301 15.091 1.00 25.62 C ANISOU 123 CD1 LEU B 10 4288 2615 2830 1112 778 557 C ATOM 124 CD2 LEU B 10 17.362 20.710 17.057 1.00 27.35 C ANISOU 124 CD2 LEU B 10 4261 2888 3242 1032 680 705 C ATOM 0 H LEU B 10 17.442 25.214 18.862 1.00 21.07 H new ATOM 0 HA LEU B 10 17.000 24.822 16.230 1.00 23.16 H new ATOM 0 HB2 LEU B 10 18.320 23.251 17.335 1.00 22.87 H new ATOM 0 HB3 LEU B 10 17.171 22.974 18.352 1.00 22.87 H new ATOM 0 HG LEU B 10 15.884 22.015 16.583 1.00 25.60 H new ATOM 0 HD11 LEU B 10 16.962 21.576 14.530 1.00 25.62 H new ATOM 0 HD12 LEU B 10 16.898 23.138 14.782 1.00 25.62 H new ATOM 0 HD13 LEU B 10 18.247 22.349 15.041 1.00 25.62 H new ATOM 0 HD21 LEU B 10 17.032 19.999 16.486 1.00 27.35 H new ATOM 0 HD22 LEU B 10 18.332 20.708 17.048 1.00 27.35 H new ATOM 0 HD23 LEU B 10 17.047 20.568 17.964 1.00 27.35 H new ATOM 136 N VAL B 11 14.548 24.826 16.196 1.00 22.51 N ANISOU 136 N VAL B 11 3694 2568 2292 767 265 303 N ATOM 137 CA VAL B 11 13.098 25.072 16.177 1.00 22.04 C ANISOU 137 CA VAL B 11 3645 2501 2226 668 120 204 C ATOM 138 C VAL B 11 12.410 24.134 15.185 1.00 22.10 C ANISOU 138 C VAL B 11 3864 2340 2192 665 33 131 C ATOM 139 O VAL B 11 12.969 23.871 14.144 1.00 26.00 O ANISOU 139 O VAL B 11 4586 2723 2568 749 96 112 O ATOM 140 CB VAL B 11 12.814 26.530 15.762 1.00 24.85 C ANISOU 140 CB VAL B 11 3970 2921 2552 652 76 166 C ATOM 141 CG1 VAL B 11 11.319 26.806 15.708 1.00 28.85 C ANISOU 141 CG1 VAL B 11 4433 3390 3139 561 -66 114 C ATOM 142 CG2 VAL B 11 13.532 27.482 16.708 1.00 32.04 C ANISOU 142 CG2 VAL B 11 4728 3963 3483 634 139 229 C ATOM 0 H VAL B 11 14.909 24.895 15.418 1.00 22.51 H new ATOM 0 HA VAL B 11 12.752 24.910 17.068 1.00 22.04 H new ATOM 0 HB VAL B 11 13.156 26.675 14.866 1.00 24.85 H new ATOM 0 HG11 VAL B 11 11.169 27.728 15.445 1.00 28.85 H new ATOM 0 HG12 VAL B 11 10.904 26.214 15.061 1.00 28.85 H new ATOM 0 HG13 VAL B 11 10.930 26.652 16.583 1.00 28.85 H new ATOM 0 HG21 VAL B 11 13.351 28.398 16.444 1.00 32.04 H new ATOM 0 HG22 VAL B 11 13.216 27.338 17.614 1.00 32.04 H new ATOM 0 HG23 VAL B 11 14.487 27.317 16.670 1.00 32.04 H new ATOM 152 N GLN B 12 11.235 23.598 15.523 1.00 24.65 N ANISOU 152 N GLN B 12 4139 2609 2619 566 -100 107 N ATOM 153 CA GLN B 12 10.450 22.828 14.549 1.00 23.90 C ANISOU 153 CA GLN B 12 4253 2323 2504 516 -278 46 C ATOM 154 C GLN B 12 9.657 23.779 13.660 1.00 27.11 C ANISOU 154 C GLN B 12 4713 2687 2901 458 -484 9 C ATOM 155 O GLN B 12 9.233 24.824 14.118 1.00 26.46 O ANISOU 155 O GLN B 12 4405 2715 2934 430 -490 41 O ATOM 156 CB GLN B 12 9.490 21.873 15.250 1.00 27.08 C ANISOU 156 CB GLN B 12 4537 2655 3097 417 -364 69 C ATOM 157 CG GLN B 12 10.132 20.803 16.078 1.00 29.34 C ANISOU 157 CG GLN B 12 4802 2953 3394 463 -196 113 C ATOM 158 CD GLN B 12 9.108 20.035 16.890 1.00 36.23 C ANISOU 158 CD GLN B 12 5526 3761 4478 366 -245 152 C ATOM 159 OE1 GLN B 12 8.306 19.281 16.342 1.00 37.57 O ANISOU 159 OE1 GLN B 12 5782 3756 4737 285 -420 127 O ATOM 160 NE2 GLN B 12 9.122 20.234 18.199 1.00 30.16 N ANISOU 160 NE2 GLN B 12 4566 3105 3789 366 -97 223 N ATOM 0 H GLN B 12 10.876 23.666 16.302 1.00 24.65 H new ATOM 0 HA GLN B 12 11.065 22.307 14.010 1.00 23.90 H new ATOM 0 HB2 GLN B 12 8.902 22.392 15.821 1.00 27.08 H new ATOM 0 HB3 GLN B 12 8.933 21.449 14.579 1.00 27.08 H new ATOM 0 HG2 GLN B 12 10.613 20.190 15.500 1.00 29.34 H new ATOM 0 HG3 GLN B 12 10.785 21.202 16.674 1.00 29.34 H new ATOM 0 HE21 GLN B 12 9.698 20.769 18.546 1.00 30.16 H new ATOM 0 HE22 GLN B 12 8.555 19.828 18.702 1.00 30.16 H new ATOM 169 N PRO B 13 9.430 23.405 12.390 1.00 25.70 N ANISOU 169 N PRO B 13 4872 2319 2576 436 -663 -49 N ATOM 170 CA PRO B 13 8.561 24.207 11.522 1.00 26.35 C ANISOU 170 CA PRO B 13 5025 2325 2661 355 -945 -57 C ATOM 171 C PRO B 13 7.240 24.525 12.202 1.00 27.76 C ANISOU 171 C PRO B 13 4830 2525 3193 230 -1123 24 C ATOM 172 O PRO B 13 6.628 23.634 12.812 1.00 31.44 O ANISOU 172 O PRO B 13 5154 2925 3865 156 -1170 61 O ATOM 173 CB PRO B 13 8.367 23.304 10.302 1.00 33.78 C ANISOU 173 CB PRO B 13 6446 2994 3395 301 -1170 -122 C ATOM 174 CG PRO B 13 9.616 22.465 10.263 1.00 36.08 C ANISOU 174 CG PRO B 13 6982 3247 3479 441 -844 -163 C ATOM 175 CD PRO B 13 9.917 22.191 11.714 1.00 30.93 C ANISOU 175 CD PRO B 13 5910 2789 3054 475 -626 -100 C ATOM 0 HA PRO B 13 8.938 25.072 11.296 1.00 26.35 H new ATOM 0 HB2 PRO B 13 7.573 22.754 10.391 1.00 33.78 H new ATOM 0 HB3 PRO B 13 8.263 23.823 9.489 1.00 33.78 H new ATOM 0 HG2 PRO B 13 9.476 21.643 9.768 1.00 36.08 H new ATOM 0 HG3 PRO B 13 10.346 22.935 9.831 1.00 36.08 H new ATOM 0 HD2 PRO B 13 9.461 21.396 12.031 1.00 30.93 H new ATOM 0 HD3 PRO B 13 10.865 22.053 11.864 1.00 30.93 H new ATOM 183 N GLY B 14 6.841 25.785 12.134 1.00 27.76 N ANISOU 183 N GLY B 14 4658 2599 3291 224 -1169 67 N ATOM 184 CA GLY B 14 5.642 26.251 12.794 1.00 31.97 C ANISOU 184 CA GLY B 14 4809 3127 4209 141 -1244 178 C ATOM 185 C GLY B 14 5.890 26.778 14.189 1.00 29.71 C ANISOU 185 C GLY B 14 4244 3015 4030 206 -888 210 C ATOM 186 O GLY B 14 5.001 27.367 14.785 1.00 30.31 O ANISOU 186 O GLY B 14 4037 3073 4405 175 -835 306 O ATOM 0 H GLY B 14 7.263 26.396 11.700 1.00 27.76 H new ATOM 0 HA2 GLY B 14 5.237 26.951 12.258 1.00 31.97 H new ATOM 0 HA3 GLY B 14 5.002 25.523 12.840 1.00 31.97 H new ATOM 190 N GLY B 15 7.094 26.572 14.717 1.00 26.93 N ANISOU 190 N GLY B 15 3993 2796 3445 294 -644 148 N ATOM 191 CA GLY B 15 7.412 26.986 16.072 1.00 22.57 C ANISOU 191 CA GLY B 15 3275 2373 2927 328 -367 176 C ATOM 192 C GLY B 15 7.811 28.447 16.206 1.00 21.12 C ANISOU 192 C GLY B 15 3050 2307 2669 372 -248 169 C ATOM 193 O GLY B 15 7.848 29.184 15.222 1.00 25.40 O ANISOU 193 O GLY B 15 3655 2846 3152 391 -362 150 O ATOM 0 H GLY B 15 7.743 26.191 14.300 1.00 26.93 H new ATOM 0 HA2 GLY B 15 6.642 26.819 16.638 1.00 22.57 H new ATOM 0 HA3 GLY B 15 8.135 26.433 16.406 1.00 22.57 H new ATOM 197 N SER B 16 8.131 28.825 17.440 1.00 23.65 N ANISOU 197 N SER B 16 3311 2707 2968 380 -29 187 N ATOM 198 CA SER B 16 8.474 30.191 17.803 1.00 24.29 C ANISOU 198 CA SER B 16 3379 2870 2981 398 96 181 C ATOM 199 C SER B 16 9.839 30.272 18.457 1.00 22.33 C ANISOU 199 C SER B 16 3240 2731 2514 414 180 165 C ATOM 200 O SER B 16 10.301 29.317 19.073 1.00 23.74 O ANISOU 200 O SER B 16 3465 2916 2640 405 198 185 O ATOM 201 CB SER B 16 7.446 30.765 18.777 1.00 24.14 C ANISOU 201 CB SER B 16 3246 2775 3153 368 282 238 C ATOM 202 OG SER B 16 6.208 31.004 18.134 1.00 34.51 O ANISOU 202 OG SER B 16 4381 3971 4759 355 197 304 O ATOM 0 H SER B 16 8.155 28.279 18.104 1.00 23.65 H new ATOM 0 HA SER B 16 8.482 30.704 16.980 1.00 24.29 H new ATOM 0 HB2 SER B 16 7.316 30.148 19.515 1.00 24.14 H new ATOM 0 HB3 SER B 16 7.782 31.593 19.155 1.00 24.14 H new ATOM 0 HG SER B 16 6.116 31.828 18.000 1.00 34.51 H new ATOM 208 N LEU B 17 10.447 31.447 18.343 1.00 22.93 N ANISOU 208 N LEU B 17 3339 2873 2499 426 208 150 N ATOM 209 CA LEU B 17 11.689 31.755 19.043 1.00 21.33 C ANISOU 209 CA LEU B 17 3207 2746 2152 407 237 169 C ATOM 210 C LEU B 17 11.666 33.235 19.359 1.00 23.44 C ANISOU 210 C LEU B 17 3500 3023 2383 374 306 152 C ATOM 211 O LEU B 17 11.100 34.020 18.599 1.00 26.80 O ANISOU 211 O LEU B 17 3867 3434 2881 407 318 129 O ATOM 212 CB LEU B 17 12.891 31.376 18.164 1.00 25.87 C ANISOU 212 CB LEU B 17 3785 3362 2682 474 167 194 C ATOM 213 CG LEU B 17 14.262 31.107 18.753 1.00 35.73 C ANISOU 213 CG LEU B 17 5028 4649 3898 461 143 281 C ATOM 214 CD1 LEU B 17 14.246 29.914 19.702 1.00 31.39 C ANISOU 214 CD1 LEU B 17 4506 4076 3344 424 125 325 C ATOM 215 CD2 LEU B 17 15.208 30.864 17.579 1.00 29.39 C ANISOU 215 CD2 LEU B 17 4199 3833 3136 570 169 326 C ATOM 0 H LEU B 17 10.150 32.091 17.856 1.00 22.93 H new ATOM 0 HA LEU B 17 11.771 31.248 19.866 1.00 21.33 H new ATOM 0 HB2 LEU B 17 12.637 30.580 17.671 1.00 25.87 H new ATOM 0 HB3 LEU B 17 13.000 32.089 17.516 1.00 25.87 H new ATOM 0 HG LEU B 17 14.555 31.865 19.283 1.00 35.73 H new ATOM 0 HD11 LEU B 17 15.137 29.772 20.059 1.00 31.39 H new ATOM 0 HD12 LEU B 17 13.630 30.088 20.431 1.00 31.39 H new ATOM 0 HD13 LEU B 17 13.961 29.121 19.221 1.00 31.39 H new ATOM 0 HD21 LEU B 17 16.101 30.687 17.914 1.00 29.39 H new ATOM 0 HD22 LEU B 17 14.898 30.101 17.066 1.00 29.39 H new ATOM 0 HD23 LEU B 17 15.226 31.649 17.010 1.00 29.39 H new ATOM 227 N ARG B 18 12.255 33.622 20.479 1.00 23.48 N ANISOU 227 N ARG B 18 3623 3030 2269 299 332 170 N ATOM 228 CA ARG B 18 12.351 35.033 20.835 1.00 21.71 C ANISOU 228 CA ARG B 18 3486 2785 1976 250 390 147 C ATOM 229 C ARG B 18 13.799 35.416 21.068 1.00 23.75 C ANISOU 229 C ARG B 18 3792 3091 2142 186 240 194 C ATOM 230 O ARG B 18 14.435 34.932 22.004 1.00 27.26 O ANISOU 230 O ARG B 18 4345 3516 2495 103 138 249 O ATOM 231 CB ARG B 18 11.529 35.328 22.077 1.00 25.12 C ANISOU 231 CB ARG B 18 4108 3096 2340 190 573 131 C ATOM 232 CG ARG B 18 11.528 36.795 22.485 1.00 25.91 C ANISOU 232 CG ARG B 18 4370 3126 2348 140 676 95 C ATOM 233 CD ARG B 18 10.751 36.922 23.780 1.00 30.48 C ANISOU 233 CD ARG B 18 5228 3529 2822 96 926 86 C ATOM 234 NE ARG B 18 10.611 38.288 24.262 1.00 34.34 N ANISOU 234 NE ARG B 18 5953 3893 3202 53 1090 45 N ATOM 235 CZ ARG B 18 9.755 39.181 23.775 1.00 40.84 C ANISOU 235 CZ ARG B 18 6658 4651 4208 130 1295 38 C ATOM 236 NH1 ARG B 18 8.979 38.877 22.744 1.00 37.87 N ANISOU 236 NH1 ARG B 18 5935 4330 4124 239 1314 80 N ATOM 237 NH2 ARG B 18 9.691 40.391 24.312 1.00 42.81 N ANISOU 237 NH2 ARG B 18 7091 4758 4416 86 1390 2 N ATOM 0 H ARG B 18 12.607 33.084 21.050 1.00 23.48 H new ATOM 0 HA ARG B 18 11.999 35.559 20.100 1.00 21.71 H new ATOM 0 HB2 ARG B 18 10.614 35.044 21.923 1.00 25.12 H new ATOM 0 HB3 ARG B 18 11.871 34.797 22.813 1.00 25.12 H new ATOM 0 HG2 ARG B 18 12.436 37.115 22.602 1.00 25.91 H new ATOM 0 HG3 ARG B 18 11.123 37.339 21.792 1.00 25.91 H new ATOM 0 HD2 ARG B 18 9.867 36.543 23.653 1.00 30.48 H new ATOM 0 HD3 ARG B 18 11.192 36.393 24.463 1.00 30.48 H new ATOM 0 HE ARG B 18 11.120 38.536 24.910 1.00 34.34 H new ATOM 0 HH11 ARG B 18 9.027 38.097 22.385 1.00 37.87 H new ATOM 0 HH12 ARG B 18 8.428 39.460 22.434 1.00 37.87 H new ATOM 0 HH21 ARG B 18 10.202 40.596 24.973 1.00 42.81 H new ATOM 0 HH22 ARG B 18 9.139 40.971 24.000 1.00 42.81 H new ATOM 251 N LEU B 19 14.325 36.253 20.183 1.00 21.49 N ANISOU 251 N LEU B 19 3409 2847 1910 223 210 198 N ATOM 252 CA LEU B 19 15.688 36.758 20.324 1.00 20.58 C ANISOU 252 CA LEU B 19 3277 2746 1796 158 70 277 C ATOM 253 C LEU B 19 15.724 38.040 21.134 1.00 22.13 C ANISOU 253 C LEU B 19 3656 2873 1878 32 56 244 C ATOM 254 O LEU B 19 14.789 38.830 21.087 1.00 22.21 O ANISOU 254 O LEU B 19 3745 2842 1854 52 218 159 O ATOM 255 CB LEU B 19 16.310 37.014 18.944 1.00 20.50 C ANISOU 255 CB LEU B 19 3086 2780 1921 270 91 318 C ATOM 256 CG LEU B 19 16.167 35.888 17.925 1.00 23.02 C ANISOU 256 CG LEU B 19 3328 3118 2302 407 150 324 C ATOM 257 CD1 LEU B 19 16.927 36.244 16.641 1.00 24.53 C ANISOU 257 CD1 LEU B 19 3439 3299 2582 519 222 379 C ATOM 258 CD2 LEU B 19 16.632 34.542 18.448 1.00 24.60 C ANISOU 258 CD2 LEU B 19 3506 3311 2530 400 89 398 C ATOM 0 H LEU B 19 13.908 36.543 19.489 1.00 21.49 H new ATOM 0 HA LEU B 19 16.201 36.081 20.793 1.00 20.58 H new ATOM 0 HB2 LEU B 19 15.909 37.815 18.572 1.00 20.50 H new ATOM 0 HB3 LEU B 19 17.255 37.199 19.064 1.00 20.50 H new ATOM 0 HG LEU B 19 15.219 35.800 17.739 1.00 23.02 H new ATOM 0 HD11 LEU B 19 16.832 35.524 15.998 1.00 24.53 H new ATOM 0 HD12 LEU B 19 16.564 37.062 16.266 1.00 24.53 H new ATOM 0 HD13 LEU B 19 17.867 36.372 16.846 1.00 24.53 H new ATOM 0 HD21 LEU B 19 16.517 33.869 17.759 1.00 24.60 H new ATOM 0 HD22 LEU B 19 17.569 34.596 18.693 1.00 24.60 H new ATOM 0 HD23 LEU B 19 16.108 34.299 19.227 1.00 24.60 H new ATOM 270 N SER B 20 16.838 38.236 21.841 1.00 22.80 N ANISOU 270 N SER B 20 3810 2922 1932 -102 -156 333 N ATOM 271 CA SER B 20 17.094 39.393 22.667 1.00 24.14 C ANISOU 271 CA SER B 20 4220 2987 1963 -262 -246 314 C ATOM 272 C SER B 20 18.463 39.955 22.356 1.00 28.06 C ANISOU 272 C SER B 20 4554 3482 2626 -336 -473 444 C ATOM 273 O SER B 20 19.396 39.224 22.041 1.00 28.59 O ANISOU 273 O SER B 20 4381 3589 2894 -310 -609 593 O ATOM 274 CB SER B 20 17.041 39.038 24.161 1.00 31.32 C ANISOU 274 CB SER B 20 5493 3779 2630 -420 -363 316 C ATOM 275 OG SER B 20 15.791 38.497 24.519 1.00 43.32 O ANISOU 275 OG SER B 20 7155 5267 4038 -345 -105 225 O ATOM 0 H SER B 20 17.486 37.670 21.846 1.00 22.80 H new ATOM 0 HA SER B 20 16.406 40.048 22.474 1.00 24.14 H new ATOM 0 HB2 SER B 20 17.742 38.401 24.368 1.00 31.32 H new ATOM 0 HB3 SER B 20 17.214 39.832 24.690 1.00 31.32 H new ATOM 0 HG SER B 20 15.797 37.667 24.389 1.00 43.32 H new ATOM 281 N CYS B 21 18.587 41.260 22.480 1.00 26.75 N ANISOU 281 N CYS B 21 4511 3240 2411 -430 -496 406 N ATOM 282 CA CYS B 21 19.873 41.893 22.360 1.00 32.50 C ANISOU 282 CA CYS B 21 5101 3924 3324 -540 -740 548 C ATOM 283 C CYS B 21 19.959 43.053 23.323 1.00 34.81 C ANISOU 283 C CYS B 21 5756 4053 3417 -759 -897 497 C ATOM 284 O CYS B 21 19.149 43.984 23.286 1.00 30.96 O ANISOU 284 O CYS B 21 5466 3517 2781 -738 -675 349 O ATOM 285 CB CYS B 21 20.110 42.367 20.942 1.00 32.68 C ANISOU 285 CB CYS B 21 4801 4022 3592 -376 -562 580 C ATOM 286 SG CYS B 21 21.784 43.082 20.741 1.00 42.65 S ANISOU 286 SG CYS B 21 5807 5198 5201 -495 -821 813 S ATOM 0 H CYS B 21 17.934 41.797 22.635 1.00 26.75 H new ATOM 0 HA CYS B 21 20.561 41.245 22.578 1.00 32.50 H new ATOM 0 HB2 CYS B 21 19.999 41.624 20.329 1.00 32.68 H new ATOM 0 HB3 CYS B 21 19.443 43.031 20.706 1.00 32.68 H new ATOM 291 N VAL B 22 20.966 42.984 24.180 1.00 31.68 N ANISOU 291 N VAL B 22 5461 3545 3031 -979 -1299 637 N ATOM 292 CA VAL B 22 21.249 44.039 25.121 1.00 34.62 C ANISOU 292 CA VAL B 22 6237 3715 3200 -1236 -1547 612 C ATOM 293 C VAL B 22 22.152 45.035 24.443 1.00 41.33 C ANISOU 293 C VAL B 22 6810 4537 4358 -1288 -1675 722 C ATOM 294 O VAL B 22 23.182 44.665 23.865 1.00 38.76 O ANISOU 294 O VAL B 22 6035 4261 4433 -1262 -1835 941 O ATOM 295 CB VAL B 22 21.918 43.497 26.394 1.00 46.22 C ANISOU 295 CB VAL B 22 7999 5040 4524 -1487 -2010 735 C ATOM 296 CG1 VAL B 22 22.168 44.622 27.376 1.00 47.96 C ANISOU 296 CG1 VAL B 22 8683 4989 4550 -1741 -2212 686 C ATOM 297 CG2 VAL B 22 21.050 42.423 27.012 1.00 43.81 C ANISOU 297 CG2 VAL B 22 7904 4756 3988 -1394 -1801 632 C ATOM 0 H VAL B 22 21.506 42.316 24.228 1.00 31.68 H new ATOM 0 HA VAL B 22 20.418 44.458 25.393 1.00 34.62 H new ATOM 0 HB VAL B 22 22.775 43.105 26.162 1.00 46.22 H new ATOM 0 HG11 VAL B 22 22.590 44.267 28.174 1.00 47.96 H new ATOM 0 HG12 VAL B 22 22.750 45.283 26.970 1.00 47.96 H new ATOM 0 HG13 VAL B 22 21.324 45.037 27.614 1.00 47.96 H new ATOM 0 HG21 VAL B 22 21.476 42.084 27.815 1.00 43.81 H new ATOM 0 HG22 VAL B 22 20.184 42.797 27.239 1.00 43.81 H new ATOM 0 HG23 VAL B 22 20.932 41.698 26.379 1.00 43.81 H new ATOM 307 N VAL B 23 21.745 46.297 24.511 1.00 39.65 N ANISOU 307 N VAL B 23 6861 4220 3985 -1349 -1559 584 N ATOM 308 CA VAL B 23 22.413 47.367 23.806 1.00 38.95 C ANISOU 308 CA VAL B 23 6533 4097 4170 -1378 -1603 659 C ATOM 309 C VAL B 23 22.964 48.363 24.798 1.00 46.44 C ANISOU 309 C VAL B 23 7885 4788 4971 -1705 -1985 673 C ATOM 310 O VAL B 23 22.295 48.721 25.766 1.00 51.39 O ANISOU 310 O VAL B 23 9106 5257 5163 -1829 -1963 504 O ATOM 311 CB VAL B 23 21.454 48.097 22.852 1.00 37.90 C ANISOU 311 CB VAL B 23 6337 4051 4012 -1156 -1127 495 C ATOM 312 CG1 VAL B 23 22.219 49.067 21.969 1.00 38.45 C ANISOU 312 CG1 VAL B 23 6100 4103 4406 -1149 -1139 601 C ATOM 313 CG2 VAL B 23 20.679 47.106 22.008 1.00 39.26 C ANISOU 313 CG2 VAL B 23 6255 4431 4232 -871 -795 450 C ATOM 0 H VAL B 23 21.067 46.553 24.973 1.00 39.65 H new ATOM 0 HA VAL B 23 23.131 46.975 23.284 1.00 38.95 H new ATOM 0 HB VAL B 23 20.820 48.602 23.385 1.00 37.90 H new ATOM 0 HG11 VAL B 23 21.601 49.519 21.374 1.00 38.45 H new ATOM 0 HG12 VAL B 23 22.671 49.722 22.523 1.00 38.45 H new ATOM 0 HG13 VAL B 23 22.874 48.580 21.445 1.00 38.45 H new ATOM 0 HG21 VAL B 23 20.081 47.585 21.414 1.00 39.26 H new ATOM 0 HG22 VAL B 23 21.298 46.574 21.483 1.00 39.26 H new ATOM 0 HG23 VAL B 23 20.162 46.523 22.586 1.00 39.26 H new ATOM 323 N SER B 24 24.187 48.810 24.545 1.00 48.23 N ANISOU 323 N SER B 24 7811 4940 5575 -1846 -2321 888 N ATOM 324 CA SER B 24 24.770 49.909 25.301 1.00 49.87 C ANISOU 324 CA SER B 24 8361 4881 5707 -2175 -2721 916 C ATOM 325 C SER B 24 25.172 51.010 24.335 1.00 47.94 C ANISOU 325 C SER B 24 7784 4628 5805 -2125 -2589 969 C ATOM 326 O SER B 24 25.910 50.769 23.382 1.00 53.87 O ANISOU 326 O SER B 24 7934 5482 7053 -1995 -2547 1179 O ATOM 327 CB SER B 24 25.970 49.431 26.125 1.00 66.34 C ANISOU 327 CB SER B 24 10390 6844 7971 -2373 -3281 1201 C ATOM 328 OG SER B 24 26.937 48.800 25.307 1.00 74.41 O ANISOU 328 OG SER B 24 10713 7965 9596 -2302 -3403 1485 O ATOM 0 H SER B 24 24.700 48.487 23.934 1.00 48.23 H new ATOM 0 HA SER B 24 24.114 50.255 25.926 1.00 49.87 H new ATOM 0 HB2 SER B 24 26.373 50.186 26.582 1.00 66.34 H new ATOM 0 HB3 SER B 24 25.669 48.813 26.809 1.00 66.34 H new ATOM 0 HG SER B 24 26.983 49.198 24.569 1.00 74.41 H new ATOM 334 N GLY B 25 24.670 52.216 24.585 1.00 49.05 N ANISOU 334 N GLY B 25 8344 4619 5675 -2216 -2477 783 N ATOM 335 CA GLY B 25 24.946 53.363 23.737 1.00 50.88 C ANISOU 335 CA GLY B 25 8332 4820 6180 -2175 -2328 810 C ATOM 336 C GLY B 25 23.721 53.802 22.961 1.00 44.85 C ANISOU 336 C GLY B 25 7599 4193 5248 -1878 -1710 589 C ATOM 337 O GLY B 25 22.799 53.010 22.725 1.00 45.79 O ANISOU 337 O GLY B 25 7699 4490 5208 -1645 -1381 480 O ATOM 0 H GLY B 25 24.158 52.389 25.254 1.00 49.05 H new ATOM 0 HA2 GLY B 25 25.263 54.099 24.283 1.00 50.88 H new ATOM 0 HA3 GLY B 25 25.659 53.142 23.117 1.00 50.88 H new ATOM 341 N ASP B 26 23.718 55.067 22.553 1.00 50.10 N ANISOU 341 N ASP B 26 8293 4758 5984 -1895 -1577 545 N ATOM 342 CA ASP B 26 22.595 55.649 21.829 1.00 47.74 C ANISOU 342 CA ASP B 26 8024 4547 5568 -1637 -1036 369 C ATOM 343 C ASP B 26 22.691 55.369 20.344 1.00 46.89 C ANISOU 343 C ASP B 26 7328 4673 5816 -1341 -758 480 C ATOM 344 O ASP B 26 23.789 55.337 19.789 1.00 43.70 O ANISOU 344 O ASP B 26 6522 4276 5807 -1362 -919 695 O ATOM 345 CB ASP B 26 22.542 57.156 22.054 1.00 46.20 C ANISOU 345 CB ASP B 26 8154 4117 5282 -1783 -1002 278 C ATOM 346 CG ASP B 26 22.211 57.517 23.488 1.00 65.92 C ANISOU 346 CG ASP B 26 11395 6333 7318 -2044 -1161 121 C ATOM 347 OD1 ASP B 26 21.013 57.488 23.847 1.00 75.02 O ANISOU 347 OD1 ASP B 26 12914 7458 8132 -1917 -779 -67 O ATOM 348 OD2 ASP B 26 23.149 57.828 24.253 1.00 66.31 O ANISOU 348 OD2 ASP B 26 11625 6217 7352 -2325 -1638 210 O ATOM 0 H ASP B 26 24.369 55.613 22.689 1.00 50.10 H new ATOM 0 HA ASP B 26 21.785 55.239 22.170 1.00 47.74 H new ATOM 0 HB2 ASP B 26 23.397 57.546 21.815 1.00 46.20 H new ATOM 0 HB3 ASP B 26 21.878 57.545 21.464 1.00 46.20 H new ATOM 353 N TYR B 27 21.536 55.203 19.701 1.00 34.95 N ANISOU 353 N TYR B 27 5793 3310 4176 -1070 -336 352 N ATOM 354 CA TYR B 27 21.482 54.926 18.276 1.00 33.70 C ANISOU 354 CA TYR B 27 5206 3340 4257 -790 -74 434 C ATOM 355 C TYR B 27 20.258 55.568 17.614 1.00 30.92 C ANISOU 355 C TYR B 27 4931 3031 3786 -585 317 301 C ATOM 356 O TYR B 27 19.265 55.868 18.281 1.00 30.80 O ANISOU 356 O TYR B 27 5244 2938 3522 -605 451 148 O ATOM 357 CB TYR B 27 21.465 53.415 18.038 1.00 30.56 C ANISOU 357 CB TYR B 27 4606 3119 3886 -658 -86 489 C ATOM 358 CG TYR B 27 20.373 52.693 18.804 1.00 38.66 C ANISOU 358 CG TYR B 27 5915 4185 4588 -642 -28 331 C ATOM 359 CD1 TYR B 27 19.104 52.552 18.263 1.00 30.58 C ANISOU 359 CD1 TYR B 27 4907 3259 3454 -429 292 220 C ATOM 360 CD2 TYR B 27 20.611 52.153 20.067 1.00 35.96 C ANISOU 360 CD2 TYR B 27 5827 3760 4076 -847 -304 318 C ATOM 361 CE1 TYR B 27 18.100 51.916 18.954 1.00 31.95 C ANISOU 361 CE1 TYR B 27 5295 3439 3407 -410 378 109 C ATOM 362 CE2 TYR B 27 19.609 51.510 20.766 1.00 42.10 C ANISOU 362 CE2 TYR B 27 6879 4548 4570 -819 -194 187 C ATOM 363 CZ TYR B 27 18.357 51.391 20.199 1.00 39.73 C ANISOU 363 CZ TYR B 27 6540 4341 4216 -594 168 88 C ATOM 364 OH TYR B 27 17.348 50.758 20.880 1.00 39.95 O ANISOU 364 OH TYR B 27 6792 4351 4035 -559 309 -9 O ATOM 0 H TYR B 27 20.766 55.249 20.081 1.00 34.95 H new ATOM 0 HA TYR B 27 22.274 55.314 17.873 1.00 33.70 H new ATOM 0 HB2 TYR B 27 21.351 53.246 17.090 1.00 30.56 H new ATOM 0 HB3 TYR B 27 22.326 53.045 18.291 1.00 30.56 H new ATOM 0 HD1 TYR B 27 18.929 52.894 17.416 1.00 30.58 H new ATOM 0 HD2 TYR B 27 21.458 52.227 20.444 1.00 35.96 H new ATOM 0 HE1 TYR B 27 17.251 51.841 18.581 1.00 31.95 H new ATOM 0 HE2 TYR B 27 19.777 51.160 21.611 1.00 42.10 H new ATOM 0 HH TYR B 27 17.637 50.486 21.620 1.00 39.95 H new ATOM 374 N TYR B 28 20.348 55.757 16.302 1.00 28.41 N ANISOU 374 N TYR B 28 4322 2808 3666 -384 509 384 N ATOM 375 CA TYR B 28 19.243 56.267 15.499 1.00 26.45 C ANISOU 375 CA TYR B 28 4090 2605 3353 -178 822 309 C ATOM 376 C TYR B 28 18.364 55.119 15.012 1.00 26.55 C ANISOU 376 C TYR B 28 4027 2782 3279 14 921 280 C ATOM 377 O TYR B 28 17.141 55.225 14.966 1.00 27.18 O ANISOU 377 O TYR B 28 4202 2869 3257 112 1086 196 O ATOM 378 CB TYR B 28 19.770 57.068 14.310 1.00 26.03 C ANISOU 378 CB TYR B 28 3831 2542 3519 -68 954 424 C ATOM 379 CG TYR B 28 18.695 57.811 13.561 1.00 30.75 C ANISOU 379 CG TYR B 28 4478 3144 4060 107 1219 370 C ATOM 380 CD1 TYR B 28 17.983 57.195 12.534 1.00 29.70 C ANISOU 380 CD1 TYR B 28 4251 3140 3893 330 1340 391 C ATOM 381 CD2 TYR B 28 18.388 59.136 13.872 1.00 33.44 C ANISOU 381 CD2 TYR B 28 4980 3334 4391 39 1327 313 C ATOM 382 CE1 TYR B 28 16.990 57.871 11.847 1.00 36.55 C ANISOU 382 CE1 TYR B 28 5149 3992 4744 473 1515 380 C ATOM 383 CE2 TYR B 28 17.399 59.817 13.181 1.00 38.74 C ANISOU 383 CE2 TYR B 28 5662 3995 5061 207 1564 299 C ATOM 384 CZ TYR B 28 16.705 59.177 12.174 1.00 43.33 C ANISOU 384 CZ TYR B 28 6114 4713 5636 419 1636 345 C ATOM 385 OH TYR B 28 15.720 59.837 11.482 1.00 45.91 O ANISOU 385 OH TYR B 28 6437 5013 5995 569 1804 368 O ATOM 0 H TYR B 28 21.060 55.591 15.848 1.00 28.41 H new ATOM 0 HA TYR B 28 18.708 56.854 16.055 1.00 26.45 H new ATOM 0 HB2 TYR B 28 20.432 57.703 14.625 1.00 26.03 H new ATOM 0 HB3 TYR B 28 20.223 56.466 13.699 1.00 26.03 H new ATOM 0 HD1 TYR B 28 18.178 56.315 12.306 1.00 29.70 H new ATOM 0 HD2 TYR B 28 18.853 59.568 14.552 1.00 33.44 H new ATOM 0 HE1 TYR B 28 16.518 57.445 11.168 1.00 36.55 H new ATOM 0 HE2 TYR B 28 17.204 60.701 13.395 1.00 38.74 H new ATOM 0 HH TYR B 28 15.646 60.620 11.778 1.00 45.91 H new ATOM 395 N ALA B 29 18.998 54.002 14.670 1.00 24.07 N ANISOU 395 N ALA B 29 3534 2571 3040 60 817 368 N ATOM 396 CA ALA B 29 18.305 52.858 14.111 1.00 20.58 C ANISOU 396 CA ALA B 29 3036 2262 2522 227 879 350 C ATOM 397 C ALA B 29 18.900 51.598 14.694 1.00 21.89 C ANISOU 397 C ALA B 29 3149 2478 2689 156 700 389 C ATOM 398 O ALA B 29 20.105 51.547 14.936 1.00 24.67 O ANISOU 398 O ALA B 29 3385 2784 3204 52 557 507 O ATOM 399 CB ALA B 29 18.430 52.847 12.588 1.00 27.89 C ANISOU 399 CB ALA B 29 3831 3234 3532 431 1027 439 C ATOM 0 H ALA B 29 19.846 53.890 14.758 1.00 24.07 H new ATOM 0 HA ALA B 29 17.362 52.910 14.333 1.00 20.58 H new ATOM 0 HB1 ALA B 29 17.962 52.077 12.230 1.00 27.89 H new ATOM 0 HB2 ALA B 29 18.041 53.658 12.225 1.00 27.89 H new ATOM 0 HB3 ALA B 29 19.367 52.799 12.340 1.00 27.89 H new ATOM 405 N ILE B 30 18.049 50.615 14.940 1.00 21.55 N ANISOU 405 N ILE B 30 3171 2511 2507 205 700 314 N ATOM 406 CA ILE B 30 18.506 49.297 15.343 1.00 23.25 C ANISOU 406 CA ILE B 30 3330 2783 2721 175 559 355 C ATOM 407 C ILE B 30 17.669 48.250 14.614 1.00 25.60 C ANISOU 407 C ILE B 30 3602 3177 2948 345 646 321 C ATOM 408 O ILE B 30 16.501 48.462 14.340 1.00 22.73 O ANISOU 408 O ILE B 30 3305 2821 2511 417 740 245 O ATOM 409 CB ILE B 30 18.432 49.140 16.856 1.00 27.15 C ANISOU 409 CB ILE B 30 4018 3217 3081 -22 396 293 C ATOM 410 CG1 ILE B 30 19.122 47.852 17.289 1.00 26.67 C ANISOU 410 CG1 ILE B 30 3874 3201 3058 -70 211 375 C ATOM 411 CG2 ILE B 30 17.005 49.168 17.351 1.00 25.43 C ANISOU 411 CG2 ILE B 30 4001 2979 2681 4 540 154 C ATOM 412 CD1 ILE B 30 19.599 47.921 18.704 1.00 32.21 C ANISOU 412 CD1 ILE B 30 4770 3798 3670 -311 -45 381 C ATOM 0 H ILE B 30 17.195 50.692 14.879 1.00 21.55 H new ATOM 0 HA ILE B 30 19.437 49.176 15.100 1.00 23.25 H new ATOM 0 HB ILE B 30 18.894 49.894 17.254 1.00 27.15 H new ATOM 0 HG12 ILE B 30 18.507 47.108 17.192 1.00 26.67 H new ATOM 0 HG13 ILE B 30 19.875 47.676 16.703 1.00 26.67 H new ATOM 0 HG21 ILE B 30 16.995 49.066 18.316 1.00 25.43 H new ATOM 0 HG22 ILE B 30 16.596 50.014 17.112 1.00 25.43 H new ATOM 0 HG23 ILE B 30 16.507 48.442 16.944 1.00 25.43 H new ATOM 0 HD11 ILE B 30 20.031 47.085 18.941 1.00 32.21 H new ATOM 0 HD12 ILE B 30 20.232 48.650 18.797 1.00 32.21 H new ATOM 0 HD13 ILE B 30 18.844 48.073 19.293 1.00 32.21 H new ATOM 424 N GLY B 31 18.258 47.115 14.267 1.00 21.09 N ANISOU 424 N GLY B 31 2932 2652 2429 406 607 396 N ATOM 425 CA GLY B 31 17.502 46.113 13.558 1.00 20.96 C ANISOU 425 CA GLY B 31 2947 2692 2325 544 659 358 C ATOM 426 C GLY B 31 18.110 44.740 13.699 1.00 23.23 C ANISOU 426 C GLY B 31 3176 3006 2643 559 601 418 C ATOM 427 O GLY B 31 19.139 44.558 14.345 1.00 23.42 O ANISOU 427 O GLY B 31 3100 3007 2791 468 510 514 O ATOM 0 H GLY B 31 19.078 46.913 14.431 1.00 21.09 H new ATOM 0 HA2 GLY B 31 16.592 46.099 13.893 1.00 20.96 H new ATOM 0 HA3 GLY B 31 17.455 46.350 12.619 1.00 20.96 H new ATOM 431 N TRP B 32 17.422 43.782 13.111 1.00 19.66 N ANISOU 431 N TRP B 32 2794 2581 2096 663 626 374 N ATOM 432 CA TRP B 32 17.841 42.389 13.073 1.00 17.91 C ANISOU 432 CA TRP B 32 2556 2366 1885 707 611 420 C ATOM 433 C TRP B 32 18.110 42.010 11.652 1.00 19.75 C ANISOU 433 C TRP B 32 2878 2536 2091 879 765 467 C ATOM 434 O TRP B 32 17.342 42.344 10.731 1.00 20.31 O ANISOU 434 O TRP B 32 3102 2581 2035 953 793 410 O ATOM 435 CB TRP B 32 16.760 41.490 13.668 1.00 20.06 C ANISOU 435 CB TRP B 32 2895 2680 2045 665 512 321 C ATOM 436 CG TRP B 32 16.594 41.665 15.125 1.00 20.30 C ANISOU 436 CG TRP B 32 2920 2730 2065 510 416 287 C ATOM 437 CD1 TRP B 32 15.733 42.514 15.752 1.00 21.37 C ANISOU 437 CD1 TRP B 32 3128 2846 2147 437 432 209 C ATOM 438 CD2 TRP B 32 17.303 40.979 16.161 1.00 19.35 C ANISOU 438 CD2 TRP B 32 2770 2612 1970 411 303 344 C ATOM 439 NE1 TRP B 32 15.866 42.409 17.108 1.00 22.46 N ANISOU 439 NE1 TRP B 32 3349 2959 2227 299 361 196 N ATOM 440 CE2 TRP B 32 16.820 41.470 17.388 1.00 21.47 C ANISOU 440 CE2 TRP B 32 3163 2855 2140 270 244 279 C ATOM 441 CE3 TRP B 32 18.310 40.008 16.170 1.00 20.41 C ANISOU 441 CE3 TRP B 32 2802 2742 2210 432 257 461 C ATOM 442 CZ2 TRP B 32 17.295 41.017 18.613 1.00 23.77 C ANISOU 442 CZ2 TRP B 32 3529 3120 2384 133 95 316 C ATOM 443 CZ3 TRP B 32 18.775 39.568 17.375 1.00 20.18 C ANISOU 443 CZ3 TRP B 32 2771 2704 2194 299 91 518 C ATOM 444 CH2 TRP B 32 18.271 40.077 18.587 1.00 21.61 C ANISOU 444 CH2 TRP B 32 3125 2863 2224 142 -12 440 C ATOM 0 H TRP B 32 16.675 43.924 12.709 1.00 19.66 H new ATOM 0 HA TRP B 32 18.647 42.276 13.601 1.00 17.91 H new ATOM 0 HB2 TRP B 32 15.916 41.675 13.228 1.00 20.06 H new ATOM 0 HB3 TRP B 32 16.980 40.564 13.482 1.00 20.06 H new ATOM 0 HD1 TRP B 32 15.139 43.084 15.319 1.00 21.37 H new ATOM 0 HE1 TRP B 32 15.422 42.860 17.690 1.00 22.46 H new ATOM 0 HE3 TRP B 32 18.654 39.671 15.374 1.00 20.41 H new ATOM 0 HZ2 TRP B 32 16.958 41.345 19.415 1.00 23.77 H new ATOM 0 HZ3 TRP B 32 19.439 38.918 17.396 1.00 20.18 H new ATOM 0 HH2 TRP B 32 18.617 39.760 19.390 1.00 21.61 H new ATOM 455 N PHE B 33 19.193 41.255 11.460 1.00 18.91 N ANISOU 455 N PHE B 33 2708 2372 2105 946 871 588 N ATOM 456 CA PHE B 33 19.697 40.896 10.145 1.00 21.90 C ANISOU 456 CA PHE B 33 3227 2629 2466 1128 1112 662 C ATOM 457 C PHE B 33 20.050 39.452 10.217 1.00 30.79 C ANISOU 457 C PHE B 33 4376 3708 3614 1183 1164 706 C ATOM 458 O PHE B 33 20.406 38.971 11.291 1.00 33.96 O ANISOU 458 O PHE B 33 4580 4165 4157 1085 1039 755 O ATOM 459 CB PHE B 33 20.907 41.744 9.757 1.00 23.49 C ANISOU 459 CB PHE B 33 3286 2738 2901 1188 1317 830 C ATOM 460 CG PHE B 33 20.604 43.214 9.729 1.00 23.62 C ANISOU 460 CG PHE B 33 3277 2791 2906 1127 1270 789 C ATOM 461 CD1 PHE B 33 20.614 43.940 10.900 1.00 25.25 C ANISOU 461 CD1 PHE B 33 3303 3075 3215 944 1068 770 C ATOM 462 CD2 PHE B 33 20.276 43.849 8.544 1.00 34.01 C ANISOU 462 CD2 PHE B 33 4804 4036 4083 1232 1402 766 C ATOM 463 CE1 PHE B 33 20.280 45.287 10.891 1.00 31.29 C ANISOU 463 CE1 PHE B 33 4078 3851 3961 890 1048 723 C ATOM 464 CE2 PHE B 33 19.959 45.189 8.532 1.00 29.53 C ANISOU 464 CE2 PHE B 33 4206 3498 3518 1190 1376 736 C ATOM 465 CZ PHE B 33 19.971 45.900 9.699 1.00 28.08 C ANISOU 465 CZ PHE B 33 3820 3393 3457 1022 1214 713 C ATOM 0 H PHE B 33 19.660 40.934 12.106 1.00 18.91 H new ATOM 0 HA PHE B 33 19.029 41.061 9.461 1.00 21.90 H new ATOM 0 HB2 PHE B 33 21.627 41.579 10.385 1.00 23.49 H new ATOM 0 HB3 PHE B 33 21.224 41.467 8.883 1.00 23.49 H new ATOM 0 HD1 PHE B 33 20.846 43.526 11.700 1.00 25.25 H new ATOM 0 HD2 PHE B 33 20.270 43.367 7.749 1.00 34.01 H new ATOM 0 HE1 PHE B 33 20.265 45.771 11.685 1.00 31.29 H new ATOM 0 HE2 PHE B 33 19.737 45.609 7.732 1.00 29.53 H new ATOM 0 HZ PHE B 33 19.768 46.808 9.687 1.00 28.08 H new ATOM 475 N ARG B 34 19.893 38.743 9.113 1.00 21.62 N ANISOU 475 N ARG B 34 3502 2427 2288 1326 1325 685 N ATOM 476 CA ARG B 34 20.202 37.312 9.123 1.00 22.54 C ANISOU 476 CA ARG B 34 3682 2465 2416 1374 1392 722 C ATOM 477 C ARG B 34 21.061 36.916 7.948 1.00 25.06 C ANISOU 477 C ARG B 34 4191 2568 2762 1462 1644 855 C ATOM 478 O ARG B 34 21.036 37.532 6.880 1.00 27.80 O ANISOU 478 O ARG B 34 4759 2798 3006 1504 1721 863 O ATOM 479 CB ARG B 34 18.923 36.474 9.138 1.00 25.82 C ANISOU 479 CB ARG B 34 4320 2919 2572 1334 1196 548 C ATOM 480 CG ARG B 34 18.152 36.464 7.825 1.00 25.61 C ANISOU 480 CG ARG B 34 4665 2755 2312 1354 1125 459 C ATOM 481 CD ARG B 34 16.794 35.743 8.027 1.00 27.56 C ANISOU 481 CD ARG B 34 5045 3044 2380 1271 856 313 C ATOM 482 NE ARG B 34 15.953 35.836 6.827 1.00 29.54 N ANISOU 482 NE ARG B 34 5626 3154 2446 1262 708 238 N ATOM 483 CZ ARG B 34 14.722 35.351 6.736 1.00 32.99 C ANISOU 483 CZ ARG B 34 6197 3575 2761 1173 424 146 C ATOM 484 NH1 ARG B 34 14.185 34.713 7.757 1.00 25.95 N ANISOU 484 NH1 ARG B 34 5150 2799 1908 1101 292 119 N ATOM 485 NH2 ARG B 34 14.035 35.479 5.610 1.00 34.50 N ANISOU 485 NH2 ARG B 34 6687 3611 2809 1147 255 102 N ATOM 0 H ARG B 34 19.616 39.055 8.361 1.00 21.62 H new ATOM 0 HA ARG B 34 20.702 37.137 9.935 1.00 22.54 H new ATOM 0 HB2 ARG B 34 19.152 35.561 9.371 1.00 25.82 H new ATOM 0 HB3 ARG B 34 18.341 36.808 9.838 1.00 25.82 H new ATOM 0 HG2 ARG B 34 18.004 37.372 7.519 1.00 25.61 H new ATOM 0 HG3 ARG B 34 18.669 36.014 7.139 1.00 25.61 H new ATOM 0 HD2 ARG B 34 16.950 34.810 8.243 1.00 27.56 H new ATOM 0 HD3 ARG B 34 16.327 36.134 8.782 1.00 27.56 H new ATOM 0 HE ARG B 34 16.281 36.231 6.137 1.00 29.54 H new ATOM 0 HH11 ARG B 34 14.633 34.611 8.484 1.00 25.95 H new ATOM 0 HH12 ARG B 34 13.387 34.399 7.696 1.00 25.95 H new ATOM 0 HH21 ARG B 34 14.387 35.878 4.934 1.00 34.50 H new ATOM 0 HH22 ARG B 34 13.237 35.163 5.555 1.00 34.50 H new ATOM 499 N GLN B 35 21.837 35.868 8.153 1.00 28.02 N ANISOU 499 N GLN B 35 4492 2873 3284 1495 1794 975 N ATOM 500 CA GLN B 35 22.759 35.428 7.135 1.00 29.69 C ANISOU 500 CA GLN B 35 4874 2862 3544 1576 2106 1138 C ATOM 501 C GLN B 35 22.772 33.906 7.126 1.00 34.56 C ANISOU 501 C GLN B 35 5636 3397 4100 1610 2182 1141 C ATOM 502 O GLN B 35 23.186 33.257 8.087 1.00 32.85 O ANISOU 502 O GLN B 35 5128 3259 4093 1583 2172 1206 O ATOM 503 CB GLN B 35 24.140 36.036 7.388 1.00 30.79 C ANISOU 503 CB GLN B 35 4650 2972 4077 1563 2308 1379 C ATOM 504 CG GLN B 35 25.200 35.672 6.357 1.00 39.26 C ANISOU 504 CG GLN B 35 5812 3833 5271 1636 2624 1501 C ATOM 505 CD GLN B 35 26.436 36.543 6.477 1.00 43.64 C ANISOU 505 CD GLN B 35 6009 4344 6230 1612 2767 1713 C ATOM 506 OE1 GLN B 35 26.891 36.856 7.578 1.00 49.43 O ANISOU 506 OE1 GLN B 35 6323 5172 7284 1521 2649 1844 O ATOM 507 NE2 GLN B 35 26.984 36.945 5.335 1.00 56.01 N ANISOU 507 NE2 GLN B 35 7741 5744 7797 1685 2999 1760 N ATOM 0 H GLN B 35 21.843 35.400 8.875 1.00 28.02 H new ATOM 0 HA GLN B 35 22.483 35.730 6.256 1.00 29.69 H new ATOM 0 HB2 GLN B 35 24.053 37.002 7.416 1.00 30.79 H new ATOM 0 HB3 GLN B 35 24.448 35.753 8.263 1.00 30.79 H new ATOM 0 HG2 GLN B 35 25.450 34.741 6.467 1.00 39.26 H new ATOM 0 HG3 GLN B 35 24.827 35.763 5.466 1.00 39.26 H new ATOM 0 HE21 GLN B 35 26.638 36.706 4.585 1.00 56.01 H new ATOM 0 HE22 GLN B 35 27.684 37.444 5.346 1.00 56.01 H new ATOM 516 N ALA B 36 22.245 33.359 6.035 1.00 45.20 N ANISOU 516 N ALA B 36 8212 5003 3960 3260 2199 1018 N ATOM 517 CA ALA B 36 22.202 31.924 5.817 1.00 48.64 C ANISOU 517 CA ALA B 36 9132 5144 4204 3427 2364 1046 C ATOM 518 C ALA B 36 23.551 31.495 5.279 1.00 53.10 C ANISOU 518 C ALA B 36 9640 5817 4717 3782 2577 1116 C ATOM 519 O ALA B 36 24.305 32.331 4.775 1.00 53.40 O ANISOU 519 O ALA B 36 9314 6102 4872 3811 2619 1105 O ATOM 520 CB ALA B 36 21.077 31.566 4.853 1.00 52.70 C ANISOU 520 CB ALA B 36 10088 5301 4634 3173 2382 905 C ATOM 0 H ALA B 36 21.899 33.819 5.395 1.00 45.20 H new ATOM 0 HA ALA B 36 22.021 31.458 6.648 1.00 48.64 H new ATOM 0 HB1 ALA B 36 21.060 30.606 4.717 1.00 52.70 H new ATOM 0 HB2 ALA B 36 20.228 31.854 5.224 1.00 52.70 H new ATOM 0 HB3 ALA B 36 21.225 32.010 4.003 1.00 52.70 H new ATOM 526 N PRO B 37 23.865 30.189 5.372 1.00 58.31 N ANISOU 526 N PRO B 37 10667 6285 5205 4054 2750 1183 N ATOM 527 CA PRO B 37 25.181 29.687 4.966 1.00 62.89 C ANISOU 527 CA PRO B 37 11182 6978 5735 4458 2968 1251 C ATOM 528 C PRO B 37 25.591 30.122 3.560 1.00 63.60 C ANISOU 528 C PRO B 37 11226 7080 5859 4431 3125 1175 C ATOM 529 O PRO B 37 24.858 29.852 2.613 1.00 63.67 O ANISOU 529 O PRO B 37 11654 6780 5756 4255 3184 1080 O ATOM 530 CB PRO B 37 25.006 28.163 5.037 1.00 66.21 C ANISOU 530 CB PRO B 37 12200 7033 5924 4665 3151 1301 C ATOM 531 CG PRO B 37 23.929 27.961 6.075 1.00 63.36 C ANISOU 531 CG PRO B 37 12028 6525 5519 4439 3007 1308 C ATOM 532 CD PRO B 37 22.995 29.117 5.896 1.00 60.84 C ANISOU 532 CD PRO B 37 11484 6265 5368 3997 2783 1191 C ATOM 0 HA PRO B 37 25.887 30.034 5.533 1.00 62.89 H new ATOM 0 HB2 PRO B 37 24.744 27.796 4.178 1.00 66.21 H new ATOM 0 HB3 PRO B 37 25.832 27.723 5.293 1.00 66.21 H new ATOM 0 HG2 PRO B 37 23.471 27.116 5.945 1.00 63.36 H new ATOM 0 HG3 PRO B 37 24.302 27.947 6.970 1.00 63.36 H new ATOM 0 HD2 PRO B 37 22.279 28.904 5.277 1.00 60.84 H new ATOM 0 HD3 PRO B 37 22.579 29.373 6.734 1.00 60.84 H new ATOM 540 N GLY B 38 26.725 30.812 3.451 1.00 65.13 N ANISOU 540 N GLY B 38 10910 7640 6198 4582 3197 1194 N ATOM 541 CA GLY B 38 27.249 31.261 2.169 1.00 67.27 C ANISOU 541 CA GLY B 38 11111 7960 6487 4574 3414 1135 C ATOM 542 C GLY B 38 26.505 32.409 1.495 1.00 63.43 C ANISOU 542 C GLY B 38 10591 7458 6052 4180 3325 1052 C ATOM 543 O GLY B 38 26.817 32.762 0.354 1.00 65.50 O ANISOU 543 O GLY B 38 10899 7721 6266 4156 3526 1010 O ATOM 0 H GLY B 38 27.213 31.033 4.124 1.00 65.13 H new ATOM 0 HA2 GLY B 38 28.172 31.530 2.296 1.00 67.27 H new ATOM 0 HA3 GLY B 38 27.255 30.505 1.562 1.00 67.27 H new ATOM 547 N LYS B 39 25.536 33.005 2.189 1.00 58.40 N ANISOU 547 N LYS B 39 9886 6811 5491 3895 3045 1031 N ATOM 548 CA LYS B 39 24.709 34.060 1.598 1.00 55.09 C ANISOU 548 CA LYS B 39 9479 6355 5098 3558 2941 956 C ATOM 549 C LYS B 39 25.020 35.437 2.188 1.00 52.52 C ANISOU 549 C LYS B 39 8595 6361 4999 3398 2845 975 C ATOM 550 O LYS B 39 25.848 35.575 3.087 1.00 53.23 O ANISOU 550 O LYS B 39 8259 6727 5239 3516 2828 1012 O ATOM 551 CB LYS B 39 23.223 33.745 1.793 1.00 55.78 C ANISOU 551 CB LYS B 39 9938 6154 5100 3328 2714 877 C ATOM 552 CG LYS B 39 22.765 32.435 1.168 1.00 58.90 C ANISOU 552 CG LYS B 39 10916 6188 5274 3387 2810 805 C ATOM 553 CD LYS B 39 22.729 32.538 -0.342 1.00 60.52 C ANISOU 553 CD LYS B 39 11402 6283 5308 3352 2947 706 C ATOM 554 CE LYS B 39 21.995 31.375 -0.985 1.00 65.75 C ANISOU 554 CE LYS B 39 12666 6580 5738 3301 2978 561 C ATOM 555 NZ LYS B 39 21.910 31.540 -2.471 1.00 63.23 N ANISOU 555 NZ LYS B 39 12638 6189 5197 3258 3074 441 N ATOM 0 H LYS B 39 25.340 32.814 3.004 1.00 58.40 H new ATOM 0 HA LYS B 39 24.918 34.087 0.651 1.00 55.09 H new ATOM 0 HB2 LYS B 39 23.032 33.720 2.744 1.00 55.78 H new ATOM 0 HB3 LYS B 39 22.699 34.470 1.417 1.00 55.78 H new ATOM 0 HG2 LYS B 39 23.364 31.720 1.433 1.00 58.90 H new ATOM 0 HG3 LYS B 39 21.884 32.205 1.501 1.00 58.90 H new ATOM 0 HD2 LYS B 39 22.299 33.369 -0.597 1.00 60.52 H new ATOM 0 HD3 LYS B 39 23.636 32.572 -0.683 1.00 60.52 H new ATOM 0 HE2 LYS B 39 22.452 30.546 -0.775 1.00 65.75 H new ATOM 0 HE3 LYS B 39 21.102 31.308 -0.613 1.00 65.75 H new ATOM 0 HZ1 LYS B 39 21.476 30.847 -2.823 1.00 63.23 H new ATOM 0 HZ2 LYS B 39 21.472 32.291 -2.662 1.00 63.23 H new ATOM 0 HZ3 LYS B 39 22.731 31.580 -2.813 1.00 63.23 H new ATOM 569 N GLU B 40 24.345 36.457 1.669 1.00 50.11 N ANISOU 569 N GLU B 40 8308 6026 4706 3131 2781 934 N ATOM 570 CA GLU B 40 24.531 37.823 2.145 1.00 48.02 C ANISOU 570 CA GLU B 40 7589 6014 4642 2940 2725 947 C ATOM 571 C GLU B 40 23.642 38.115 3.352 1.00 43.63 C ANISOU 571 C GLU B 40 6931 5464 4183 2790 2419 926 C ATOM 572 O GLU B 40 22.619 37.468 3.540 1.00 42.96 O ANISOU 572 O GLU B 40 7176 5153 3995 2755 2262 891 O ATOM 573 CB GLU B 40 24.221 38.821 1.031 1.00 48.16 C ANISOU 573 CB GLU B 40 7729 5974 4594 2751 2831 944 C ATOM 574 CG GLU B 40 25.016 38.562 -0.233 1.00 57.02 C ANISOU 574 CG GLU B 40 9015 7074 5578 2882 3158 964 C ATOM 575 CD GLU B 40 26.507 38.654 0.002 1.00 61.43 C ANISOU 575 CD GLU B 40 9100 7930 6311 3008 3415 994 C ATOM 576 OE1 GLU B 40 26.936 39.600 0.701 1.00 62.26 O ANISOU 576 OE1 GLU B 40 8721 8285 6649 2853 3400 992 O ATOM 577 OE2 GLU B 40 27.245 37.776 -0.505 1.00 72.65 O ANISOU 577 OE2 GLU B 40 10616 9345 7643 3257 3635 995 O ATOM 0 H GLU B 40 23.770 36.378 1.035 1.00 50.11 H new ATOM 0 HA GLU B 40 25.458 37.916 2.415 1.00 48.02 H new ATOM 0 HB2 GLU B 40 23.274 38.784 0.825 1.00 48.16 H new ATOM 0 HB3 GLU B 40 24.408 39.719 1.347 1.00 48.16 H new ATOM 0 HG2 GLU B 40 24.798 37.681 -0.576 1.00 57.02 H new ATOM 0 HG3 GLU B 40 24.757 39.203 -0.913 1.00 57.02 H new ATOM 584 N ARG B 41 24.045 39.098 4.151 1.00 42.48 N ANISOU 584 N ARG B 41 6323 5578 4239 2681 2361 925 N ATOM 585 CA ARG B 41 23.234 39.561 5.271 1.00 38.68 C ANISOU 585 CA ARG B 41 5727 5122 3847 2527 2098 895 C ATOM 586 C ARG B 41 22.002 40.292 4.763 1.00 36.46 C ANISOU 586 C ARG B 41 5677 4660 3518 2309 2011 870 C ATOM 587 O ARG B 41 22.102 41.179 3.906 1.00 37.79 O ANISOU 587 O ARG B 41 5845 4829 3684 2203 2147 893 O ATOM 588 CB ARG B 41 24.057 40.467 6.193 1.00 43.12 C ANISOU 588 CB ARG B 41 5734 6011 4639 2459 2069 860 C ATOM 589 CG ARG B 41 25.072 39.690 7.031 1.00 52.40 C ANISOU 589 CG ARG B 41 6657 7401 5851 2709 2039 850 C ATOM 590 CD ARG B 41 25.977 40.566 7.892 1.00 57.32 C ANISOU 590 CD ARG B 41 6680 8379 6719 2639 1984 756 C ATOM 591 NE ARG B 41 26.798 39.747 8.788 1.00 69.07 N ANISOU 591 NE ARG B 41 7970 10074 8199 2930 1884 746 N ATOM 592 CZ ARG B 41 27.830 40.199 9.497 1.00 66.34 C ANISOU 592 CZ ARG B 41 7072 10078 8054 2961 1823 644 C ATOM 593 NH1 ARG B 41 28.188 41.475 9.417 1.00 67.64 N ANISOU 593 NH1 ARG B 41 6813 10410 8478 2667 1886 525 N ATOM 594 NH2 ARG B 41 28.517 39.368 10.281 1.00 65.28 N ANISOU 594 NH2 ARG B 41 6816 10127 7862 3288 1707 659 N ATOM 0 H ARG B 41 24.792 39.513 4.060 1.00 42.48 H new ATOM 0 HA ARG B 41 22.945 38.789 5.783 1.00 38.68 H new ATOM 0 HB2 ARG B 41 24.523 41.128 5.658 1.00 43.12 H new ATOM 0 HB3 ARG B 41 23.458 40.951 6.783 1.00 43.12 H new ATOM 0 HG2 ARG B 41 24.595 39.072 7.607 1.00 52.40 H new ATOM 0 HG3 ARG B 41 25.624 39.157 6.438 1.00 52.40 H new ATOM 0 HD2 ARG B 41 26.550 41.103 7.323 1.00 57.32 H new ATOM 0 HD3 ARG B 41 25.438 41.181 8.413 1.00 57.32 H new ATOM 0 HE ARG B 41 26.599 38.914 8.861 1.00 69.07 H new ATOM 0 HH11 ARG B 41 27.753 42.012 8.906 1.00 67.64 H new ATOM 0 HH12 ARG B 41 28.855 41.764 9.876 1.00 67.64 H new ATOM 0 HH21 ARG B 41 28.294 38.539 10.329 1.00 65.28 H new ATOM 0 HH22 ARG B 41 29.184 39.661 10.739 1.00 65.28 H new ATOM 608 N GLU B 42 20.838 39.919 5.283 1.00 33.33 N ANISOU 608 N GLU B 42 5485 4109 3071 2246 1803 823 N ATOM 609 CA GLU B 42 19.608 40.573 4.869 1.00 31.50 C ANISOU 609 CA GLU B 42 5432 3743 2792 2071 1690 766 C ATOM 610 C GLU B 42 18.835 41.042 6.079 1.00 28.27 C ANISOU 610 C GLU B 42 4854 3390 2499 1950 1494 728 C ATOM 611 O GLU B 42 18.769 40.361 7.094 1.00 27.60 O ANISOU 611 O GLU B 42 4728 3319 2440 1989 1406 717 O ATOM 612 CB GLU B 42 18.752 39.647 4.014 1.00 41.99 C ANISOU 612 CB GLU B 42 7212 4821 3921 2074 1650 676 C ATOM 613 CG GLU B 42 18.083 38.507 4.731 1.00 52.48 C ANISOU 613 CG GLU B 42 8715 6002 5222 2065 1545 609 C ATOM 614 CD GLU B 42 17.292 37.648 3.772 1.00 62.13 C ANISOU 614 CD GLU B 42 10375 6986 6245 2001 1532 476 C ATOM 615 OE1 GLU B 42 17.666 37.612 2.583 1.00 62.20 O ANISOU 615 OE1 GLU B 42 10566 6957 6112 2064 1639 468 O ATOM 616 OE2 GLU B 42 16.298 37.026 4.195 1.00 46.96 O ANISOU 616 OE2 GLU B 42 8621 4927 4294 1863 1429 364 O ATOM 0 H GLU B 42 20.741 39.297 5.869 1.00 33.33 H new ATOM 0 HA GLU B 42 19.842 41.343 4.328 1.00 31.50 H new ATOM 0 HB2 GLU B 42 18.066 40.179 3.582 1.00 41.99 H new ATOM 0 HB3 GLU B 42 19.310 39.279 3.311 1.00 41.99 H new ATOM 0 HG2 GLU B 42 18.752 37.965 5.178 1.00 52.48 H new ATOM 0 HG3 GLU B 42 17.494 38.855 5.419 1.00 52.48 H new ATOM 623 N GLY B 43 18.256 42.235 5.981 1.00 29.15 N ANISOU 623 N GLY B 43 4894 3526 2654 1816 1448 722 N ATOM 624 CA GLY B 43 17.490 42.759 7.084 1.00 25.19 C ANISOU 624 CA GLY B 43 4238 3073 2261 1717 1289 675 C ATOM 625 C GLY B 43 16.125 42.113 7.181 1.00 28.80 C ANISOU 625 C GLY B 43 4950 3376 2616 1664 1137 566 C ATOM 626 O GLY B 43 15.447 41.956 6.163 1.00 31.65 O ANISOU 626 O GLY B 43 5588 3626 2810 1631 1099 508 O ATOM 0 H GLY B 43 18.298 42.745 5.290 1.00 29.15 H new ATOM 0 HA2 GLY B 43 17.975 42.615 7.912 1.00 25.19 H new ATOM 0 HA3 GLY B 43 17.387 43.718 6.979 1.00 25.19 H new ATOM 630 N VAL B 44 15.741 41.716 8.392 1.00 24.60 N ANISOU 630 N VAL B 44 4323 2857 2168 1626 1045 519 N ATOM 631 CA VAL B 44 14.410 41.172 8.633 1.00 24.66 C ANISOU 631 CA VAL B 44 4515 2725 2130 1523 951 389 C ATOM 632 C VAL B 44 13.523 42.051 9.524 1.00 24.47 C ANISOU 632 C VAL B 44 4263 2759 2276 1403 809 328 C ATOM 633 O VAL B 44 12.314 41.817 9.592 1.00 25.10 O ANISOU 633 O VAL B 44 4393 2763 2383 1239 688 217 O ATOM 634 CB VAL B 44 14.489 39.766 9.251 1.00 29.12 C ANISOU 634 CB VAL B 44 5237 3166 2663 1539 1006 391 C ATOM 635 CG1 VAL B 44 15.109 38.804 8.239 1.00 32.81 C ANISOU 635 CG1 VAL B 44 5971 3503 2993 1640 1118 424 C ATOM 636 CG2 VAL B 44 15.267 39.769 10.563 1.00 28.16 C ANISOU 636 CG2 VAL B 44 4891 3193 2617 1625 1003 488 C ATOM 0 H VAL B 44 16.241 41.754 9.091 1.00 24.60 H new ATOM 0 HA VAL B 44 13.996 41.138 7.756 1.00 24.66 H new ATOM 0 HB VAL B 44 13.591 39.468 9.463 1.00 29.12 H new ATOM 0 HG11 VAL B 44 15.160 37.916 8.626 1.00 32.81 H new ATOM 0 HG12 VAL B 44 14.560 38.777 7.440 1.00 32.81 H new ATOM 0 HG13 VAL B 44 16.001 39.108 8.008 1.00 32.81 H new ATOM 0 HG21 VAL B 44 15.297 38.869 10.924 1.00 28.16 H new ATOM 0 HG22 VAL B 44 16.171 40.083 10.403 1.00 28.16 H new ATOM 0 HG23 VAL B 44 14.829 40.357 11.198 1.00 28.16 H new ATOM 646 N ALA B 45 14.089 43.038 10.226 1.00 21.37 N ANISOU 646 N ALA B 45 3578 2506 2038 1423 793 386 N ATOM 647 CA ALA B 45 13.292 43.932 11.061 1.00 22.34 C ANISOU 647 CA ALA B 45 3492 2660 2338 1289 646 329 C ATOM 648 C ALA B 45 14.142 45.133 11.474 1.00 22.89 C ANISOU 648 C ALA B 45 3307 2843 2548 1286 653 370 C ATOM 649 O ALA B 45 15.346 44.977 11.728 1.00 23.62 O ANISOU 649 O ALA B 45 3287 3059 2627 1382 751 407 O ATOM 650 CB ALA B 45 12.787 43.197 12.289 1.00 24.73 C ANISOU 650 CB ALA B 45 3806 2940 2652 1275 661 261 C ATOM 0 H ALA B 45 14.933 43.204 10.230 1.00 21.37 H new ATOM 0 HA ALA B 45 12.525 44.242 10.555 1.00 22.34 H new ATOM 0 HB1 ALA B 45 12.260 43.802 12.834 1.00 24.73 H new ATOM 0 HB2 ALA B 45 12.237 42.447 12.014 1.00 24.73 H new ATOM 0 HB3 ALA B 45 13.541 42.872 12.805 1.00 24.73 H new ATOM 656 N ALA B 46 13.533 46.309 11.558 1.00 20.33 N ANISOU 656 N ALA B 46 2880 2479 2366 1175 551 344 N ATOM 657 CA ALA B 46 14.248 47.477 12.039 1.00 21.47 C ANISOU 657 CA ALA B 46 2825 2667 2664 1108 574 336 C ATOM 658 C ALA B 46 13.287 48.409 12.728 1.00 22.47 C ANISOU 658 C ALA B 46 2883 2716 2937 1031 464 247 C ATOM 659 O ALA B 46 12.104 48.403 12.420 1.00 21.94 O ANISOU 659 O ALA B 46 2892 2572 2873 1048 375 237 O ATOM 660 CB ALA B 46 14.972 48.202 10.900 1.00 21.19 C ANISOU 660 CB ALA B 46 2834 2576 2643 1069 695 452 C ATOM 0 H ALA B 46 12.712 46.449 11.343 1.00 20.33 H new ATOM 0 HA ALA B 46 14.922 47.182 12.671 1.00 21.47 H new ATOM 0 HB1 ALA B 46 15.439 48.975 11.253 1.00 21.19 H new ATOM 0 HB2 ALA B 46 15.611 47.600 10.487 1.00 21.19 H new ATOM 0 HB3 ALA B 46 14.325 48.490 10.237 1.00 21.19 H new ATOM 666 N ILE B 47 13.814 49.235 13.630 1.00 21.67 N ANISOU 666 N ILE B 47 2624 2651 2959 952 470 160 N ATOM 667 CA ILE B 47 13.007 50.223 14.343 1.00 18.87 C ANISOU 667 CA ILE B 47 2239 2191 2740 900 409 51 C ATOM 668 C ILE B 47 13.797 51.539 14.467 1.00 19.73 C ANISOU 668 C ILE B 47 2285 2208 3005 751 467 -1 C ATOM 669 O ILE B 47 15.012 51.557 14.628 1.00 22.74 O ANISOU 669 O ILE B 47 2523 2713 3402 650 518 -37 O ATOM 670 CB ILE B 47 12.579 49.684 15.745 1.00 22.36 C ANISOU 670 CB ILE B 47 2622 2748 3125 935 369 -84 C ATOM 671 CG1 ILE B 47 11.505 50.571 16.381 1.00 26.08 C ANISOU 671 CG1 ILE B 47 3087 3104 3719 927 351 -200 C ATOM 672 CG2 ILE B 47 13.771 49.560 16.650 1.00 26.16 C ANISOU 672 CG2 ILE B 47 2985 3413 3540 918 357 -165 C ATOM 673 CD1 ILE B 47 10.868 49.927 17.596 1.00 30.28 C ANISOU 673 CD1 ILE B 47 3611 3732 4160 970 379 -302 C ATOM 0 H ILE B 47 14.647 49.238 13.845 1.00 21.67 H new ATOM 0 HA ILE B 47 12.195 50.394 13.840 1.00 18.87 H new ATOM 0 HB ILE B 47 12.195 48.802 15.619 1.00 22.36 H new ATOM 0 HG12 ILE B 47 11.900 51.419 16.637 1.00 26.08 H new ATOM 0 HG13 ILE B 47 10.819 50.765 15.724 1.00 26.08 H new ATOM 0 HG21 ILE B 47 13.487 49.225 17.515 1.00 26.16 H new ATOM 0 HG22 ILE B 47 14.412 48.945 16.259 1.00 26.16 H new ATOM 0 HG23 ILE B 47 14.185 50.430 16.761 1.00 26.16 H new ATOM 0 HD11 ILE B 47 10.197 50.523 17.964 1.00 30.28 H new ATOM 0 HD12 ILE B 47 10.450 49.090 17.338 1.00 30.28 H new ATOM 0 HD13 ILE B 47 11.549 49.755 18.265 1.00 30.28 H new ATOM 685 N SER B 48 13.065 52.644 14.377 1.00 22.61 N ANISOU 685 N SER B 48 2750 2343 3498 739 468 -17 N ATOM 686 CA SER B 48 13.580 53.988 14.581 1.00 22.93 C ANISOU 686 CA SER B 48 2815 2188 3709 571 556 -96 C ATOM 687 C SER B 48 13.502 54.419 16.038 1.00 23.58 C ANISOU 687 C SER B 48 2815 2301 3846 497 504 -352 C ATOM 688 O SER B 48 12.439 54.340 16.626 1.00 25.76 O ANISOU 688 O SER B 48 3127 2562 4098 637 453 -417 O ATOM 689 CB SER B 48 12.757 54.957 13.762 1.00 24.85 C ANISOU 689 CB SER B 48 3298 2112 4034 671 599 32 C ATOM 690 OG SER B 48 13.067 56.295 14.067 1.00 29.32 O ANISOU 690 OG SER B 48 3972 2392 4775 519 719 -57 O ATOM 0 H SER B 48 12.226 52.629 14.189 1.00 22.61 H new ATOM 0 HA SER B 48 14.512 53.989 14.311 1.00 22.93 H new ATOM 0 HB2 SER B 48 12.913 54.796 12.818 1.00 24.85 H new ATOM 0 HB3 SER B 48 11.814 54.798 13.925 1.00 24.85 H new ATOM 0 HG SER B 48 12.595 56.806 13.596 1.00 29.32 H new ATOM 696 N SER B 49 14.591 54.907 16.609 1.00 27.93 N ANISOU 696 N SER B 49 3245 2904 4463 269 525 -519 N ATOM 697 CA SER B 49 14.557 55.365 17.992 1.00 30.73 C ANISOU 697 CA SER B 49 3566 3294 4815 190 450 -801 C ATOM 698 C SER B 49 13.827 56.694 18.085 1.00 39.03 C ANISOU 698 C SER B 49 4851 3950 6030 161 548 -889 C ATOM 699 O SER B 49 13.321 57.060 19.154 1.00 33.29 O ANISOU 699 O SER B 49 4189 3187 5275 195 520 -1105 O ATOM 700 CB SER B 49 15.975 55.488 18.556 1.00 39.63 C ANISOU 700 CB SER B 49 4456 4646 5955 -63 388 -1001 C ATOM 701 OG SER B 49 16.719 56.455 17.856 1.00 43.48 O ANISOU 701 OG SER B 49 4934 4920 6667 -351 540 -1009 O ATOM 0 H SER B 49 15.354 54.982 16.220 1.00 27.93 H new ATOM 0 HA SER B 49 14.078 54.710 18.523 1.00 30.73 H new ATOM 0 HB2 SER B 49 15.933 55.726 19.495 1.00 39.63 H new ATOM 0 HB3 SER B 49 16.423 54.629 18.501 1.00 39.63 H new ATOM 0 HG SER B 49 17.537 56.351 18.018 1.00 43.48 H new ATOM 707 N ARG B 50 13.769 57.418 16.968 1.00 30.25 N ANISOU 707 N ARG B 50 3911 2522 5062 135 688 -713 N ATOM 708 CA ARG B 50 13.159 58.742 16.965 1.00 33.71 C ANISOU 708 CA ARG B 50 4633 2516 5659 155 811 -761 C ATOM 709 C ARG B 50 11.638 58.693 17.029 1.00 32.00 C ANISOU 709 C ARG B 50 4515 2232 5411 532 764 -691 C ATOM 710 O ARG B 50 11.036 59.469 17.793 1.00 39.09 O ANISOU 710 O ARG B 50 5544 2926 6382 608 818 -872 O ATOM 711 CB ARG B 50 13.606 59.520 15.725 1.00 36.90 C ANISOU 711 CB ARG B 50 5256 2575 6191 45 1005 -548 C ATOM 712 CG ARG B 50 13.039 60.917 15.599 1.00 42.61 C ANISOU 712 CG ARG B 50 6365 2756 7070 106 1172 -544 C ATOM 713 CD ARG B 50 13.848 61.737 14.605 1.00 49.15 C ANISOU 713 CD ARG B 50 7443 3211 8020 -135 1436 -379 C ATOM 714 NE ARG B 50 13.125 62.927 14.164 1.00 57.53 N ANISOU 714 NE ARG B 50 8909 3859 9092 66 1531 -231 N ATOM 715 CZ ARG B 50 13.624 63.853 13.352 1.00 64.23 C ANISOU 715 CZ ARG B 50 10035 4405 9965 -87 1743 -64 C ATOM 716 NH1 ARG B 50 14.867 63.750 12.903 1.00 75.22 N ANISOU 716 NH1 ARG B 50 11353 5790 11435 -484 1953 -41 N ATOM 717 NH2 ARG B 50 12.884 64.898 13.004 1.00 65.35 N ANISOU 717 NH2 ARG B 50 10505 4264 10062 158 1764 70 N ATOM 0 H ARG B 50 14.076 57.161 16.207 1.00 30.25 H new ATOM 0 HA ARG B 50 13.461 59.195 17.768 1.00 33.71 H new ATOM 0 HB2 ARG B 50 14.574 59.579 15.730 1.00 36.90 H new ATOM 0 HB3 ARG B 50 13.357 59.013 14.936 1.00 36.90 H new ATOM 0 HG2 ARG B 50 12.114 60.871 15.311 1.00 42.61 H new ATOM 0 HG3 ARG B 50 13.045 61.353 16.466 1.00 42.61 H new ATOM 0 HD2 ARG B 50 14.688 62.002 15.012 1.00 49.15 H new ATOM 0 HD3 ARG B 50 14.066 61.188 13.836 1.00 49.15 H new ATOM 0 HE ARG B 50 12.321 63.036 14.449 1.00 57.53 H new ATOM 0 HH11 ARG B 50 15.355 63.081 13.137 1.00 75.22 H new ATOM 0 HH12 ARG B 50 15.186 64.352 12.378 1.00 75.22 H new ATOM 0 HH21 ARG B 50 12.082 64.976 13.304 1.00 65.35 H new ATOM 0 HH22 ARG B 50 13.207 65.497 12.479 1.00 65.35 H new ATOM 731 N ASP B 51 11.002 57.824 16.241 1.00 31.40 N ANISOU 731 N ASP B 51 4365 2329 5237 761 674 -463 N ATOM 732 CA ASP B 51 9.537 57.810 16.208 1.00 34.48 C ANISOU 732 CA ASP B 51 4760 2702 5639 1098 617 -415 C ATOM 733 C ASP B 51 8.931 56.412 16.374 1.00 31.42 C ANISOU 733 C ASP B 51 4124 2695 5119 1191 493 -399 C ATOM 734 O ASP B 51 7.713 56.251 16.310 1.00 38.61 O ANISOU 734 O ASP B 51 4949 3699 6024 1397 421 -378 O ATOM 735 CB ASP B 51 9.038 58.474 14.914 1.00 36.89 C ANISOU 735 CB ASP B 51 5271 2779 5966 1306 602 -161 C ATOM 736 CG ASP B 51 9.306 57.649 13.672 1.00 42.24 C ANISOU 736 CG ASP B 51 5940 3598 6512 1336 529 81 C ATOM 737 OD1 ASP B 51 9.973 56.607 13.770 1.00 33.91 O ANISOU 737 OD1 ASP B 51 4718 2811 5355 1160 501 53 O ATOM 738 OD2 ASP B 51 8.852 58.054 12.582 1.00 49.31 O ANISOU 738 OD2 ASP B 51 6986 4423 7326 1489 444 275 O ATOM 0 H ASP B 51 11.387 57.249 15.731 1.00 31.40 H new ATOM 0 HA ASP B 51 9.235 58.319 16.976 1.00 34.48 H new ATOM 0 HB2 ASP B 51 8.084 58.635 14.988 1.00 36.89 H new ATOM 0 HB3 ASP B 51 9.465 59.340 14.817 1.00 36.89 H new ATOM 743 N GLY B 52 9.777 55.411 16.607 1.00 28.91 N ANISOU 743 N GLY B 52 3691 2626 4668 1014 460 -417 N ATOM 744 CA GLY B 52 9.315 54.062 16.881 1.00 33.80 C ANISOU 744 CA GLY B 52 4156 3529 5155 1063 401 -411 C ATOM 745 C GLY B 52 8.739 53.330 15.687 1.00 29.88 C ANISOU 745 C GLY B 52 3633 3106 4613 1167 312 -231 C ATOM 746 O GLY B 52 8.195 52.237 15.834 1.00 28.79 O ANISOU 746 O GLY B 52 3390 3149 4400 1174 284 -246 O ATOM 0 H GLY B 52 10.633 55.499 16.610 1.00 28.91 H new ATOM 0 HA2 GLY B 52 10.057 53.546 17.233 1.00 33.80 H new ATOM 0 HA3 GLY B 52 8.640 54.100 17.577 1.00 33.80 H new ATOM 750 N SER B 53 8.870 53.904 14.498 1.00 28.12 N ANISOU 750 N SER B 53 3541 2731 4411 1230 277 -70 N ATOM 751 CA SER B 53 8.386 53.239 13.293 1.00 25.80 C ANISOU 751 CA SER B 53 3264 2527 4011 1333 152 78 C ATOM 752 C SER B 53 9.179 51.964 13.051 1.00 23.58 C ANISOU 752 C SER B 53 2980 2415 3563 1197 168 110 C ATOM 753 O SER B 53 10.345 51.886 13.405 1.00 24.21 O ANISOU 753 O SER B 53 3070 2511 3617 1068 271 99 O ATOM 754 CB SER B 53 8.478 54.174 12.087 1.00 27.02 C ANISOU 754 CB SER B 53 3648 2469 4148 1463 131 270 C ATOM 755 OG SER B 53 9.803 54.640 11.876 1.00 30.58 O ANISOU 755 OG SER B 53 4258 2767 4593 1291 301 343 O ATOM 0 H SER B 53 9.233 54.672 14.366 1.00 28.12 H new ATOM 0 HA SER B 53 7.453 53.005 13.418 1.00 25.80 H new ATOM 0 HB2 SER B 53 8.169 53.709 11.294 1.00 27.02 H new ATOM 0 HB3 SER B 53 7.887 54.931 12.220 1.00 27.02 H new ATOM 0 HG SER B 53 9.975 55.253 12.424 1.00 30.58 H new ATOM 761 N THR B 54 8.524 50.957 12.480 1.00 26.29 N ANISOU 761 N THR B 54 3295 2891 3803 1232 64 125 N ATOM 762 CA THR B 54 9.138 49.669 12.232 1.00 22.60 C ANISOU 762 CA THR B 54 2884 2530 3171 1140 102 143 C ATOM 763 C THR B 54 9.063 49.303 10.757 1.00 22.35 C ANISOU 763 C THR B 54 3020 2501 2973 1198 6 251 C ATOM 764 O THR B 54 8.229 49.822 10.007 1.00 26.78 O ANISOU 764 O THR B 54 3605 3047 3523 1318 -154 290 O ATOM 765 CB THR B 54 8.481 48.566 13.064 1.00 23.07 C ANISOU 765 CB THR B 54 2837 2701 3228 1067 125 14 C ATOM 766 OG1 THR B 54 7.074 48.536 12.803 1.00 26.67 O ANISOU 766 OG1 THR B 54 3157 3211 3767 1089 2 -62 O ATOM 767 CG2 THR B 54 8.754 48.799 14.535 1.00 23.56 C ANISOU 767 CG2 THR B 54 2819 2779 3356 1035 243 -76 C ATOM 0 H THR B 54 7.704 51.008 12.226 1.00 26.29 H new ATOM 0 HA THR B 54 10.069 49.743 12.494 1.00 22.60 H new ATOM 0 HB THR B 54 8.857 47.706 12.817 1.00 23.07 H new ATOM 0 HG1 THR B 54 6.719 47.920 13.251 1.00 26.67 H new ATOM 0 HG21 THR B 54 8.335 48.097 15.057 1.00 23.56 H new ATOM 0 HG22 THR B 54 9.711 48.791 14.692 1.00 23.56 H new ATOM 0 HG23 THR B 54 8.391 49.659 14.800 1.00 23.56 H new ATOM 775 N TYR B 55 9.987 48.428 10.359 1.00 22.14 N ANISOU 775 N TYR B 55 3123 2503 2787 1151 105 298 N ATOM 776 CA TYR B 55 10.209 48.045 8.967 1.00 24.21 C ANISOU 776 CA TYR B 55 3615 2754 2830 1205 77 393 C ATOM 777 C TYR B 55 10.505 46.564 8.866 1.00 22.25 C ANISOU 777 C TYR B 55 3470 2554 2430 1154 147 329 C ATOM 778 O TYR B 55 11.324 46.049 9.619 1.00 22.92 O ANISOU 778 O TYR B 55 3513 2657 2540 1138 305 321 O ATOM 779 CB TYR B 55 11.377 48.863 8.366 1.00 25.92 C ANISOU 779 CB TYR B 55 3965 2877 3006 1236 245 563 C ATOM 780 CG TYR B 55 11.146 50.336 8.567 1.00 26.62 C ANISOU 780 CG TYR B 55 4024 2830 3263 1263 233 623 C ATOM 781 CD1 TYR B 55 11.512 50.945 9.758 1.00 24.20 C ANISOU 781 CD1 TYR B 55 3531 2486 3178 1162 319 540 C ATOM 782 CD2 TYR B 55 10.498 51.103 7.611 1.00 27.01 C ANISOU 782 CD2 TYR B 55 4266 2774 3224 1417 120 749 C ATOM 783 CE1 TYR B 55 11.241 52.258 9.994 1.00 22.25 C ANISOU 783 CE1 TYR B 55 3308 2058 3090 1181 330 559 C ATOM 784 CE2 TYR B 55 10.243 52.438 7.824 1.00 31.75 C ANISOU 784 CE2 TYR B 55 4900 3186 3978 1488 136 815 C ATOM 785 CZ TYR B 55 10.617 53.020 9.020 1.00 25.05 C ANISOU 785 CZ TYR B 55 3882 2256 3380 1353 261 709 C ATOM 786 OH TYR B 55 10.332 54.358 9.224 1.00 29.02 O ANISOU 786 OH TYR B 55 4479 2509 4037 1424 302 750 O ATOM 0 H TYR B 55 10.516 48.030 10.908 1.00 22.14 H new ATOM 0 HA TYR B 55 9.402 48.235 8.464 1.00 24.21 H new ATOM 0 HB2 TYR B 55 12.212 48.601 8.785 1.00 25.92 H new ATOM 0 HB3 TYR B 55 11.461 48.669 7.419 1.00 25.92 H new ATOM 0 HD1 TYR B 55 11.951 50.446 10.409 1.00 24.20 H new ATOM 0 HD2 TYR B 55 10.231 50.708 6.812 1.00 27.01 H new ATOM 0 HE1 TYR B 55 11.474 52.643 10.808 1.00 22.25 H new ATOM 0 HE2 TYR B 55 9.822 52.945 7.168 1.00 31.75 H new ATOM 0 HH TYR B 55 10.169 54.489 10.038 1.00 29.02 H new ATOM 796 N TYR B 56 9.844 45.904 7.920 1.00 23.71 N ANISOU 796 N TYR B 56 3813 2754 2442 1150 15 273 N ATOM 797 CA TYR B 56 10.014 44.474 7.677 1.00 22.69 C ANISOU 797 CA TYR B 56 3871 2597 2152 1090 93 183 C ATOM 798 C TYR B 56 9.948 44.170 6.190 1.00 23.54 C ANISOU 798 C TYR B 56 4275 2698 1970 1139 3 182 C ATOM 799 O TYR B 56 9.162 44.796 5.475 1.00 26.71 O ANISOU 799 O TYR B 56 4679 3167 2302 1182 -239 180 O ATOM 800 CB TYR B 56 8.922 43.658 8.359 1.00 24.56 C ANISOU 800 CB TYR B 56 3997 2841 2495 919 24 -5 C ATOM 801 CG TYR B 56 8.708 43.930 9.820 1.00 21.40 C ANISOU 801 CG TYR B 56 3345 2457 2328 872 107 -24 C ATOM 802 CD1 TYR B 56 9.379 43.207 10.789 1.00 21.80 C ANISOU 802 CD1 TYR B 56 3461 2447 2376 877 320 -2 C ATOM 803 CD2 TYR B 56 7.819 44.908 10.235 1.00 20.59 C ANISOU 803 CD2 TYR B 56 2972 2436 2417 869 -25 -60 C ATOM 804 CE1 TYR B 56 9.172 43.448 12.123 1.00 21.15 C ANISOU 804 CE1 TYR B 56 3208 2392 2434 854 392 -21 C ATOM 805 CE2 TYR B 56 7.590 45.156 11.556 1.00 23.11 C ANISOU 805 CE2 TYR B 56 3104 2767 2910 835 78 -99 C ATOM 806 CZ TYR B 56 8.264 44.411 12.506 1.00 21.91 C ANISOU 806 CZ TYR B 56 3051 2563 2713 813 285 -82 C ATOM 807 OH TYR B 56 8.041 44.664 13.824 1.00 23.09 O ANISOU 807 OH TYR B 56 3071 2735 2967 800 385 -119 O ATOM 0 H TYR B 56 9.276 46.279 7.394 1.00 23.71 H new ATOM 0 HA TYR B 56 10.881 44.233 8.038 1.00 22.69 H new ATOM 0 HB2 TYR B 56 8.086 43.817 7.893 1.00 24.56 H new ATOM 0 HB3 TYR B 56 9.132 42.717 8.251 1.00 24.56 H new ATOM 0 HD1 TYR B 56 9.981 42.546 10.532 1.00 21.80 H new ATOM 0 HD2 TYR B 56 7.366 45.409 9.595 1.00 20.59 H new ATOM 0 HE1 TYR B 56 9.641 42.965 12.765 1.00 21.15 H new ATOM 0 HE2 TYR B 56 6.989 45.817 11.814 1.00 23.11 H new ATOM 0 HH TYR B 56 7.278 45.003 13.919 1.00 23.09 H new ATOM 817 N PRO B 57 10.734 43.188 5.716 1.00 24.37 N ANISOU 817 N PRO B 57 4654 2727 1876 1171 187 174 N ATOM 818 CA PRO B 57 10.530 42.666 4.365 1.00 28.28 C ANISOU 818 CA PRO B 57 5493 3205 2047 1192 100 102 C ATOM 819 C PRO B 57 9.263 41.823 4.305 1.00 30.66 C ANISOU 819 C PRO B 57 5802 3515 2334 983 -132 -164 C ATOM 820 O PRO B 57 8.857 41.283 5.333 1.00 29.53 O ANISOU 820 O PRO B 57 5487 3322 2411 825 -77 -268 O ATOM 821 CB PRO B 57 11.774 41.823 4.122 1.00 31.69 C ANISOU 821 CB PRO B 57 6188 3531 2324 1302 429 149 C ATOM 822 CG PRO B 57 12.170 41.351 5.492 1.00 25.52 C ANISOU 822 CG PRO B 57 5206 2705 1785 1288 593 152 C ATOM 823 CD PRO B 57 11.827 42.495 6.419 1.00 23.68 C ANISOU 823 CD PRO B 57 4587 2580 1832 1233 472 219 C ATOM 0 HA PRO B 57 10.415 43.359 3.696 1.00 28.28 H new ATOM 0 HB2 PRO B 57 11.587 41.078 3.530 1.00 31.69 H new ATOM 0 HB3 PRO B 57 12.480 42.344 3.708 1.00 31.69 H new ATOM 0 HG2 PRO B 57 11.690 40.545 5.737 1.00 25.52 H new ATOM 0 HG3 PRO B 57 13.116 41.140 5.530 1.00 25.52 H new ATOM 0 HD2 PRO B 57 11.546 42.177 7.291 1.00 23.68 H new ATOM 0 HD3 PRO B 57 12.588 43.080 6.562 1.00 23.68 H new ATOM 831 N ASP B 58 8.641 41.728 3.131 1.00 32.21 N ANISOU 831 N ASP B 58 5697 3959 2584 937 -844 988 N ATOM 832 CA ASP B 58 7.369 41.032 3.017 1.00 35.50 C ANISOU 832 CA ASP B 58 5739 4633 3115 1137 -1023 896 C ATOM 833 C ASP B 58 7.442 39.603 3.527 1.00 30.88 C ANISOU 833 C ASP B 58 4787 4179 2768 958 -913 607 C ATOM 834 O ASP B 58 6.488 39.104 4.124 1.00 33.19 O ANISOU 834 O ASP B 58 4779 4557 3276 1074 -951 522 O ATOM 835 CB ASP B 58 6.893 41.037 1.566 1.00 34.97 C ANISOU 835 CB ASP B 58 5686 4875 2725 1157 -1266 977 C ATOM 836 CG ASP B 58 6.386 42.399 1.124 1.00 46.94 C ANISOU 836 CG ASP B 58 7397 6249 4189 1333 -1376 1262 C ATOM 837 OD1 ASP B 58 6.134 43.263 1.991 1.00 52.53 O ANISOU 837 OD1 ASP B 58 8175 6644 5139 1519 -1304 1332 O ATOM 838 OD2 ASP B 58 6.222 42.599 -0.096 1.00 51.60 O ANISOU 838 OD2 ASP B 58 8051 7054 4501 1270 -1533 1391 O ATOM 0 H ASP B 58 8.939 42.058 2.395 1.00 32.21 H new ATOM 0 HA ASP B 58 6.734 41.509 3.574 1.00 35.50 H new ATOM 0 HB2 ASP B 58 7.623 40.764 0.988 1.00 34.97 H new ATOM 0 HB3 ASP B 58 6.186 40.382 1.459 1.00 34.97 H new ATOM 843 N ALA B 59 8.589 38.960 3.331 1.00 30.37 N ANISOU 843 N ALA B 59 4752 4115 2671 672 -769 453 N ATOM 844 CA ALA B 59 8.747 37.547 3.677 1.00 30.30 C ANISOU 844 CA ALA B 59 4461 4158 2896 524 -695 190 C ATOM 845 C ALA B 59 8.566 37.211 5.156 1.00 30.64 C ANISOU 845 C ALA B 59 4381 4005 3254 582 -588 192 C ATOM 846 O ALA B 59 8.390 36.047 5.506 1.00 28.01 O ANISOU 846 O ALA B 59 3840 3672 3130 485 -567 41 O ATOM 847 CB ALA B 59 10.121 37.062 3.215 1.00 30.83 C ANISOU 847 CB ALA B 59 4591 4246 2878 287 -567 7 C ATOM 0 H ALA B 59 9.293 39.325 2.997 1.00 30.37 H new ATOM 0 HA ALA B 59 8.027 37.088 3.217 1.00 30.30 H new ATOM 0 HB1 ALA B 59 10.227 36.125 3.444 1.00 30.83 H new ATOM 0 HB2 ALA B 59 10.196 37.170 2.254 1.00 30.83 H new ATOM 0 HB3 ALA B 59 10.812 37.582 3.654 1.00 30.83 H new ATOM 853 N VAL B 60 8.644 38.205 6.035 1.00 29.39 N ANISOU 853 N VAL B 60 4381 3669 3117 711 -515 356 N ATOM 854 CA VAL B 60 8.441 37.955 7.452 1.00 24.40 C ANISOU 854 CA VAL B 60 3635 2923 2711 744 -408 360 C ATOM 855 C VAL B 60 7.278 38.744 8.047 1.00 25.02 C ANISOU 855 C VAL B 60 3651 3021 2836 986 -441 452 C ATOM 856 O VAL B 60 7.040 38.650 9.242 1.00 26.32 O ANISOU 856 O VAL B 60 3717 3149 3134 997 -332 444 O ATOM 857 CB VAL B 60 9.714 38.276 8.285 1.00 23.23 C ANISOU 857 CB VAL B 60 3663 2596 2568 650 -248 377 C ATOM 858 CG1 VAL B 60 10.924 37.580 7.692 1.00 26.44 C ANISOU 858 CG1 VAL B 60 4080 3034 2933 463 -216 240 C ATOM 859 CG2 VAL B 60 9.944 39.769 8.382 1.00 26.11 C ANISOU 859 CG2 VAL B 60 4312 2819 2788 736 -204 501 C ATOM 0 H VAL B 60 8.812 39.024 5.832 1.00 29.39 H new ATOM 0 HA VAL B 60 8.234 37.009 7.504 1.00 24.40 H new ATOM 0 HB VAL B 60 9.577 37.941 9.185 1.00 23.23 H new ATOM 0 HG11 VAL B 60 11.710 37.789 8.221 1.00 26.44 H new ATOM 0 HG12 VAL B 60 10.779 36.621 7.694 1.00 26.44 H new ATOM 0 HG13 VAL B 60 11.058 37.884 6.781 1.00 26.44 H new ATOM 0 HG21 VAL B 60 10.742 39.940 8.906 1.00 26.11 H new ATOM 0 HG22 VAL B 60 10.056 40.138 7.492 1.00 26.11 H new ATOM 0 HG23 VAL B 60 9.181 40.187 8.811 1.00 26.11 H new ATOM 869 N LYS B 61 6.547 39.489 7.231 1.00 30.92 N ANISOU 869 N LYS B 61 4437 3852 3458 1194 -598 530 N ATOM 870 CA LYS B 61 5.421 40.265 7.736 1.00 30.72 C ANISOU 870 CA LYS B 61 4312 3859 3500 1507 -652 572 C ATOM 871 C LYS B 61 4.363 39.357 8.371 1.00 31.39 C ANISOU 871 C LYS B 61 3964 4205 3757 1476 -630 428 C ATOM 872 O LYS B 61 4.019 38.315 7.819 1.00 35.06 O ANISOU 872 O LYS B 61 4205 4876 4239 1301 -701 329 O ATOM 873 CB LYS B 61 4.815 41.104 6.605 1.00 33.96 C ANISOU 873 CB LYS B 61 4828 4333 3742 1782 -891 700 C ATOM 874 CG LYS B 61 5.681 42.293 6.256 1.00 44.52 C ANISOU 874 CG LYS B 61 6622 5347 4945 1760 -852 867 C ATOM 875 CD LYS B 61 5.059 43.196 5.211 1.00 45.58 C ANISOU 875 CD LYS B 61 6857 5496 4967 1924 -1046 1013 C ATOM 876 CE LYS B 61 5.942 44.414 4.993 1.00 43.78 C ANISOU 876 CE LYS B 61 7060 4919 4655 1808 -959 1165 C ATOM 877 NZ LYS B 61 5.593 45.147 3.749 1.00 56.85 N ANISOU 877 NZ LYS B 61 8879 6585 6138 1894 -1159 1381 N ATOM 0 H LYS B 61 6.684 39.560 6.385 1.00 30.92 H new ATOM 0 HA LYS B 61 5.745 40.862 8.428 1.00 30.72 H new ATOM 0 HB2 LYS B 61 4.697 40.549 5.819 1.00 33.96 H new ATOM 0 HB3 LYS B 61 3.934 41.413 6.869 1.00 33.96 H new ATOM 0 HG2 LYS B 61 5.853 42.808 7.060 1.00 44.52 H new ATOM 0 HG3 LYS B 61 6.539 41.977 5.933 1.00 44.52 H new ATOM 0 HD2 LYS B 61 4.949 42.712 4.377 1.00 45.58 H new ATOM 0 HD3 LYS B 61 4.175 43.474 5.496 1.00 45.58 H new ATOM 0 HE2 LYS B 61 5.859 45.012 5.752 1.00 43.78 H new ATOM 0 HE3 LYS B 61 6.870 44.135 4.952 1.00 43.78 H new ATOM 0 HZ1 LYS B 61 6.184 45.798 3.612 1.00 56.85 H new ATOM 0 HZ2 LYS B 61 5.606 44.585 3.059 1.00 56.85 H new ATOM 0 HZ3 LYS B 61 4.779 45.498 3.829 1.00 56.85 H new ATOM 891 N GLY B 62 3.877 39.750 9.545 1.00 31.72 N ANISOU 891 N GLY B 62 3898 4245 3909 1598 -508 392 N ATOM 892 CA GLY B 62 2.874 38.986 10.268 1.00 37.73 C ANISOU 892 CA GLY B 62 4252 5290 4792 1510 -438 260 C ATOM 893 C GLY B 62 3.480 37.884 11.126 1.00 31.44 C ANISOU 893 C GLY B 62 3453 4421 4074 1133 -260 258 C ATOM 894 O GLY B 62 2.807 37.329 11.995 1.00 41.24 O ANISOU 894 O GLY B 62 4441 5842 5384 988 -144 198 O ATOM 0 H GLY B 62 4.123 40.471 9.944 1.00 31.72 H new ATOM 0 HA2 GLY B 62 2.361 39.585 10.833 1.00 37.73 H new ATOM 0 HA3 GLY B 62 2.253 38.593 9.634 1.00 37.73 H new ATOM 898 N ARG B 63 4.753 37.570 10.880 1.00 26.14 N ANISOU 898 N ARG B 63 3057 3501 3375 976 -245 328 N ATOM 899 CA ARG B 63 5.439 36.505 11.613 1.00 28.56 C ANISOU 899 CA ARG B 63 3394 3692 3764 692 -134 354 C ATOM 900 C ARG B 63 6.517 37.023 12.566 1.00 22.25 C ANISOU 900 C ARG B 63 2828 2713 2912 691 -11 434 C ATOM 901 O ARG B 63 6.694 36.463 13.653 1.00 22.77 O ANISOU 901 O ARG B 63 2868 2775 3009 537 90 490 O ATOM 902 CB ARG B 63 6.080 35.502 10.647 1.00 25.15 C ANISOU 902 CB ARG B 63 3019 3161 3377 526 -226 304 C ATOM 903 CG ARG B 63 5.110 34.926 9.635 1.00 29.28 C ANISOU 903 CG ARG B 63 3315 3885 3923 471 -354 177 C ATOM 904 CD ARG B 63 5.717 33.765 8.857 1.00 30.11 C ANISOU 904 CD ARG B 63 3465 3872 4104 267 -407 57 C ATOM 905 NE ARG B 63 6.901 34.178 8.107 1.00 26.00 N ANISOU 905 NE ARG B 63 3167 3251 3461 344 -436 39 N ATOM 906 CZ ARG B 63 8.113 33.653 8.239 1.00 23.32 C ANISOU 906 CZ ARG B 63 2964 2707 3189 271 -382 1 C ATOM 907 NH1 ARG B 63 9.128 34.109 7.517 1.00 25.05 N ANISOU 907 NH1 ARG B 63 3326 2930 3260 309 -384 -54 N ATOM 908 NH2 ARG B 63 8.353 32.668 9.104 1.00 27.25 N ANISOU 908 NH2 ARG B 63 3456 3008 3888 161 -331 24 N ATOM 0 H ARG B 63 5.239 37.964 10.290 1.00 26.14 H new ATOM 0 HA ARG B 63 4.753 36.073 12.145 1.00 28.56 H new ATOM 0 HB2 ARG B 63 6.806 35.939 10.175 1.00 25.15 H new ATOM 0 HB3 ARG B 63 6.470 34.776 11.159 1.00 25.15 H new ATOM 0 HG2 ARG B 63 4.309 34.624 10.092 1.00 29.28 H new ATOM 0 HG3 ARG B 63 4.839 35.622 9.016 1.00 29.28 H new ATOM 0 HD2 ARG B 63 5.955 33.053 9.471 1.00 30.11 H new ATOM 0 HD3 ARG B 63 5.056 33.404 8.246 1.00 30.11 H new ATOM 0 HE ARG B 63 6.805 34.812 7.534 1.00 26.00 H new ATOM 0 HH11 ARG B 63 9.004 34.750 6.957 1.00 25.05 H new ATOM 0 HH12 ARG B 63 9.910 33.763 7.608 1.00 25.05 H new ATOM 0 HH21 ARG B 63 7.715 32.359 9.592 1.00 27.25 H new ATOM 0 HH22 ARG B 63 9.145 32.341 9.175 1.00 27.25 H new ATOM 922 N PHE B 64 7.249 38.054 12.141 1.00 26.24 N ANISOU 922 N PHE B 64 3570 3087 3313 823 -28 448 N ATOM 923 CA PHE B 64 8.330 38.635 12.943 1.00 28.22 C ANISOU 923 CA PHE B 64 4028 3202 3492 782 85 474 C ATOM 924 C PHE B 64 7.908 39.995 13.472 1.00 23.56 C ANISOU 924 C PHE B 64 3532 2574 2845 972 159 444 C ATOM 925 O PHE B 64 7.319 40.796 12.736 1.00 26.36 O ANISOU 925 O PHE B 64 3949 2879 3187 1188 76 444 O ATOM 926 CB PHE B 64 9.624 38.841 12.138 1.00 23.28 C ANISOU 926 CB PHE B 64 3617 2450 2779 706 54 467 C ATOM 927 CG PHE B 64 10.354 37.570 11.744 1.00 25.38 C ANISOU 927 CG PHE B 64 3804 2725 3112 556 4 427 C ATOM 928 CD1 PHE B 64 9.757 36.326 11.794 1.00 21.02 C ANISOU 928 CD1 PHE B 64 3068 2207 2711 495 -48 421 C ATOM 929 CD2 PHE B 64 11.645 37.667 11.266 1.00 25.11 C ANISOU 929 CD2 PHE B 64 3884 2659 2996 471 17 363 C ATOM 930 CE1 PHE B 64 10.478 35.169 11.410 1.00 24.28 C ANISOU 930 CE1 PHE B 64 3452 2545 3229 400 -102 352 C ATOM 931 CE2 PHE B 64 12.350 36.550 10.867 1.00 21.89 C ANISOU 931 CE2 PHE B 64 3383 2264 2673 398 -30 266 C ATOM 932 CZ PHE B 64 11.761 35.312 10.920 1.00 20.60 C ANISOU 932 CZ PHE B 64 3073 2059 2693 390 -99 259 C ATOM 0 H PHE B 64 7.133 38.437 11.380 1.00 26.24 H new ATOM 0 HA PHE B 64 8.503 38.006 13.661 1.00 28.22 H new ATOM 0 HB2 PHE B 64 9.410 39.336 11.332 1.00 23.28 H new ATOM 0 HB3 PHE B 64 10.227 39.394 12.659 1.00 23.28 H new ATOM 0 HD1 PHE B 64 8.876 36.247 12.082 1.00 21.02 H new ATOM 0 HD2 PHE B 64 12.048 38.503 11.212 1.00 25.11 H new ATOM 0 HE1 PHE B 64 10.093 34.326 11.487 1.00 24.28 H new ATOM 0 HE2 PHE B 64 13.224 36.636 10.562 1.00 21.89 H new ATOM 0 HZ PHE B 64 12.229 34.565 10.624 1.00 20.60 H new ATOM 942 N THR B 65 8.252 40.277 14.726 1.00 21.63 N ANISOU 942 N THR B 65 3321 2339 2559 907 300 412 N ATOM 943 CA THR B 65 7.991 41.591 15.309 1.00 23.76 C ANISOU 943 CA THR B 65 3710 2531 2787 1072 398 313 C ATOM 944 C THR B 65 9.198 42.073 16.093 1.00 23.99 C ANISOU 944 C THR B 65 3942 2471 2703 903 513 265 C ATOM 945 O THR B 65 9.691 41.366 16.971 1.00 24.13 O ANISOU 945 O THR B 65 3863 2646 2660 716 565 285 O ATOM 946 CB THR B 65 6.781 41.564 16.248 1.00 26.00 C ANISOU 946 CB THR B 65 3723 3048 3106 1172 493 211 C ATOM 947 OG1 THR B 65 5.638 41.080 15.543 1.00 27.55 O ANISOU 947 OG1 THR B 65 3663 3404 3399 1295 385 219 O ATOM 948 CG2 THR B 65 6.483 42.944 16.786 1.00 28.14 C ANISOU 948 CG2 THR B 65 4111 3213 3367 1400 594 38 C ATOM 0 H THR B 65 8.638 39.721 15.257 1.00 21.63 H new ATOM 0 HA THR B 65 7.806 42.195 14.573 1.00 23.76 H new ATOM 0 HB THR B 65 6.987 40.977 16.992 1.00 26.00 H new ATOM 0 HG1 THR B 65 5.623 40.241 15.576 1.00 27.55 H new ATOM 0 HG21 THR B 65 5.715 42.902 17.377 1.00 28.14 H new ATOM 0 HG22 THR B 65 7.251 43.272 17.278 1.00 28.14 H new ATOM 0 HG23 THR B 65 6.291 43.544 16.049 1.00 28.14 H new ATOM 956 N ILE B 66 9.659 43.281 15.785 1.00 23.14 N ANISOU 956 N ILE B 66 4126 2114 2552 955 541 208 N ATOM 957 CA ILE B 66 10.713 43.903 16.566 1.00 26.83 C ANISOU 957 CA ILE B 66 4772 2520 2903 763 667 98 C ATOM 958 C ILE B 66 10.083 44.812 17.626 1.00 24.64 C ANISOU 958 C ILE B 66 4518 2219 2624 891 806 -96 C ATOM 959 O ILE B 66 9.093 45.496 17.370 1.00 27.84 O ANISOU 959 O ILE B 66 4960 2479 3140 1185 793 -154 O ATOM 960 CB ILE B 66 11.697 44.679 15.668 1.00 22.70 C ANISOU 960 CB ILE B 66 4577 1732 2314 635 656 117 C ATOM 961 CG1 ILE B 66 12.886 45.188 16.484 1.00 23.17 C ANISOU 961 CG1 ILE B 66 4758 1807 2238 353 789 -36 C ATOM 962 CG2 ILE B 66 11.024 45.846 14.927 1.00 25.56 C ANISOU 962 CG2 ILE B 66 5229 1744 2739 868 617 148 C ATOM 963 CD1 ILE B 66 13.994 45.741 15.612 1.00 24.09 C ANISOU 963 CD1 ILE B 66 5136 1760 2258 107 807 -28 C ATOM 0 H ILE B 66 9.373 43.755 15.127 1.00 23.14 H new ATOM 0 HA ILE B 66 11.229 43.212 17.009 1.00 26.83 H new ATOM 0 HB ILE B 66 12.013 44.055 14.996 1.00 22.70 H new ATOM 0 HG12 ILE B 66 12.584 45.879 17.094 1.00 23.17 H new ATOM 0 HG13 ILE B 66 13.236 44.464 17.026 1.00 23.17 H new ATOM 0 HG21 ILE B 66 11.680 46.302 14.377 1.00 25.56 H new ATOM 0 HG22 ILE B 66 10.312 45.504 14.364 1.00 25.56 H new ATOM 0 HG23 ILE B 66 10.654 46.469 15.572 1.00 25.56 H new ATOM 0 HD11 ILE B 66 14.723 46.050 16.172 1.00 24.09 H new ATOM 0 HD12 ILE B 66 14.316 45.045 15.018 1.00 24.09 H new ATOM 0 HD13 ILE B 66 13.653 46.482 15.087 1.00 24.09 H new ATOM 975 N SER B 67 10.635 44.772 18.836 1.00 24.77 N ANISOU 975 N SER B 67 4484 2423 2505 693 929 -217 N ATOM 976 CA SER B 67 10.174 45.648 19.911 1.00 27.48 C ANISOU 976 CA SER B 67 4848 2789 2805 764 1092 -475 C ATOM 977 C SER B 67 11.315 45.993 20.857 1.00 30.56 C ANISOU 977 C SER B 67 5339 3278 2993 461 1201 -632 C ATOM 978 O SER B 67 12.404 45.419 20.757 1.00 27.77 O ANISOU 978 O SER B 67 4971 3042 2537 223 1132 -520 O ATOM 979 CB SER B 67 9.048 44.984 20.687 1.00 28.39 C ANISOU 979 CB SER B 67 4618 3262 2908 858 1150 -502 C ATOM 980 OG SER B 67 9.508 43.809 21.336 1.00 29.30 O ANISOU 980 OG SER B 67 4556 3708 2869 593 1135 -348 O ATOM 0 H SER B 67 11.278 44.245 19.056 1.00 24.77 H new ATOM 0 HA SER B 67 9.845 46.468 19.510 1.00 27.48 H new ATOM 0 HB2 SER B 67 8.693 45.603 21.344 1.00 28.39 H new ATOM 0 HB3 SER B 67 8.321 44.762 20.084 1.00 28.39 H new ATOM 0 HG SER B 67 9.376 43.144 20.839 1.00 29.30 H new ATOM 986 N ARG B 68 11.057 46.923 21.778 1.00 35.42 N ANISOU 986 N ARG B 68 6026 3881 3550 483 1366 -932 N ATOM 987 CA ARG B 68 12.059 47.317 22.759 1.00 36.54 C ANISOU 987 CA ARG B 68 6239 4177 3466 170 1475 -1144 C ATOM 988 C ARG B 68 11.505 47.413 24.164 1.00 36.11 C ANISOU 988 C ARG B 68 5975 4488 3259 153 1604 -1372 C ATOM 989 O ARG B 68 10.351 47.750 24.353 1.00 42.32 O ANISOU 989 O ARG B 68 6675 5256 4147 412 1691 -1522 O ATOM 990 CB ARG B 68 12.660 48.659 22.389 1.00 41.59 C ANISOU 990 CB ARG B 68 7207 4393 4201 81 1498 -1309 C ATOM 991 CG ARG B 68 13.203 48.700 20.992 1.00 47.21 C ANISOU 991 CG ARG B 68 8162 4766 5009 44 1401 -1093 C ATOM 992 CD ARG B 68 14.053 49.928 20.797 1.00 44.25 C ANISOU 992 CD ARG B 68 8068 4087 4657 -205 1437 -1200 C ATOM 993 NE ARG B 68 13.265 51.147 20.906 1.00 42.05 N ANISOU 993 NE ARG B 68 7971 3444 4561 20 1471 -1343 N ATOM 994 CZ ARG B 68 13.783 52.369 20.908 1.00 52.35 C ANISOU 994 CZ ARG B 68 9546 4439 5908 -157 1524 -1467 C ATOM 995 NH1 ARG B 68 15.096 52.533 20.813 1.00 56.03 N ANISOU 995 NH1 ARG B 68 10104 4960 6223 -596 1577 -1469 N ATOM 996 NH2 ARG B 68 12.985 53.427 21.018 1.00 58.33 N ANISOU 996 NH2 ARG B 68 10453 4847 6862 108 1523 -1609 N ATOM 0 H ARG B 68 10.306 47.336 21.849 1.00 35.42 H new ATOM 0 HA ARG B 68 12.734 46.621 22.748 1.00 36.54 H new ATOM 0 HB2 ARG B 68 11.984 49.347 22.487 1.00 41.59 H new ATOM 0 HB3 ARG B 68 13.372 48.870 23.013 1.00 41.59 H new ATOM 0 HG2 ARG B 68 13.730 47.904 20.820 1.00 47.21 H new ATOM 0 HG3 ARG B 68 12.472 48.700 20.354 1.00 47.21 H new ATOM 0 HD2 ARG B 68 14.762 49.940 21.459 1.00 44.25 H new ATOM 0 HD3 ARG B 68 14.478 49.893 19.926 1.00 44.25 H new ATOM 0 HE ARG B 68 12.411 51.071 20.973 1.00 42.05 H new ATOM 0 HH11 ARG B 68 15.612 51.848 20.750 1.00 56.03 H new ATOM 0 HH12 ARG B 68 15.432 53.325 20.814 1.00 56.03 H new ATOM 0 HH21 ARG B 68 12.135 53.319 21.088 1.00 58.33 H new ATOM 0 HH22 ARG B 68 13.319 54.219 21.019 1.00 58.33 H new ATOM 1010 N ASP B 69 12.354 47.099 25.132 1.00 43.18 N ANISOU 1010 N ASP B 69 6736 5757 3913 -135 1568 -1375 N ATOM 1011 CA ASP B 69 12.131 47.486 26.515 1.00 44.44 C ANISOU 1011 CA ASP B 69 6757 6230 3900 -205 1649 -1597 C ATOM 1012 C ASP B 69 13.261 48.430 26.894 1.00 47.78 C ANISOU 1012 C ASP B 69 7320 6562 4271 -440 1637 -1801 C ATOM 1013 O ASP B 69 14.337 47.988 27.280 1.00 54.38 O ANISOU 1013 O ASP B 69 8066 7652 4944 -683 1531 -1696 O ATOM 1014 CB ASP B 69 12.101 46.274 27.441 1.00 43.03 C ANISOU 1014 CB ASP B 69 6318 6560 3471 -335 1594 -1363 C ATOM 1015 CG ASP B 69 11.741 46.644 28.864 1.00 47.72 C ANISOU 1015 CG ASP B 69 6793 7466 3871 -417 1695 -1566 C ATOM 1016 OD1 ASP B 69 11.558 47.846 29.134 1.00 56.34 O ANISOU 1016 OD1 ASP B 69 7985 8397 5023 -359 1811 -1921 O ATOM 1017 OD2 ASP B 69 11.637 45.736 29.709 1.00 54.35 O ANISOU 1017 OD2 ASP B 69 7463 8683 4505 -549 1655 -1367 O ATOM 0 H ASP B 69 13.079 46.654 25.004 1.00 43.18 H new ATOM 0 HA ASP B 69 11.268 47.919 26.609 1.00 44.44 H new ATOM 0 HB2 ASP B 69 11.459 45.629 27.105 1.00 43.03 H new ATOM 0 HB3 ASP B 69 12.969 45.841 27.432 1.00 43.03 H new ATOM 1022 N ASN B 70 13.021 49.728 26.761 1.00 54.00 N ANISOU 1022 N ASN B 70 8321 6975 5220 -358 1735 -2090 N ATOM 1023 CA ASN B 70 14.064 50.722 27.000 1.00 53.84 C ANISOU 1023 CA ASN B 70 8469 6804 5182 -628 1755 -2292 C ATOM 1024 C ASN B 70 14.556 50.725 28.453 1.00 49.19 C ANISOU 1024 C ASN B 70 7688 6681 4319 -868 1777 -2454 C ATOM 1025 O ASN B 70 15.697 51.095 28.728 1.00 62.40 O ANISOU 1025 O ASN B 70 9379 8424 5905 -1178 1754 -2542 O ATOM 1026 CB ASN B 70 13.560 52.116 26.623 1.00 54.02 C ANISOU 1026 CB ASN B 70 8793 6278 5455 -459 1845 -2548 C ATOM 1027 CG ASN B 70 13.388 52.295 25.125 1.00 52.99 C ANISOU 1027 CG ASN B 70 8920 5626 5587 -295 1782 -2332 C ATOM 1028 OD1 ASN B 70 13.914 51.514 24.327 1.00 60.46 O ANISOU 1028 OD1 ASN B 70 9860 6608 6504 -400 1700 -2040 O ATOM 1029 ND2 ASN B 70 12.658 53.335 24.734 1.00 73.16 N ANISOU 1029 ND2 ASN B 70 11705 7699 8395 -18 1795 -2464 N ATOM 0 H ASN B 70 12.260 50.057 26.533 1.00 54.00 H new ATOM 0 HA ASN B 70 14.818 50.479 26.440 1.00 53.84 H new ATOM 0 HB2 ASN B 70 12.711 52.278 27.063 1.00 54.02 H new ATOM 0 HB3 ASN B 70 14.183 52.781 26.954 1.00 54.02 H new ATOM 0 HD21 ASN B 70 12.537 53.485 23.896 1.00 73.16 H new ATOM 0 HD22 ASN B 70 12.307 53.858 25.319 1.00 73.16 H new ATOM 1036 N ALA B 71 13.689 50.310 29.372 1.00 50.13 N ANISOU 1036 N ALA B 71 7609 7142 4295 -749 1829 -2488 N ATOM 1037 CA ALA B 71 14.065 50.178 30.775 1.00 56.11 C ANISOU 1037 CA ALA B 71 8180 8376 4762 -982 1838 -2587 C ATOM 1038 C ALA B 71 15.215 49.188 30.943 1.00 58.66 C ANISOU 1038 C ALA B 71 8348 9036 4903 -1214 1649 -2299 C ATOM 1039 O ALA B 71 16.114 49.410 31.754 1.00 61.82 O ANISOU 1039 O ALA B 71 8663 9705 5122 -1477 1610 -2419 O ATOM 1040 CB ALA B 71 12.866 49.741 31.606 1.00 56.31 C ANISOU 1040 CB ALA B 71 8019 8718 4658 -844 1932 -2599 C ATOM 0 H ALA B 71 12.873 50.099 29.201 1.00 50.13 H new ATOM 0 HA ALA B 71 14.365 51.045 31.089 1.00 56.11 H new ATOM 0 HB1 ALA B 71 13.130 49.657 32.536 1.00 56.31 H new ATOM 0 HB2 ALA B 71 12.160 50.402 31.529 1.00 56.31 H new ATOM 0 HB3 ALA B 71 12.543 48.885 31.284 1.00 56.31 H new ATOM 1046 N LYS B 72 15.176 48.100 30.178 1.00 47.52 N ANISOU 1046 N LYS B 72 6888 7617 3549 -1095 1525 -1939 N ATOM 1047 CA LYS B 72 16.222 47.073 30.202 1.00 54.55 C ANISOU 1047 CA LYS B 72 7638 8775 4312 -1221 1317 -1655 C ATOM 1048 C LYS B 72 17.305 47.297 29.141 1.00 50.86 C ANISOU 1048 C LYS B 72 7254 8078 3995 -1308 1239 -1648 C ATOM 1049 O LYS B 72 18.233 46.493 29.030 1.00 56.30 O ANISOU 1049 O LYS B 72 7802 8981 4608 -1371 1066 -1460 O ATOM 1050 CB LYS B 72 15.618 45.678 29.979 1.00 51.26 C ANISOU 1050 CB LYS B 72 7128 8471 3879 -1056 1223 -1266 C ATOM 1051 CG LYS B 72 14.683 45.154 31.072 1.00 57.88 C ANISOU 1051 CG LYS B 72 7845 9622 4526 -1056 1277 -1181 C ATOM 1052 CD LYS B 72 14.165 43.768 30.665 1.00 58.11 C ANISOU 1052 CD LYS B 72 7822 9671 4585 -948 1185 -768 C ATOM 1053 CE LYS B 72 13.045 43.260 31.560 1.00 54.22 C ANISOU 1053 CE LYS B 72 7225 9432 3944 -987 1278 -673 C ATOM 1054 NZ LYS B 72 13.529 42.862 32.909 1.00 57.21 N ANISOU 1054 NZ LYS B 72 7516 10221 4001 -1192 1184 -585 N ATOM 0 H LYS B 72 14.538 47.934 29.626 1.00 47.52 H new ATOM 0 HA LYS B 72 16.633 47.136 31.079 1.00 54.55 H new ATOM 0 HB2 LYS B 72 15.129 45.690 29.141 1.00 51.26 H new ATOM 0 HB3 LYS B 72 16.346 45.046 29.874 1.00 51.26 H new ATOM 0 HG2 LYS B 72 15.154 45.100 31.918 1.00 57.88 H new ATOM 0 HG3 LYS B 72 13.940 45.765 31.199 1.00 57.88 H new ATOM 0 HD2 LYS B 72 13.848 43.804 29.749 1.00 58.11 H new ATOM 0 HD3 LYS B 72 14.900 43.135 30.686 1.00 58.11 H new ATOM 0 HE2 LYS B 72 12.371 43.951 31.653 1.00 54.22 H new ATOM 0 HE3 LYS B 72 12.616 42.500 31.136 1.00 54.22 H new ATOM 0 HZ1 LYS B 72 12.843 42.572 33.397 1.00 57.21 H new ATOM 0 HZ2 LYS B 72 14.131 42.212 32.829 1.00 57.21 H new ATOM 0 HZ3 LYS B 72 13.902 43.564 33.310 1.00 57.21 H new ATOM 1068 N ASN B 73 17.186 48.372 28.360 1.00 51.43 N ANISOU 1068 N ASN B 73 8198 6086 5256 -1154 1066 -2256 N ATOM 1069 CA ASN B 73 18.087 48.615 27.226 1.00 50.51 C ANISOU 1069 CA ASN B 73 8030 5717 5444 -1239 926 -1970 C ATOM 1070 C ASN B 73 18.176 47.406 26.300 1.00 43.62 C ANISOU 1070 C ASN B 73 7040 5010 4525 -1155 913 -1503 C ATOM 1071 O ASN B 73 19.248 47.079 25.794 1.00 41.98 O ANISOU 1071 O ASN B 73 6778 4834 4340 -1273 784 -1231 O ATOM 1072 CB ASN B 73 19.491 48.980 27.709 1.00 51.34 C ANISOU 1072 CB ASN B 73 8156 5849 5502 -1527 715 -2048 C ATOM 1073 CG ASN B 73 19.518 50.268 28.500 1.00 56.45 C ANISOU 1073 CG ASN B 73 8926 6264 6260 -1630 683 -2549 C ATOM 1074 OD1 ASN B 73 19.793 50.268 29.701 1.00 66.10 O ANISOU 1074 OD1 ASN B 73 10182 7755 7176 -1735 599 -2802 O ATOM 1075 ND2 ASN B 73 19.239 51.380 27.827 1.00 67.11 N ANISOU 1075 ND2 ASN B 73 10283 7129 8086 -1554 730 -2628 N ATOM 0 H ASN B 73 16.586 48.978 28.470 1.00 51.43 H new ATOM 0 HA ASN B 73 17.712 49.358 26.729 1.00 50.51 H new ATOM 0 HB2 ASN B 73 19.838 48.260 28.259 1.00 51.34 H new ATOM 0 HB3 ASN B 73 20.081 49.062 26.944 1.00 51.34 H new ATOM 0 HD21 ASN B 73 19.246 52.140 28.230 1.00 67.11 H new ATOM 0 HD22 ASN B 73 19.052 51.340 26.989 1.00 67.11 H new ATOM 1082 N THR B 74 17.035 46.763 26.074 1.00 43.32 N ANISOU 1082 N THR B 74 6959 5056 4446 -945 1048 -1417 N ATOM 1083 CA THR B 74 16.967 45.508 25.346 1.00 37.98 C ANISOU 1083 CA THR B 74 6174 4552 3703 -858 1034 -1054 C ATOM 1084 C THR B 74 16.031 45.644 24.154 1.00 29.78 C ANISOU 1084 C THR B 74 5113 3271 2931 -639 1096 -909 C ATOM 1085 O THR B 74 14.984 46.278 24.246 1.00 36.18 O ANISOU 1085 O THR B 74 5949 3911 3886 -509 1213 -1069 O ATOM 1086 CB THR B 74 16.481 44.373 26.274 1.00 38.53 C ANISOU 1086 CB THR B 74 6163 5009 3468 -828 1100 -1045 C ATOM 1087 OG1 THR B 74 17.406 44.230 27.360 1.00 50.09 O ANISOU 1087 OG1 THR B 74 7624 6754 4654 -1039 1030 -1138 O ATOM 1088 CG2 THR B 74 16.353 43.043 25.539 1.00 35.72 C ANISOU 1088 CG2 THR B 74 5675 4783 3112 -738 1082 -700 C ATOM 0 H THR B 74 16.270 47.049 26.344 1.00 43.32 H new ATOM 0 HA THR B 74 17.856 45.288 25.025 1.00 37.98 H new ATOM 0 HB THR B 74 15.600 44.612 26.601 1.00 38.53 H new ATOM 0 HG1 THR B 74 17.445 44.949 27.792 1.00 50.09 H new ATOM 0 HG21 THR B 74 16.046 42.360 26.156 1.00 35.72 H new ATOM 0 HG22 THR B 74 15.715 43.134 24.814 1.00 35.72 H new ATOM 0 HG23 THR B 74 17.217 42.788 25.178 1.00 35.72 H new ATOM 1096 N AVAL B 75 16.428 45.072 23.024 0.58 28.03 N ANISOU 1096 N AVAL B 75 4838 3042 2769 -596 1021 -599 N ATOM 1097 N BVAL B 75 16.427 45.024 23.045 0.42 28.88 N ANISOU 1097 N BVAL B 75 4944 3162 2867 -597 1021 -597 N ATOM 1098 CA AVAL B 75 15.549 44.964 21.875 0.58 30.82 C ANISOU 1098 CA AVAL B 75 5155 3261 3295 -392 1047 -437 C ATOM 1099 CA BVAL B 75 15.627 44.954 21.829 0.42 31.56 C ANISOU 1099 CA BVAL B 75 5249 3355 3388 -398 1040 -424 C ATOM 1100 C AVAL B 75 15.270 43.492 21.638 0.58 32.95 C ANISOU 1100 C AVAL B 75 5346 3768 3407 -324 1015 -263 C ATOM 1101 C BVAL B 75 15.319 43.488 21.537 0.42 32.38 C ANISOU 1101 C BVAL B 75 5274 3688 3342 -321 1009 -245 C ATOM 1102 O AVAL B 75 16.092 42.634 21.963 0.58 29.51 O ANISOU 1102 O AVAL B 75 4873 3546 2795 -434 968 -170 O ATOM 1103 O BVAL B 75 16.176 42.625 21.723 0.42 23.55 O ANISOU 1103 O BVAL B 75 4120 2770 2058 -424 955 -131 O ATOM 1104 CB AVAL B 75 16.158 45.617 20.626 0.58 30.19 C ANISOU 1104 CB AVAL B 75 5077 2971 3424 -360 986 -235 C ATOM 1105 CB BVAL B 75 16.369 45.601 20.645 0.42 30.88 C ANISOU 1105 CB BVAL B 75 5166 3069 3497 -385 973 -223 C ATOM 1106 CG1AVAL B 75 16.539 47.053 20.937 0.58 36.53 C ANISOU 1106 CG1AVAL B 75 5915 3506 4457 -450 1005 -395 C ATOM 1107 CG1BVAL B 75 15.548 45.522 19.364 0.42 28.60 C ANISOU 1107 CG1BVAL B 75 4833 2693 3340 -174 978 -33 C ATOM 1108 CG2AVAL B 75 17.365 44.845 20.140 0.58 32.60 C ANISOU 1108 CG2AVAL B 75 5364 3431 3592 -431 891 9 C ATOM 1109 CG2BVAL B 75 16.702 47.045 20.980 0.42 38.00 C ANISOU 1109 CG2BVAL B 75 6105 3702 4631 -473 993 -392 C ATOM 0 H AVAL B 75 17.211 44.738 22.905 0.58 28.88 H new ATOM 0 H BVAL B 75 17.185 44.624 22.979 0.42 28.88 H new ATOM 0 HA AVAL B 75 14.723 45.439 22.054 0.58 31.56 H new ATOM 0 HA BVAL B 75 14.800 45.445 21.954 0.42 31.56 H new ATOM 0 HB AVAL B 75 15.495 45.606 19.918 0.58 30.88 H new ATOM 0 HB BVAL B 75 17.192 45.110 20.492 0.42 30.88 H new ATOM 0 HG11AVAL B 75 16.924 47.464 20.147 0.58 28.60 H new ATOM 0 HG11BVAL B 75 16.040 45.937 18.638 0.42 28.60 H new ATOM 0 HG12AVAL B 75 15.749 47.547 21.206 0.58 28.60 H new ATOM 0 HG12BVAL B 75 15.375 44.593 19.147 0.42 28.60 H new ATOM 0 HG13AVAL B 75 17.189 47.067 21.657 0.58 28.60 H new ATOM 0 HG13BVAL B 75 14.706 45.987 19.490 0.42 28.60 H new ATOM 0 HG21AVAL B 75 17.730 45.277 19.352 0.58 38.00 H new ATOM 0 HG21BVAL B 75 17.169 47.451 20.233 0.42 38.00 H new ATOM 0 HG22AVAL B 75 18.038 44.824 20.838 0.58 38.00 H new ATOM 0 HG22BVAL B 75 15.883 47.535 21.153 0.42 38.00 H new ATOM 0 HG23AVAL B 75 17.102 43.938 19.918 0.58 38.00 H new ATOM 0 HG23BVAL B 75 17.267 47.073 21.768 0.42 38.00 H new ATOM 1128 N TYR B 76 14.096 43.209 21.093 1.00 25.60 N ANISOU 1128 N TYR B 76 4368 2781 2578 -149 1038 -211 N ATOM 1129 CA TYR B 76 13.636 41.836 20.885 1.00 22.19 C ANISOU 1129 CA TYR B 76 3839 2520 2071 -75 993 -81 C ATOM 1130 C TYR B 76 13.241 41.596 19.444 1.00 21.32 C ANISOU 1130 C TYR B 76 3721 2310 2070 68 902 81 C ATOM 1131 O TYR B 76 12.859 42.524 18.719 1.00 23.07 O ANISOU 1131 O TYR B 76 3976 2346 2444 153 906 105 O ATOM 1132 CB TYR B 76 12.443 41.518 21.781 1.00 23.72 C ANISOU 1132 CB TYR B 76 3949 2785 2278 2 1082 -170 C ATOM 1133 CG TYR B 76 12.686 41.729 23.251 1.00 26.09 C ANISOU 1133 CG TYR B 76 4256 3247 2411 -102 1184 -345 C ATOM 1134 CD1 TYR B 76 13.290 40.754 24.028 1.00 32.26 C ANISOU 1134 CD1 TYR B 76 4945 4322 2992 -205 1173 -282 C ATOM 1135 CD2 TYR B 76 12.305 42.917 23.862 1.00 30.11 C ANISOU 1135 CD2 TYR B 76 4853 3625 2963 -89 1298 -575 C ATOM 1136 CE1 TYR B 76 13.507 40.956 25.401 1.00 30.35 C ANISOU 1136 CE1 TYR B 76 4700 4292 2540 -296 1257 -436 C ATOM 1137 CE2 TYR B 76 12.517 43.126 25.223 1.00 34.67 C ANISOU 1137 CE2 TYR B 76 5458 4384 3333 -172 1384 -783 C ATOM 1138 CZ TYR B 76 13.119 42.141 25.978 1.00 37.67 C ANISOU 1138 CZ TYR B 76 5746 5106 3462 -276 1353 -706 C ATOM 1139 OH TYR B 76 13.340 42.342 27.325 1.00 41.35 O ANISOU 1139 OH TYR B 76 6204 5804 3703 -340 1390 -879 O ATOM 0 H ATYR B 76 13.538 43.808 20.831 0.58 25.60 H new ATOM 0 H BTYR B 76 13.509 43.809 20.904 0.42 25.60 H new ATOM 0 HA TYR B 76 14.378 41.254 21.112 1.00 22.19 H new ATOM 0 HB2 TYR B 76 11.693 42.069 21.507 1.00 23.72 H new ATOM 0 HB3 TYR B 76 12.184 40.594 21.638 1.00 23.72 H new ATOM 0 HD1 TYR B 76 13.556 39.954 23.635 1.00 32.26 H new ATOM 0 HD2 TYR B 76 11.902 43.584 23.354 1.00 30.11 H new ATOM 0 HE1 TYR B 76 13.910 40.294 25.915 1.00 30.35 H new ATOM 0 HE2 TYR B 76 12.254 43.925 25.620 1.00 34.67 H new ATOM 0 HH TYR B 76 13.058 43.102 27.545 1.00 41.35 H new ATOM 1150 N LEU B 77 13.324 40.333 19.042 1.00 21.96 N ANISOU 1150 N LEU B 77 3741 2524 2079 96 819 189 N ATOM 1151 CA LEU B 77 12.729 39.861 17.796 1.00 20.24 C ANISOU 1151 CA LEU B 77 3507 2258 1926 240 707 286 C ATOM 1152 C LEU B 77 11.904 38.635 18.142 1.00 21.27 C ANISOU 1152 C LEU B 77 3503 2471 2106 280 660 285 C ATOM 1153 O LEU B 77 12.472 37.593 18.517 1.00 22.11 O ANISOU 1153 O LEU B 77 3542 2714 2144 212 653 319 O ATOM 1154 CB LEU B 77 13.772 39.493 16.740 1.00 19.26 C ANISOU 1154 CB LEU B 77 3449 2184 1685 255 632 406 C ATOM 1155 CG LEU B 77 13.185 39.162 15.360 1.00 20.47 C ANISOU 1155 CG LEU B 77 3614 2316 1847 419 502 467 C ATOM 1156 CD1 LEU B 77 12.498 40.394 14.758 1.00 22.52 C ANISOU 1156 CD1 LEU B 77 3889 2444 2222 513 503 512 C ATOM 1157 CD2 LEU B 77 14.231 38.618 14.405 1.00 22.42 C ANISOU 1157 CD2 LEU B 77 3934 2656 1931 462 456 562 C ATOM 0 H LEU B 77 13.730 39.720 19.488 1.00 21.96 H new ATOM 0 HA LEU B 77 12.193 40.572 17.412 1.00 20.24 H new ATOM 0 HB2 LEU B 77 14.396 40.230 16.646 1.00 19.26 H new ATOM 0 HB3 LEU B 77 14.280 38.729 17.055 1.00 19.26 H new ATOM 0 HG LEU B 77 12.525 38.463 15.491 1.00 20.47 H new ATOM 0 HD11 LEU B 77 12.133 40.169 13.888 1.00 22.52 H new ATOM 0 HD12 LEU B 77 11.781 40.683 15.344 1.00 22.52 H new ATOM 0 HD13 LEU B 77 13.145 41.110 14.661 1.00 22.52 H new ATOM 0 HD21 LEU B 77 13.818 38.423 13.549 1.00 22.42 H new ATOM 0 HD22 LEU B 77 14.932 39.277 14.283 1.00 22.42 H new ATOM 0 HD23 LEU B 77 14.613 37.805 14.772 1.00 22.42 H new ATOM 1169 N GLN B 78 10.585 38.776 18.093 1.00 22.06 N ANISOU 1169 N GLN B 78 3536 2479 2369 384 641 278 N ATOM 1170 CA GLN B 78 9.659 37.670 18.303 1.00 20.79 C ANISOU 1170 CA GLN B 78 3212 2351 2337 441 571 319 C ATOM 1171 C GLN B 78 9.409 37.021 16.956 1.00 23.23 C ANISOU 1171 C GLN B 78 3525 2615 2688 522 368 360 C ATOM 1172 O GLN B 78 8.925 37.688 16.044 1.00 23.48 O ANISOU 1172 O GLN B 78 3616 2555 2752 604 295 386 O ATOM 1173 CB GLN B 78 8.333 38.138 18.892 1.00 24.06 C ANISOU 1173 CB GLN B 78 3533 2677 2932 524 646 331 C ATOM 1174 CG GLN B 78 7.353 37.012 19.144 1.00 25.20 C ANISOU 1174 CG GLN B 78 3467 2839 3268 590 569 428 C ATOM 1175 CD GLN B 78 7.895 35.990 20.119 1.00 25.37 C ANISOU 1175 CD GLN B 78 3355 3043 3240 517 628 458 C ATOM 1176 OE1 GLN B 78 8.466 36.340 21.154 1.00 29.55 O ANISOU 1176 OE1 GLN B 78 3907 3712 3610 446 791 413 O ATOM 1177 NE2 GLN B 78 7.750 34.719 19.784 1.00 28.28 N ANISOU 1177 NE2 GLN B 78 3572 3418 3757 529 487 535 N ATOM 0 H GLN B 78 10.197 39.527 17.935 1.00 22.06 H new ATOM 0 HA GLN B 78 10.050 37.046 18.935 1.00 20.79 H new ATOM 0 HB2 GLN B 78 8.504 38.601 19.727 1.00 24.06 H new ATOM 0 HB3 GLN B 78 7.928 38.781 18.289 1.00 24.06 H new ATOM 0 HG2 GLN B 78 6.524 37.378 19.489 1.00 25.20 H new ATOM 0 HG3 GLN B 78 7.142 36.575 18.304 1.00 25.20 H new ATOM 0 HE21 GLN B 78 7.346 34.510 19.054 1.00 28.28 H new ATOM 0 HE22 GLN B 78 8.060 34.101 20.296 1.00 28.28 H new ATOM 1186 N MET B 79 9.751 35.737 16.831 1.00 23.97 N ANISOU 1186 N MET B 79 3546 2778 2783 500 280 363 N ATOM 1187 CA MET B 79 9.613 35.021 15.567 1.00 25.03 C ANISOU 1187 CA MET B 79 3706 2879 2927 575 78 336 C ATOM 1188 C MET B 79 8.623 33.879 15.702 1.00 22.71 C ANISOU 1188 C MET B 79 3211 2525 2892 607 -62 340 C ATOM 1189 O MET B 79 8.865 32.928 16.436 1.00 25.43 O ANISOU 1189 O MET B 79 3406 2912 3345 552 -18 369 O ATOM 1190 CB MET B 79 10.966 34.491 15.115 1.00 21.64 C ANISOU 1190 CB MET B 79 3377 2536 2311 539 92 312 C ATOM 1191 CG MET B 79 11.942 35.572 14.741 1.00 24.11 C ANISOU 1191 CG MET B 79 3865 2886 2408 529 190 354 C ATOM 1192 SD MET B 79 13.443 34.864 14.024 1.00 37.20 S ANISOU 1192 SD MET B 79 5628 4638 3868 533 209 381 S ATOM 1193 CE MET B 79 14.086 34.520 15.499 1.00 21.23 C ANISOU 1193 CE MET B 79 3488 2680 1900 363 366 439 C ATOM 0 H MET B 79 10.067 35.261 17.474 1.00 23.97 H new ATOM 0 HA MET B 79 9.277 35.640 14.900 1.00 25.03 H new ATOM 0 HB2 MET B 79 11.348 33.953 15.826 1.00 21.64 H new ATOM 0 HB3 MET B 79 10.837 33.905 14.353 1.00 21.64 H new ATOM 0 HG2 MET B 79 11.531 36.179 14.106 1.00 24.11 H new ATOM 0 HG3 MET B 79 12.169 36.094 15.526 1.00 24.11 H new ATOM 0 HE1 MET B 79 15.035 34.344 15.405 1.00 21.23 H new ATOM 0 HE2 MET B 79 13.955 35.275 16.094 1.00 21.23 H new ATOM 0 HE3 MET B 79 13.648 33.738 15.869 1.00 21.23 H new ATOM 1203 N ASN B 80 7.504 33.998 15.000 1.00 24.99 N ANISOU 1203 N ASN B 80 3468 2713 3312 691 -236 346 N ATOM 1204 CA ASN B 80 6.450 32.992 15.035 1.00 26.45 C ANISOU 1204 CA ASN B 80 3443 2802 3806 721 -412 371 C ATOM 1205 C ASN B 80 6.328 32.299 13.693 1.00 28.18 C ANISOU 1205 C ASN B 80 3719 2979 4010 766 -694 242 C ATOM 1206 O ASN B 80 6.800 32.827 12.692 1.00 27.22 O ANISOU 1206 O ASN B 80 3800 2927 3617 808 -742 171 O ATOM 1207 CB ASN B 80 5.119 33.634 15.417 1.00 28.57 C ANISOU 1207 CB ASN B 80 3589 2977 4288 777 -404 508 C ATOM 1208 CG ASN B 80 5.155 34.244 16.801 1.00 24.22 C ANISOU 1208 CG ASN B 80 2984 2477 3740 758 -119 594 C ATOM 1209 OD1 ASN B 80 5.883 33.759 17.674 1.00 28.55 O ANISOU 1209 OD1 ASN B 80 3480 3137 4232 694 16 589 O ATOM 1210 ND2 ASN B 80 4.401 35.309 17.005 1.00 29.30 N ANISOU 1210 ND2 ASN B 80 3640 3053 4439 816 -19 672 N ATOM 0 H ASN B 80 7.333 34.667 14.487 1.00 24.99 H new ATOM 0 HA ASN B 80 6.683 32.329 15.704 1.00 26.45 H new ATOM 0 HB2 ASN B 80 4.895 34.320 14.769 1.00 28.57 H new ATOM 0 HB3 ASN B 80 4.417 32.966 15.378 1.00 28.57 H new ATOM 0 HD21 ASN B 80 4.403 35.696 17.773 1.00 29.30 H new ATOM 0 HD22 ASN B 80 3.908 35.615 16.370 1.00 29.30 H new ATOM 1217 N SER B 81 5.688 31.129 13.678 1.00 28.60 N ANISOU 1217 N SER B 81 3581 2924 4363 766 -883 213 N ATOM 1218 CA SER B 81 5.438 30.397 12.438 1.00 29.84 C ANISOU 1218 CA SER B 81 3783 3021 4535 804 -1192 35 C ATOM 1219 C SER B 81 6.722 30.278 11.626 1.00 27.60 C ANISOU 1219 C SER B 81 3744 2855 3889 824 -1157 -142 C ATOM 1220 O SER B 81 6.738 30.595 10.423 1.00 30.13 O ANISOU 1220 O SER B 81 4244 3250 3954 899 -1311 -253 O ATOM 1221 CB SER B 81 4.369 31.089 11.593 1.00 34.95 C ANISOU 1221 CB SER B 81 4462 3646 5170 862 -1405 73 C ATOM 1222 OG SER B 81 3.170 31.269 12.322 1.00 37.60 O ANISOU 1222 OG SER B 81 4570 3863 5855 859 -1412 281 O ATOM 0 H SER B 81 5.388 30.740 14.384 1.00 28.60 H new ATOM 0 HA SER B 81 5.121 29.512 12.678 1.00 29.84 H new ATOM 0 HB2 SER B 81 4.699 31.950 11.293 1.00 34.95 H new ATOM 0 HB3 SER B 81 4.190 30.561 10.799 1.00 34.95 H new ATOM 0 HG SER B 81 2.601 31.652 11.836 1.00 37.60 H new ATOM 1228 N LEU B 82 7.781 29.825 12.279 1.00 30.06 N ANISOU 1228 N LEU B 82 4043 3203 4174 770 -949 -135 N ATOM 1229 CA LEU B 82 9.078 29.689 11.641 1.00 26.63 C ANISOU 1229 CA LEU B 82 3817 2870 3432 797 -864 -246 C ATOM 1230 C LEU B 82 9.075 28.589 10.591 1.00 30.63 C ANISOU 1230 C LEU B 82 4369 3308 3960 861 -1092 -498 C ATOM 1231 O LEU B 82 8.341 27.615 10.697 1.00 29.69 O ANISOU 1231 O LEU B 82 4061 3025 4195 837 -1275 -585 O ATOM 1232 CB LEU B 82 10.154 29.435 12.691 1.00 23.45 C ANISOU 1232 CB LEU B 82 3346 2516 3047 706 -588 -128 C ATOM 1233 CG LEU B 82 10.588 30.722 13.395 1.00 23.23 C ANISOU 1233 CG LEU B 82 3394 2605 2828 656 -365 40 C ATOM 1234 CD1 LEU B 82 11.298 30.426 14.710 1.00 22.04 C ANISOU 1234 CD1 LEU B 82 3100 2516 2758 537 -142 178 C ATOM 1235 CD2 LEU B 82 11.509 31.506 12.489 1.00 25.32 C ANISOU 1235 CD2 LEU B 82 3914 2972 2733 716 -310 27 C ATOM 0 H LEU B 82 7.767 29.588 13.105 1.00 30.06 H new ATOM 0 HA LEU B 82 9.276 30.521 11.184 1.00 26.63 H new ATOM 0 HB2 LEU B 82 9.820 28.805 13.349 1.00 23.45 H new ATOM 0 HB3 LEU B 82 10.924 29.023 12.270 1.00 23.45 H new ATOM 0 HG LEU B 82 9.793 31.241 13.592 1.00 23.23 H new ATOM 0 HD11 LEU B 82 11.560 31.260 15.131 1.00 22.04 H new ATOM 0 HD12 LEU B 82 10.699 29.941 15.299 1.00 22.04 H new ATOM 0 HD13 LEU B 82 12.087 29.889 14.538 1.00 22.04 H new ATOM 0 HD21 LEU B 82 11.784 32.322 12.935 1.00 25.32 H new ATOM 0 HD22 LEU B 82 12.291 30.971 12.282 1.00 25.32 H new ATOM 0 HD23 LEU B 82 11.043 31.728 11.668 1.00 25.32 H new ATOM 1247 N LYS B 83 9.905 28.775 9.572 1.00 27.57 N ANISOU 1247 N LYS B 83 4229 3046 3199 955 -1077 -614 N ATOM 1248 CA LYS B 83 9.959 27.886 8.414 1.00 29.56 C ANISOU 1248 CA LYS B 83 4593 3278 3362 1051 -1285 -907 C ATOM 1249 C LYS B 83 11.419 27.538 8.147 1.00 29.29 C ANISOU 1249 C LYS B 83 4712 3321 3097 1109 -1061 -950 C ATOM 1250 O LYS B 83 12.311 28.277 8.533 1.00 29.35 O ANISOU 1250 O LYS B 83 4787 3444 2922 1094 -803 -734 O ATOM 1251 CB LYS B 83 9.353 28.540 7.173 1.00 34.71 C ANISOU 1251 CB LYS B 83 5412 4070 3704 1165 -1520 -1002 C ATOM 1252 CG LYS B 83 7.943 29.037 7.325 1.00 43.97 C ANISOU 1252 CG LYS B 83 6441 5185 5082 1118 -1726 -901 C ATOM 1253 CD LYS B 83 7.624 29.990 6.177 1.00 49.00 C ANISOU 1253 CD LYS B 83 7239 6035 5344 1229 -1864 -877 C ATOM 1254 CE LYS B 83 6.269 30.633 6.327 1.00 53.53 C ANISOU 1254 CE LYS B 83 7657 6558 6126 1183 -2028 -706 C ATOM 1255 NZ LYS B 83 5.933 31.431 5.116 1.00 57.25 N ANISOU 1255 NZ LYS B 83 8245 7256 6250 1291 -2190 -666 N ATOM 0 H LYS B 83 10.461 29.430 9.531 1.00 27.57 H new ATOM 0 HA LYS B 83 9.442 27.088 8.606 1.00 29.56 H new ATOM 0 HB2 LYS B 83 9.916 29.286 6.913 1.00 34.71 H new ATOM 0 HB3 LYS B 83 9.377 27.899 6.445 1.00 34.71 H new ATOM 0 HG2 LYS B 83 7.323 28.291 7.323 1.00 43.97 H new ATOM 0 HG3 LYS B 83 7.838 29.491 8.176 1.00 43.97 H new ATOM 0 HD2 LYS B 83 8.304 30.680 6.134 1.00 49.00 H new ATOM 0 HD3 LYS B 83 7.658 29.505 5.338 1.00 49.00 H new ATOM 0 HE2 LYS B 83 5.595 29.950 6.468 1.00 53.53 H new ATOM 0 HE3 LYS B 83 6.261 31.205 7.110 1.00 53.53 H new ATOM 0 HZ1 LYS B 83 5.132 31.804 5.219 1.00 57.25 H new ATOM 0 HZ2 LYS B 83 6.544 32.068 5.001 1.00 57.25 H new ATOM 0 HZ3 LYS B 83 5.923 30.899 4.403 1.00 57.25 H new ATOM 1269 N PRO B 84 11.670 26.411 7.486 1.00 31.54 N ANISOU 1269 N PRO B 84 5046 3523 3415 1176 -1159 -1226 N ATOM 1270 CA PRO B 84 13.077 26.090 7.217 1.00 33.99 C ANISOU 1270 CA PRO B 84 5499 3900 3517 1253 -908 -1233 C ATOM 1271 C PRO B 84 13.855 27.197 6.502 1.00 38.88 C ANISOU 1271 C PRO B 84 6369 4780 3623 1386 -767 -1096 C ATOM 1272 O PRO B 84 15.059 27.328 6.740 1.00 33.18 O ANISOU 1272 O PRO B 84 5698 4119 2791 1399 -485 -914 O ATOM 1273 CB PRO B 84 12.981 24.839 6.345 1.00 35.27 C ANISOU 1273 CB PRO B 84 5718 3935 3747 1348 -1088 -1628 C ATOM 1274 CG PRO B 84 11.717 24.197 6.770 1.00 39.08 C ANISOU 1274 CG PRO B 84 5954 4189 4706 1233 -1364 -1743 C ATOM 1275 CD PRO B 84 10.765 25.321 7.080 1.00 34.99 C ANISOU 1275 CD PRO B 84 5383 3767 4147 1175 -1473 -1530 C ATOM 0 HA PRO B 84 13.572 25.971 8.042 1.00 33.99 H new ATOM 0 HB2 PRO B 84 12.964 25.065 5.402 1.00 35.27 H new ATOM 0 HB3 PRO B 84 13.741 24.252 6.483 1.00 35.27 H new ATOM 0 HG2 PRO B 84 11.364 23.627 6.069 1.00 39.08 H new ATOM 0 HG3 PRO B 84 11.857 23.636 7.549 1.00 39.08 H new ATOM 0 HD2 PRO B 84 10.232 25.565 6.307 1.00 34.99 H new ATOM 0 HD3 PRO B 84 10.146 25.084 7.788 1.00 34.99 H new ATOM 1283 N GLU B 85 13.176 27.994 5.683 1.00 38.31 N ANISOU 1283 N GLU B 85 6412 4861 3283 1478 -956 -1130 N ATOM 1284 CA GLU B 85 13.820 29.079 4.948 1.00 38.50 C ANISOU 1284 CA GLU B 85 6606 5138 2885 1613 -827 -941 C ATOM 1285 C GLU B 85 14.313 30.203 5.879 1.00 36.89 C ANISOU 1285 C GLU B 85 6345 4959 2714 1518 -589 -577 C ATOM 1286 O GLU B 85 15.025 31.118 5.446 1.00 36.47 O ANISOU 1286 O GLU B 85 6276 5020 2562 1538 -415 -339 O ATOM 1287 CB GLU B 85 12.844 29.655 3.918 1.00 42.13 C ANISOU 1287 CB GLU B 85 7066 5733 3206 1671 -1058 -979 C ATOM 1288 CG GLU B 85 11.871 30.650 4.535 1.00 48.40 C ANISOU 1288 CG GLU B 85 7771 6511 4107 1591 -1159 -803 C ATOM 1289 CD GLU B 85 10.605 30.845 3.723 1.00 61.95 C ANISOU 1289 CD GLU B 85 9449 8296 5792 1617 -1464 -892 C ATOM 1290 OE1 GLU B 85 10.134 32.005 3.631 1.00 55.40 O ANISOU 1290 OE1 GLU B 85 8564 7560 4927 1612 -1452 -652 O ATOM 1291 OE2 GLU B 85 10.070 29.844 3.195 1.00 63.37 O ANISOU 1291 OE2 GLU B 85 9634 8422 6021 1628 -1712 -1190 O ATOM 0 H GLU B 85 12.331 27.922 5.538 1.00 38.31 H new ATOM 0 HA GLU B 85 14.597 28.707 4.502 1.00 38.50 H new ATOM 0 HB2 GLU B 85 13.344 30.091 3.211 1.00 42.13 H new ATOM 0 HB3 GLU B 85 12.346 28.931 3.508 1.00 42.13 H new ATOM 0 HG2 GLU B 85 11.632 30.347 5.425 1.00 48.40 H new ATOM 0 HG3 GLU B 85 12.316 31.506 4.636 1.00 48.40 H new ATOM 1298 N ASP B 86 13.920 30.141 7.143 1.00 30.23 N ANISOU 1298 N ASP B 86 5307 3948 2232 1324 -552 -496 N ATOM 1299 CA ASP B 86 14.316 31.158 8.130 1.00 26.13 C ANISOU 1299 CA ASP B 86 4718 3433 1775 1205 -346 -207 C ATOM 1300 C ASP B 86 15.624 30.791 8.824 1.00 24.34 C ANISOU 1300 C ASP B 86 4467 3191 1591 1128 -89 -69 C ATOM 1301 O ASP B 86 16.143 31.546 9.629 1.00 26.21 O ANISOU 1301 O ASP B 86 4660 3444 1856 1020 73 149 O ATOM 1302 CB ASP B 86 13.236 31.359 9.207 1.00 25.05 C ANISOU 1302 CB ASP B 86 4389 3169 1959 1053 -412 -176 C ATOM 1303 CG ASP B 86 11.931 31.926 8.649 1.00 29.20 C ANISOU 1303 CG ASP B 86 4907 3700 2488 1109 -638 -221 C ATOM 1304 OD1 ASP B 86 11.967 32.917 7.873 1.00 31.24 O ANISOU 1304 OD1 ASP B 86 5275 4088 2505 1211 -646 -123 O ATOM 1305 OD2 ASP B 86 10.861 31.377 9.013 1.00 28.92 O ANISOU 1305 OD2 ASP B 86 4721 3537 2731 1051 -802 -311 O ATOM 0 H ASP B 86 13.420 29.517 7.459 1.00 30.23 H new ATOM 0 HA ASP B 86 14.433 31.982 7.632 1.00 26.13 H new ATOM 0 HB2 ASP B 86 13.055 30.509 9.638 1.00 25.05 H new ATOM 0 HB3 ASP B 86 13.576 31.957 9.891 1.00 25.05 H new ATOM 1310 N THR B 87 16.139 29.605 8.537 1.00 25.87 N ANISOU 1310 N THR B 87 4674 3340 1816 1175 -58 -200 N ATOM 1311 CA THR B 87 17.402 29.167 9.121 1.00 25.39 C ANISOU 1311 CA THR B 87 4566 3264 1817 1108 194 -31 C ATOM 1312 C THR B 87 18.536 30.107 8.724 1.00 25.05 C ANISOU 1312 C THR B 87 4598 3340 1578 1146 358 210 C ATOM 1313 O THR B 87 18.750 30.389 7.538 1.00 27.48 O ANISOU 1313 O THR B 87 4972 3722 1748 1280 315 172 O ATOM 1314 CB THR B 87 17.741 27.735 8.664 1.00 24.98 C ANISOU 1314 CB THR B 87 4514 3118 1860 1186 210 -227 C ATOM 1315 OG1 THR B 87 16.757 26.834 9.172 1.00 26.67 O ANISOU 1315 OG1 THR B 87 4533 3160 2441 1091 48 -408 O ATOM 1316 CG2 THR B 87 19.095 27.312 9.138 1.00 25.51 C ANISOU 1316 CG2 THR B 87 4526 3177 1988 1137 493 -2 C ATOM 0 H THR B 87 15.774 29.036 8.006 1.00 25.87 H new ATOM 0 HA THR B 87 17.304 29.180 10.086 1.00 25.39 H new ATOM 0 HB THR B 87 17.745 27.720 7.694 1.00 24.98 H new ATOM 0 HG1 THR B 87 16.121 26.777 8.626 1.00 26.67 H new ATOM 0 HG21 THR B 87 19.277 26.409 8.834 1.00 25.51 H new ATOM 0 HG22 THR B 87 19.766 27.914 8.780 1.00 25.51 H new ATOM 0 HG23 THR B 87 19.122 27.338 10.107 1.00 25.51 H new ATOM 1324 N ALA B 88 19.273 30.573 9.725 1.00 23.11 N ANISOU 1324 N ALA B 88 3708 2562 2513 1197 562 275 N ATOM 1325 CA ALA B 88 20.347 31.534 9.515 1.00 22.64 C ANISOU 1325 CA ALA B 88 3487 2495 2618 1271 691 411 C ATOM 1326 C ALA B 88 20.970 31.910 10.839 1.00 25.82 C ANISOU 1326 C ALA B 88 3633 2946 3231 1174 599 474 C ATOM 1327 O ALA B 88 20.414 31.624 11.882 1.00 22.78 O ANISOU 1327 O ALA B 88 3216 2608 2831 1052 436 400 O ATOM 1328 CB ALA B 88 19.805 32.813 8.827 1.00 23.32 C ANISOU 1328 CB ALA B 88 3594 2619 2646 1270 691 385 C ATOM 0 H ALA B 88 19.164 30.341 10.546 1.00 23.11 H new ATOM 0 HA ALA B 88 21.015 31.124 8.944 1.00 22.64 H new ATOM 0 HB1 ALA B 88 20.531 33.442 8.694 1.00 23.32 H new ATOM 0 HB2 ALA B 88 19.419 32.580 7.968 1.00 23.32 H new ATOM 0 HB3 ALA B 88 19.125 33.219 9.387 1.00 23.32 H new ATOM 1334 N VAL B 89 22.111 32.589 10.788 1.00 22.32 N ANISOU 1334 N VAL B 89 3013 2483 2984 1226 701 616 N ATOM 1335 CA VAL B 89 22.619 33.300 11.942 1.00 22.70 C ANISOU 1335 CA VAL B 89 2824 2573 3227 1113 575 671 C ATOM 1336 C VAL B 89 21.927 34.657 11.954 1.00 21.51 C ANISOU 1336 C VAL B 89 2653 2478 3043 1024 495 612 C ATOM 1337 O VAL B 89 21.901 35.359 10.940 1.00 22.52 O ANISOU 1337 O VAL B 89 2831 2587 3138 1094 616 638 O ATOM 1338 CB VAL B 89 24.141 33.469 11.893 1.00 27.59 C ANISOU 1338 CB VAL B 89 3237 3141 4103 1188 696 859 C ATOM 1339 CG1 VAL B 89 24.634 34.247 13.107 1.00 25.86 C ANISOU 1339 CG1 VAL B 89 2789 2955 4083 1048 517 908 C ATOM 1340 CG2 VAL B 89 24.825 32.092 11.840 1.00 26.32 C ANISOU 1340 CG2 VAL B 89 3102 2921 3976 1306 795 927 C ATOM 0 H VAL B 89 22.606 32.647 10.087 1.00 22.32 H new ATOM 0 HA VAL B 89 22.434 32.798 12.751 1.00 22.70 H new ATOM 0 HB VAL B 89 24.368 33.968 11.093 1.00 27.59 H new ATOM 0 HG11 VAL B 89 25.598 34.344 13.060 1.00 25.86 H new ATOM 0 HG12 VAL B 89 24.221 35.125 13.119 1.00 25.86 H new ATOM 0 HG13 VAL B 89 24.397 33.768 13.917 1.00 25.86 H new ATOM 0 HG21 VAL B 89 25.787 32.209 11.809 1.00 26.32 H new ATOM 0 HG22 VAL B 89 24.587 31.582 12.630 1.00 26.32 H new ATOM 0 HG23 VAL B 89 24.532 31.615 11.047 1.00 26.32 H new ATOM 1350 N TYR B 90 21.360 35.018 13.098 1.00 20.13 N ANISOU 1350 N TYR B 90 2427 2358 2864 882 302 537 N ATOM 1351 CA TYR B 90 20.683 36.298 13.267 1.00 18.24 C ANISOU 1351 CA TYR B 90 2176 2163 2593 802 222 481 C ATOM 1352 C TYR B 90 21.512 37.267 14.102 1.00 19.34 C ANISOU 1352 C TYR B 90 2135 2287 2928 717 140 564 C ATOM 1353 O TYR B 90 22.072 36.900 15.138 1.00 21.27 O ANISOU 1353 O TYR B 90 2286 2519 3277 653 28 599 O ATOM 1354 CB TYR B 90 19.315 36.097 13.926 1.00 17.91 C ANISOU 1354 CB TYR B 90 2233 2184 2389 711 80 333 C ATOM 1355 CG TYR B 90 18.266 35.517 13.006 1.00 16.89 C ANISOU 1355 CG TYR B 90 2273 2075 2071 763 121 239 C ATOM 1356 CD1 TYR B 90 18.387 34.227 12.504 1.00 19.02 C ANISOU 1356 CD1 TYR B 90 2649 2303 2275 830 187 236 C ATOM 1357 CD2 TYR B 90 17.168 36.271 12.608 1.00 18.75 C ANISOU 1357 CD2 TYR B 90 2570 2359 2196 750 85 160 C ATOM 1358 CE1 TYR B 90 17.438 33.707 11.651 1.00 22.45 C ANISOU 1358 CE1 TYR B 90 3256 2738 2534 863 194 148 C ATOM 1359 CE2 TYR B 90 16.221 35.759 11.768 1.00 20.46 C ANISOU 1359 CE2 TYR B 90 2930 2589 2255 787 86 81 C ATOM 1360 CZ TYR B 90 16.360 34.476 11.285 1.00 21.20 C ANISOU 1360 CZ TYR B 90 3139 2635 2281 836 131 72 C ATOM 1361 OH TYR B 90 15.392 33.983 10.441 1.00 22.20 O ANISOU 1361 OH TYR B 90 3427 2761 2246 858 100 -12 O ATOM 0 H TYR B 90 21.357 34.525 13.803 1.00 20.13 H new ATOM 0 HA TYR B 90 20.565 36.681 12.384 1.00 18.24 H new ATOM 0 HB2 TYR B 90 19.419 35.511 14.692 1.00 17.91 H new ATOM 0 HB3 TYR B 90 19.000 36.951 14.262 1.00 17.91 H new ATOM 0 HD1 TYR B 90 19.119 33.707 12.747 1.00 19.02 H new ATOM 0 HD2 TYR B 90 17.077 37.142 12.920 1.00 18.75 H new ATOM 0 HE1 TYR B 90 17.527 32.841 11.325 1.00 22.45 H new ATOM 0 HE2 TYR B 90 15.486 36.274 11.523 1.00 20.46 H new ATOM 0 HH TYR B 90 15.619 33.222 10.168 1.00 22.20 H new ATOM 1371 N TYR B 91 21.588 38.510 13.625 1.00 21.64 N ANISOU 1371 N TYR B 91 2392 2566 3262 715 185 598 N ATOM 1372 CA TYR B 91 22.410 39.539 14.227 1.00 21.79 C ANISOU 1372 CA TYR B 91 2255 2548 3475 629 114 685 C ATOM 1373 C TYR B 91 21.570 40.735 14.563 1.00 20.98 C ANISOU 1373 C TYR B 91 2219 2465 3289 550 19 600 C ATOM 1374 O TYR B 91 20.672 41.069 13.815 1.00 21.14 O ANISOU 1374 O TYR B 91 2360 2515 3158 605 87 532 O ATOM 1375 CB TYR B 91 23.511 40.022 13.272 1.00 24.83 C ANISOU 1375 CB TYR B 91 2524 2872 4038 704 294 841 C ATOM 1376 CG TYR B 91 24.487 38.985 12.788 1.00 24.29 C ANISOU 1376 CG TYR B 91 2376 2769 4084 816 443 959 C ATOM 1377 CD1 TYR B 91 24.198 38.201 11.682 1.00 25.14 C ANISOU 1377 CD1 TYR B 91 2636 2869 4045 965 627 942 C ATOM 1378 CD2 TYR B 91 25.709 38.815 13.410 1.00 27.54 C ANISOU 1378 CD2 TYR B 91 2569 3145 4752 779 398 1093 C ATOM 1379 CE1 TYR B 91 25.083 37.260 11.228 1.00 28.42 C ANISOU 1379 CE1 TYR B 91 3008 3239 4553 1087 787 1051 C ATOM 1380 CE2 TYR B 91 26.599 37.874 12.969 1.00 29.58 C ANISOU 1380 CE2 TYR B 91 2743 3369 5126 902 551 1213 C ATOM 1381 CZ TYR B 91 26.288 37.100 11.875 1.00 30.80 C ANISOU 1381 CZ TYR B 91 3069 3512 5121 1062 761 1192 C ATOM 1382 OH TYR B 91 27.192 36.166 11.429 1.00 34.79 O ANISOU 1382 OH TYR B 91 3543 3983 5692 1156 919 1287 O ATOM 0 H TYR B 91 21.154 38.776 12.932 1.00 21.64 H new ATOM 0 HA TYR B 91 22.810 39.148 15.019 1.00 21.79 H new ATOM 0 HB2 TYR B 91 23.086 40.423 12.498 1.00 24.83 H new ATOM 0 HB3 TYR B 91 24.011 40.724 13.717 1.00 24.83 H new ATOM 0 HD1 TYR B 91 23.388 38.316 11.240 1.00 25.14 H new ATOM 0 HD2 TYR B 91 25.930 39.348 14.139 1.00 27.54 H new ATOM 0 HE1 TYR B 91 24.872 36.734 10.490 1.00 28.42 H new ATOM 0 HE2 TYR B 91 27.411 37.758 13.407 1.00 29.58 H new ATOM 0 HH TYR B 91 27.876 36.182 11.917 1.00 34.79 H new ATOM 1392 N ACYS B 92 21.876 41.364 15.691 0.75 21.52 N ANISOU 1392 N ACYS B 92 2220 2506 3449 427 -144 608 N ATOM 1393 N BCYS B 92 21.868 41.408 15.673 0.25 21.94 N ANISOU 1393 N BCYS B 92 2274 2558 3502 427 -143 608 N ATOM 1394 CA ACYS B 92 21.400 42.697 15.995 0.75 20.63 C ANISOU 1394 CA ACYS B 92 2161 2376 3301 357 -215 563 C ATOM 1395 CA BCYS B 92 21.290 42.725 15.935 0.25 22.57 C ANISOU 1395 CA BCYS B 92 2420 2626 3530 363 -208 555 C ATOM 1396 C ACYS B 92 22.457 43.670 15.491 0.75 22.90 C ANISOU 1396 C ACYS B 92 2325 2587 3790 340 -150 697 C ATOM 1397 C BCYS B 92 22.359 43.793 15.719 0.25 23.72 C ANISOU 1397 C BCYS B 92 2441 2688 3882 317 -188 680 C ATOM 1398 O ACYS B 92 23.666 43.409 15.622 0.75 21.95 O ANISOU 1398 O ACYS B 92 2036 2422 3884 315 -156 822 O ATOM 1399 O BCYS B 92 23.460 43.717 16.266 0.25 33.07 O ANISOU 1399 O BCYS B 92 3476 3822 5268 246 -270 780 O ATOM 1400 CB ACYS B 92 21.159 42.872 17.493 0.75 24.18 C ANISOU 1400 CB ACYS B 92 2653 2812 3721 235 -426 498 C ATOM 1401 CB BCYS B 92 20.698 42.819 17.345 0.25 23.02 C ANISOU 1401 CB BCYS B 92 2555 2690 3502 259 -400 458 C ATOM 1402 SG ACYS B 92 20.258 44.368 17.874 0.75 27.17 S ANISOU 1402 SG ACYS B 92 3168 3167 3988 182 -488 412 S ATOM 1403 SG BCYS B 92 21.873 42.795 18.717 0.25 26.67 S ANISOU 1403 SG BCYS B 92 2916 3075 4141 127 -611 530 S ATOM 0 H ACYS B 92 22.371 41.022 16.305 0.75 21.94 H new ATOM 0 H BCYS B 92 22.400 41.121 16.285 0.25 21.94 H new ATOM 0 HA ACYS B 92 20.548 42.862 15.562 0.75 22.57 H new ATOM 0 HA BCYS B 92 20.557 42.869 15.316 0.25 22.57 H new ATOM 0 HB2ACYS B 92 20.666 42.107 17.829 0.75 23.02 H new ATOM 0 HB2BCYS B 92 20.181 43.637 17.403 0.25 23.02 H new ATOM 0 HB3ACYS B 92 22.012 42.886 17.955 0.75 23.02 H new ATOM 0 HB3BCYS B 92 20.078 42.082 17.464 0.25 23.02 H new ATOM 0 HG ACYS B 92 20.384 44.625 19.039 0.75 26.67 H new ATOM 1413 N ALA B 93 22.011 44.777 14.895 1.00 22.83 N ANISOU 1413 N ALA B 93 2390 2559 3725 358 -83 681 N ATOM 1414 CA ALA B 93 22.918 45.834 14.455 1.00 24.70 C ANISOU 1414 CA ALA B 93 2529 2709 4148 326 -18 805 C ATOM 1415 C ALA B 93 22.301 47.209 14.683 1.00 24.88 C ANISOU 1415 C ALA B 93 2668 2691 4094 268 -81 745 C ATOM 1416 O ALA B 93 21.086 47.356 14.651 1.00 23.11 O ANISOU 1416 O ALA B 93 2601 2520 3658 317 -88 624 O ATOM 1417 CB ALA B 93 23.271 45.647 12.986 1.00 24.87 C ANISOU 1417 CB ALA B 93 2532 2724 4195 466 235 896 C ATOM 0 H AALA B 93 21.181 44.934 14.736 0.75 22.83 H new ATOM 0 H BALA B 93 21.219 44.851 14.567 0.25 22.83 H new ATOM 0 HA ALA B 93 23.731 45.777 14.981 1.00 24.70 H new ATOM 0 HB1 ALA B 93 23.873 46.354 12.705 1.00 24.87 H new ATOM 0 HB2 ALA B 93 23.703 44.787 12.864 1.00 24.87 H new ATOM 0 HB3 ALA B 93 22.462 45.681 12.452 1.00 24.87 H new ATOM 1424 N ALA B 94 23.155 48.208 14.896 1.00 25.64 N ANISOU 1424 N ALA B 94 2679 2686 4376 166 -126 838 N ATOM 1425 CA ALA B 94 22.715 49.570 15.190 1.00 24.96 C ANISOU 1425 CA ALA B 94 2716 2531 4235 100 -194 792 C ATOM 1426 C ALA B 94 23.524 50.571 14.391 1.00 24.29 C ANISOU 1426 C ALA B 94 2558 2345 4325 80 -71 926 C ATOM 1427 O ALA B 94 24.620 50.283 13.904 1.00 27.31 O ANISOU 1427 O ALA B 94 2754 2696 4925 77 28 1071 O ATOM 1428 CB ALA B 94 22.855 49.846 16.681 1.00 27.70 C ANISOU 1428 CB ALA B 94 3093 2822 4610 -55 -450 744 C ATOM 0 H ALA B 94 24.010 48.114 14.874 1.00 25.64 H new ATOM 0 HA ALA B 94 21.783 49.661 14.938 1.00 24.96 H new ATOM 0 HB1 ALA B 94 22.562 50.751 16.872 1.00 27.70 H new ATOM 0 HB2 ALA B 94 22.309 49.218 17.179 1.00 27.70 H new ATOM 0 HB3 ALA B 94 23.783 49.745 16.943 1.00 27.70 H new ATOM 1434 N ASP B 95 22.990 51.777 14.271 1.00 24.54 N ANISOU 1434 N ASP B 95 2736 2317 4270 69 -66 886 N ATOM 1435 CA ASP B 95 23.646 52.808 13.509 1.00 25.84 C ANISOU 1435 CA ASP B 95 2864 2372 4580 49 61 1008 C ATOM 1436 C ASP B 95 23.194 54.171 14.002 1.00 26.09 C ANISOU 1436 C ASP B 95 3065 2305 4544 -31 -42 949 C ATOM 1437 O ASP B 95 22.110 54.299 14.573 1.00 29.28 O ANISOU 1437 O ASP B 95 3645 2749 4732 0 -135 808 O ATOM 1438 CB ASP B 95 23.339 52.628 12.032 1.00 25.48 C ANISOU 1438 CB ASP B 95 2870 2371 4439 232 325 1044 C ATOM 1439 CG ASP B 95 24.317 53.332 11.157 1.00 27.99 C ANISOU 1439 CG ASP B 95 3100 2580 4956 224 508 1214 C ATOM 1440 OD1 ASP B 95 25.472 52.868 11.068 1.00 31.19 O ANISOU 1440 OD1 ASP B 95 3286 2957 5607 181 567 1353 O ATOM 1441 OD2 ASP B 95 23.943 54.359 10.554 1.00 29.54 O ANISOU 1441 OD2 ASP B 95 3440 2712 5074 266 603 1218 O ATOM 0 H ASP B 95 22.244 52.014 14.628 1.00 24.54 H new ATOM 0 HA ASP B 95 24.607 52.744 13.628 1.00 25.84 H new ATOM 0 HB2 ASP B 95 23.340 51.682 11.817 1.00 25.48 H new ATOM 0 HB3 ASP B 95 22.447 52.960 11.847 1.00 25.48 H new ATOM 1446 N ARG B 96 24.021 55.178 13.770 1.00 27.87 N ANISOU 1446 N ARG B 96 3237 2393 4958 -129 -12 1065 N ATOM 1447 CA ARG B 96 23.727 56.545 14.210 1.00 28.56 C ANISOU 1447 CA ARG B 96 3501 2352 4999 -216 -106 1023 C ATOM 1448 C ARG B 96 23.523 57.534 13.066 1.00 29.65 C ANISOU 1448 C ARG B 96 3745 2422 5097 -126 104 1078 C ATOM 1449 O ARG B 96 23.503 58.741 13.296 1.00 32.19 O ANISOU 1449 O ARG B 96 4197 2608 5427 -207 54 1078 O ATOM 1450 CB ARG B 96 24.855 57.041 15.116 1.00 36.45 C ANISOU 1450 CB ARG B 96 4387 3209 6253 -449 -310 1102 C ATOM 1451 CG ARG B 96 24.933 56.286 16.433 1.00 39.15 C ANISOU 1451 CG ARG B 96 4701 3588 6586 -543 -569 1027 C ATOM 1452 CD ARG B 96 26.083 56.755 17.303 1.00 46.63 C ANISOU 1452 CD ARG B 96 5539 4388 7791 -779 -808 1110 C ATOM 1453 NE ARG B 96 25.978 56.226 18.660 1.00 51.08 N ANISOU 1453 NE ARG B 96 6170 4961 8279 -861 -1084 1014 N ATOM 1454 CZ ARG B 96 26.976 56.205 19.540 1.00 54.46 C ANISOU 1454 CZ ARG B 96 6481 5296 8915 -1050 -1343 1077 C ATOM 1455 NH1 ARG B 96 28.171 56.681 19.212 1.00 52.03 N ANISOU 1455 NH1 ARG B 96 5947 4884 8938 -1190 -1364 1245 N ATOM 1456 NH2 ARG B 96 26.780 55.701 20.750 1.00 54.27 N ANISOU 1456 NH2 ARG B 96 6567 5278 8775 -1100 -1586 980 N ATOM 0 H ARG B 96 24.769 55.095 13.354 1.00 27.87 H new ATOM 0 HA ARG B 96 22.885 56.503 14.689 1.00 28.56 H new ATOM 0 HB2 ARG B 96 25.701 56.954 14.649 1.00 36.45 H new ATOM 0 HB3 ARG B 96 24.726 57.985 15.297 1.00 36.45 H new ATOM 0 HG2 ARG B 96 24.099 56.397 16.916 1.00 39.15 H new ATOM 0 HG3 ARG B 96 25.033 55.338 16.254 1.00 39.15 H new ATOM 0 HD2 ARG B 96 26.924 56.474 16.909 1.00 46.63 H new ATOM 0 HD3 ARG B 96 26.094 57.724 17.332 1.00 46.63 H new ATOM 0 HE ARG B 96 25.219 55.906 18.907 1.00 51.08 H new ATOM 0 HH11 ARG B 96 28.304 57.006 18.427 1.00 52.03 H new ATOM 0 HH12 ARG B 96 28.812 56.665 19.785 1.00 52.03 H new ATOM 0 HH21 ARG B 96 26.009 55.388 20.966 1.00 54.27 H new ATOM 0 HH22 ARG B 96 27.424 55.687 21.319 1.00 54.27 H new ATOM 1470 N ARG B 97 23.335 57.041 11.847 1.00 28.65 N ANISOU 1470 N ARG B 97 3600 2376 4908 45 334 1120 N ATOM 1471 CA ARG B 97 23.049 57.918 10.713 1.00 29.22 C ANISOU 1471 CA ARG B 97 3812 2387 4903 157 537 1168 C ATOM 1472 C ARG B 97 21.566 58.063 10.468 1.00 27.71 C ANISOU 1472 C ARG B 97 3852 2277 4397 323 543 1025 C ATOM 1473 O ARG B 97 20.822 57.085 10.526 1.00 28.69 O ANISOU 1473 O ARG B 97 3984 2547 4369 420 509 928 O ATOM 1474 CB ARG B 97 23.738 57.392 9.455 1.00 33.16 C ANISOU 1474 CB ARG B 97 4195 2900 5503 260 795 1311 C ATOM 1475 CG ARG B 97 25.248 57.460 9.563 1.00 36.68 C ANISOU 1475 CG ARG B 97 4387 3245 6303 106 832 1489 C ATOM 1476 CD ARG B 97 25.946 56.719 8.442 1.00 39.38 C ANISOU 1476 CD ARG B 97 4600 3613 6749 228 1105 1633 C ATOM 1477 NE ARG B 97 25.837 55.275 8.608 1.00 37.81 N ANISOU 1477 NE ARG B 97 4314 3556 6494 304 1072 1580 N ATOM 1478 CZ ARG B 97 26.425 54.390 7.814 1.00 38.38 C ANISOU 1478 CZ ARG B 97 4282 3660 6641 419 1284 1687 C ATOM 1479 NH1 ARG B 97 27.150 54.794 6.784 1.00 44.57 N ANISOU 1479 NH1 ARG B 97 5031 4348 7556 479 1560 1857 N ATOM 1480 NH2 ARG B 97 26.274 53.101 8.041 1.00 35.42 N ANISOU 1480 NH2 ARG B 97 3856 3401 6201 482 1235 1627 N ATOM 0 H ARG B 97 23.368 56.204 11.654 1.00 28.65 H new ATOM 0 HA ARG B 97 23.397 58.797 10.931 1.00 29.22 H new ATOM 0 HB2 ARG B 97 23.467 56.474 9.299 1.00 33.16 H new ATOM 0 HB3 ARG B 97 23.446 57.908 8.688 1.00 33.16 H new ATOM 0 HG2 ARG B 97 25.528 58.389 9.556 1.00 36.68 H new ATOM 0 HG3 ARG B 97 25.525 57.087 10.414 1.00 36.68 H new ATOM 0 HD2 ARG B 97 25.559 56.978 7.591 1.00 39.38 H new ATOM 0 HD3 ARG B 97 26.882 56.973 8.418 1.00 39.38 H new ATOM 0 HE ARG B 97 25.362 54.979 9.261 1.00 37.81 H new ATOM 0 HH11 ARG B 97 27.242 55.634 6.626 1.00 44.57 H new ATOM 0 HH12 ARG B 97 27.529 54.216 6.272 1.00 44.57 H new ATOM 0 HH21 ARG B 97 25.795 52.834 8.703 1.00 35.42 H new ATOM 0 HH22 ARG B 97 26.655 52.526 7.527 1.00 35.42 H new ATOM 1494 N GLN B 98 21.132 59.285 10.186 1.00 28.33 N ANISOU 1494 N GLN B 98 4115 2258 4391 356 586 1019 N ATOM 1495 CA GLN B 98 19.727 59.545 9.903 1.00 27.25 C ANISOU 1495 CA GLN B 98 4185 2190 3979 527 595 903 C ATOM 1496 C GLN B 98 19.333 58.934 8.573 1.00 28.17 C ANISOU 1496 C GLN B 98 4331 2402 3969 723 767 925 C ATOM 1497 O GLN B 98 20.115 58.955 7.619 1.00 30.03 O ANISOU 1497 O GLN B 98 4530 2580 4302 753 949 1053 O ATOM 1498 CB GLN B 98 19.441 61.043 9.874 1.00 32.70 C ANISOU 1498 CB GLN B 98 5072 2734 4617 528 610 908 C ATOM 1499 CG GLN B 98 19.769 61.741 11.181 1.00 33.57 C ANISOU 1499 CG GLN B 98 5216 2720 4818 337 427 875 C ATOM 1500 CD GLN B 98 19.233 63.159 11.225 1.00 37.10 C ANISOU 1500 CD GLN B 98 5910 3027 5159 368 434 850 C ATOM 1501 OE1 GLN B 98 18.066 63.381 11.554 1.00 41.84 O ANISOU 1501 OE1 GLN B 98 6670 3676 5553 487 389 736 O ATOM 1502 NE2 GLN B 98 20.085 64.124 10.898 1.00 37.80 N ANISOU 1502 NE2 GLN B 98 6028 2935 5400 264 501 965 N ATOM 0 H GLN B 98 21.637 59.980 10.153 1.00 28.33 H new ATOM 0 HA GLN B 98 19.204 59.140 10.613 1.00 27.25 H new ATOM 0 HB2 GLN B 98 19.955 61.450 9.159 1.00 32.70 H new ATOM 0 HB3 GLN B 98 18.504 61.183 9.666 1.00 32.70 H new ATOM 0 HG2 GLN B 98 19.397 61.233 11.919 1.00 33.57 H new ATOM 0 HG3 GLN B 98 20.731 61.757 11.305 1.00 33.57 H new ATOM 0 HE21 GLN B 98 20.892 63.928 10.674 1.00 37.80 H new ATOM 0 HE22 GLN B 98 19.830 64.945 10.910 1.00 37.80 H new ATOM 1511 N ARG B 99 18.103 58.433 8.515 1.00 28.44 N ANISOU 1511 N ARG B 99 4447 2571 3788 857 710 805 N ATOM 1512 CA ARG B 99 17.548 57.860 7.305 1.00 32.33 C ANISOU 1512 CA ARG B 99 5008 3150 4125 1043 821 802 C ATOM 1513 C ARG B 99 16.032 57.893 7.362 1.00 33.31 C ANISOU 1513 C ARG B 99 5250 3377 4028 1170 721 675 C ATOM 1514 O ARG B 99 15.450 58.035 8.441 1.00 32.39 O ANISOU 1514 O ARG B 99 5123 3292 3890 1115 583 584 O ATOM 1515 CB ARG B 99 18.020 56.414 7.144 1.00 28.25 C ANISOU 1515 CB ARG B 99 4346 2726 3661 1036 844 815 C ATOM 1516 CG ARG B 99 17.307 55.455 8.110 1.00 28.30 C ANISOU 1516 CG ARG B 99 4278 2868 3606 998 665 685 C ATOM 1517 CD ARG B 99 18.156 54.250 8.441 1.00 34.81 C ANISOU 1517 CD ARG B 99 4928 3733 4565 916 657 716 C ATOM 1518 NE ARG B 99 19.387 54.669 9.085 1.00 34.33 N ANISOU 1518 NE ARG B 99 4736 3566 4743 753 646 811 N ATOM 1519 CZ ARG B 99 20.504 53.955 9.143 1.00 27.38 C ANISOU 1519 CZ ARG B 99 3682 2673 4050 686 690 903 C ATOM 1520 NH1 ARG B 99 20.584 52.738 8.602 1.00 32.36 N ANISOU 1520 NH1 ARG B 99 4270 3383 4644 774 767 910 N ATOM 1521 NH2 ARG B 99 21.560 54.453 9.753 1.00 30.84 N ANISOU 1521 NH2 ARG B 99 3989 3009 4720 529 648 993 N ATOM 0 H ARG B 99 17.566 58.418 9.186 1.00 28.44 H new ATOM 0 HA ARG B 99 17.852 58.382 6.546 1.00 32.33 H new ATOM 0 HB2 ARG B 99 17.864 56.125 6.231 1.00 28.25 H new ATOM 0 HB3 ARG B 99 18.977 56.370 7.296 1.00 28.25 H new ATOM 0 HG2 ARG B 99 17.084 55.927 8.928 1.00 28.30 H new ATOM 0 HG3 ARG B 99 16.471 55.162 7.715 1.00 28.30 H new ATOM 0 HD2 ARG B 99 17.665 53.650 9.024 1.00 34.81 H new ATOM 0 HD3 ARG B 99 18.358 53.756 7.631 1.00 34.81 H new ATOM 0 HE ARG B 99 19.393 55.443 9.460 1.00 34.33 H new ATOM 0 HH11 ARG B 99 19.901 52.399 8.204 1.00 32.36 H new ATOM 0 HH12 ARG B 99 21.318 52.293 8.651 1.00 32.36 H new ATOM 0 HH21 ARG B 99 21.522 55.235 10.109 1.00 30.84 H new ATOM 0 HH22 ARG B 99 22.288 53.996 9.795 1.00 30.84 H new ATOM 1535 N ATRP B 100 15.385 57.767 6.209 0.53 32.55 N ANISOU 1535 N ATRP B 100 5271 3327 3770 1346 790 673 N ATOM 1536 N BTRP B 100 15.384 57.771 6.207 0.47 32.56 N ANISOU 1536 N BTRP B 100 5273 3328 3772 1347 790 674 N ATOM 1537 CA ATRP B 100 13.984 57.365 6.187 0.53 27.79 C ANISOU 1537 CA ATRP B 100 4712 2858 2990 1461 674 560 C ATOM 1538 CA BTRP B 100 13.978 57.379 6.163 0.47 27.71 C ANISOU 1538 CA BTRP B 100 4705 2847 2978 1465 676 561 C ATOM 1539 C ATRP B 100 13.733 56.440 5.005 0.53 28.18 C ANISOU 1539 C ATRP B 100 4811 2979 2918 1589 715 563 C ATOM 1540 C BTRP B 100 13.783 56.378 5.036 0.47 27.70 C ANISOU 1540 C BTRP B 100 4740 2919 2865 1581 715 564 C ATOM 1541 O ATRP B 100 14.476 56.444 4.026 0.53 29.81 O ANISOU 1541 O ATRP B 100 5092 3109 3126 1641 867 658 O ATOM 1542 O BTRP B 100 14.593 56.291 4.111 0.47 29.03 O ANISOU 1542 O BTRP B 100 4967 3014 3047 1622 866 658 O ATOM 1543 CB ATRP B 100 13.037 58.573 6.158 0.53 27.92 C ANISOU 1543 CB ATRP B 100 4871 2840 2896 1565 645 533 C ATOM 1544 CB BTRP B 100 13.037 58.589 5.989 0.47 27.37 C ANISOU 1544 CB BTRP B 100 4817 2767 2815 1582 658 541 C ATOM 1545 CG ATRP B 100 13.119 59.498 4.962 0.53 29.02 C ANISOU 1545 CG ATRP B 100 5194 2876 2955 1696 773 618 C ATOM 1546 CG BTRP B 100 12.680 58.985 4.543 0.47 32.86 C ANISOU 1546 CG BTRP B 100 5677 3447 3361 1751 742 584 C ATOM 1547 CD1ATRP B 100 13.792 60.683 4.888 0.53 30.36 C ANISOU 1547 CD1ATRP B 100 5449 2892 3195 1651 877 698 C ATOM 1548 CD1BTRP B 100 11.927 58.277 3.658 0.47 30.82 C ANISOU 1548 CD1BTRP B 100 5450 3310 2950 1850 693 536 C ATOM 1549 CD2ATRP B 100 12.478 59.323 3.691 0.53 25.92 C ANISOU 1549 CD2ATRP B 100 4893 2570 2387 1821 788 600 C ATOM 1550 CD2BTRP B 100 13.044 60.191 3.871 0.47 30.51 C ANISOU 1550 CD2BTRP B 100 5514 3034 3044 1775 864 657 C ATOM 1551 NE1ATRP B 100 13.616 61.252 3.651 0.53 35.75 N ANISOU 1551 NE1ATRP B 100 6262 3567 3753 1750 973 729 N ATOM 1552 NE1BTRP B 100 11.813 58.950 2.477 0.47 34.55 N ANISOU 1552 NE1BTRP B 100 6080 3749 3300 1942 773 573 N ATOM 1553 CE2ATRP B 100 12.813 60.437 2.897 0.53 35.14 C ANISOU 1553 CE2ATRP B 100 6202 3633 3517 1859 916 670 C ATOM 1554 CE2BTRP B 100 12.488 60.134 2.578 0.47 35.16 C ANISOU 1554 CE2BTRP B 100 6217 3688 3455 1902 890 647 C ATOM 1555 CE3ATRP B 100 11.651 58.337 3.152 0.53 29.02 C ANISOU 1555 CE3ATRP B 100 5275 3101 2649 1900 694 531 C ATOM 1556 CE3BTRP B 100 13.784 61.312 4.235 0.47 34.61 C ANISOU 1556 CE3BTRP B 100 6080 3392 3679 1695 947 728 C ATOM 1557 CZ2ATRP B 100 12.349 60.589 1.590 0.53 44.01 C ANISOU 1557 CZ2ATRP B 100 7467 4790 4464 1986 955 669 C ATOM 1558 CZ2BTRP B 100 12.649 61.158 1.649 0.47 42.99 C ANISOU 1558 CZ2BTRP B 100 7366 4596 4373 1965 1009 703 C ATOM 1559 CZ3ATRP B 100 11.194 58.490 1.853 0.53 36.48 C ANISOU 1559 CZ3ATRP B 100 6366 4070 3425 2018 715 533 C ATOM 1560 CZ3BTRP B 100 13.946 62.322 3.313 0.47 38.12 C ANISOU 1560 CZ3BTRP B 100 6665 3757 4064 1747 1068 786 C ATOM 1561 CH2ATRP B 100 11.547 59.603 1.089 0.53 35.72 C ANISOU 1561 CH2ATRP B 100 6419 3871 3282 2066 847 599 C ATOM 1562 CH2BTRP B 100 13.382 62.239 2.034 0.47 39.51 C ANISOU 1562 CH2BTRP B 100 6951 4007 4053 1888 1105 772 C ATOM 0 H ATRP B 100 15.734 57.908 5.436 0.53 32.56 H new ATOM 0 H BTRP B 100 15.740 57.911 5.437 0.47 32.56 H new ATOM 0 HA ATRP B 100 13.795 56.886 7.009 0.53 27.71 H new ATOM 0 HA BTRP B 100 13.746 56.973 7.013 0.47 27.71 H new ATOM 0 HB2ATRP B 100 12.127 58.242 6.218 0.53 27.37 H new ATOM 0 HB2BTRP B 100 12.212 58.402 6.464 0.47 27.37 H new ATOM 0 HB3ATRP B 100 13.200 59.100 6.956 0.53 27.37 H new ATOM 0 HB3BTRP B 100 13.446 59.355 6.421 0.47 27.37 H new ATOM 0 HD1ATRP B 100 14.297 61.052 5.576 0.53 30.82 H new ATOM 0 HD1BTRP B 100 11.543 57.448 3.834 0.47 30.82 H new ATOM 0 HE1ATRP B 100 13.955 61.999 3.392 0.53 34.55 H new ATOM 0 HE1BTRP B 100 11.386 58.675 1.783 0.47 34.55 H new ATOM 0 HE3ATRP B 100 11.411 57.592 3.655 0.53 34.61 H new ATOM 0 HE3BTRP B 100 14.161 61.378 5.083 0.47 34.61 H new ATOM 0 HZ2ATRP B 100 12.577 61.332 1.080 0.53 42.99 H new ATOM 0 HZ2BTRP B 100 12.272 61.106 0.801 0.47 42.99 H new ATOM 0 HZ3ATRP B 100 10.642 57.839 1.484 0.53 38.12 H new ATOM 0 HZ3BTRP B 100 14.440 63.075 3.545 0.47 38.12 H new ATOM 0 HH2ATRP B 100 11.229 59.675 0.218 0.53 39.51 H new ATOM 0 HH2BTRP B 100 13.511 62.938 1.434 0.47 39.51 H new ATOM 1583 N GLY B 101 12.701 55.614 5.133 1.00 28.74 N ANISOU 1583 N GLY B 101 4848 3186 2887 1633 581 463 N ATOM 1584 CA GLY B 101 12.337 54.644 4.110 1.00 28.72 C ANISOU 1584 CA GLY B 101 4910 3249 2755 1738 571 445 C ATOM 1585 C GLY B 101 12.842 53.253 4.437 1.00 32.71 C ANISOU 1585 C GLY B 101 5292 3810 3327 1645 556 422 C ATOM 1586 O GLY B 101 13.886 53.116 5.062 1.00 29.03 O ANISOU 1586 O GLY B 101 4712 3298 3022 1524 618 470 O ATOM 0 H AGLY B 101 12.188 55.601 5.823 0.53 28.74 H new ATOM 0 H BGLY B 101 12.156 55.644 5.797 0.47 28.74 H new ATOM 0 HA2 GLY B 101 11.372 54.622 4.016 1.00 28.72 H new ATOM 0 HA3 GLY B 101 12.699 54.926 3.255 1.00 28.72 H new ATOM 1590 N PRO B 102 12.123 52.203 3.986 1.00 29.38 N ANISOU 1590 N PRO B 102 4898 3479 2786 1700 463 354 N ATOM 1591 CA PRO B 102 12.513 50.830 4.354 1.00 29.67 C ANISOU 1591 CA PRO B 102 4833 3566 2877 1613 441 324 C ATOM 1592 C PRO B 102 13.886 50.431 3.841 1.00 30.33 C ANISOU 1592 C PRO B 102 4938 3557 3030 1612 622 424 C ATOM 1593 O PRO B 102 14.574 49.673 4.532 1.00 30.19 O ANISOU 1593 O PRO B 102 4782 3551 3139 1508 633 432 O ATOM 1594 CB PRO B 102 11.431 49.960 3.702 1.00 33.99 C ANISOU 1594 CB PRO B 102 5461 4195 3258 1691 310 242 C ATOM 1595 CG PRO B 102 10.812 50.837 2.636 1.00 37.84 C ANISOU 1595 CG PRO B 102 6131 4650 3597 1845 303 261 C ATOM 1596 CD PRO B 102 10.896 52.233 3.171 1.00 37.81 C ANISOU 1596 CD PRO B 102 6090 4602 3673 1836 353 302 C ATOM 0 HA PRO B 102 12.576 50.733 5.317 1.00 29.67 H new ATOM 0 HB2 PRO B 102 11.812 49.155 3.317 1.00 33.99 H new ATOM 0 HB3 PRO B 102 10.769 49.677 4.352 1.00 33.99 H new ATOM 0 HG2 PRO B 102 11.289 50.755 1.796 1.00 37.84 H new ATOM 0 HG3 PRO B 102 9.892 50.583 2.465 1.00 37.84 H new ATOM 0 HD2 PRO B 102 10.955 52.888 2.458 1.00 37.81 H new ATOM 0 HD3 PRO B 102 10.117 52.461 3.703 1.00 37.81 H new ATOM 1604 N TYR B 103 14.288 50.909 2.662 1.00 29.62 N ANISOU 1604 N TYR B 103 5018 3372 2864 1734 772 507 N ATOM 1605 CA TYR B 103 15.552 50.460 2.083 1.00 27.07 C ANISOU 1605 CA TYR B 103 4720 2958 2606 1758 979 616 C ATOM 1606 C TYR B 103 16.718 50.714 3.032 1.00 31.10 C ANISOU 1606 C TYR B 103 5013 3427 3378 1613 1056 698 C ATOM 1607 O TYR B 103 17.520 49.812 3.313 1.00 29.28 O ANISOU 1607 O TYR B 103 4667 3196 3263 1561 1110 735 O ATOM 1608 CB TYR B 103 15.839 51.142 0.742 1.00 34.51 C ANISOU 1608 CB TYR B 103 5865 3819 3431 1863 1147 699 C ATOM 1609 CG TYR B 103 17.174 50.722 0.197 1.00 32.84 C ANISOU 1609 CG TYR B 103 5648 3526 3303 1868 1388 822 C ATOM 1610 CD1 TYR B 103 17.299 49.535 -0.510 1.00 35.17 C ANISOU 1610 CD1 TYR B 103 6058 3831 3474 1927 1434 818 C ATOM 1611 CD2 TYR B 103 18.313 51.468 0.432 1.00 37.78 C ANISOU 1611 CD2 TYR B 103 6148 4059 4147 1811 1565 951 C ATOM 1612 CE1 TYR B 103 18.514 49.126 -0.995 1.00 40.79 C ANISOU 1612 CE1 TYR B 103 6763 4471 4264 1942 1669 944 C ATOM 1613 CE2 TYR B 103 19.533 51.064 -0.043 1.00 40.35 C ANISOU 1613 CE2 TYR B 103 6433 4319 4579 1823 1800 1076 C ATOM 1614 CZ TYR B 103 19.631 49.889 -0.755 1.00 45.49 C ANISOU 1614 CZ TYR B 103 7201 4992 5091 1894 1862 1072 C ATOM 1615 OH TYR B 103 20.853 49.487 -1.233 1.00 53.37 O ANISOU 1615 OH TYR B 103 8162 5922 6193 1917 2115 1213 O ATOM 0 H TYR B 103 13.853 51.482 2.191 1.00 29.62 H new ATOM 0 HA TYR B 103 15.462 49.506 1.934 1.00 27.07 H new ATOM 0 HB2 TYR B 103 15.142 50.918 0.106 1.00 34.51 H new ATOM 0 HB3 TYR B 103 15.821 52.105 0.855 1.00 34.51 H new ATOM 0 HD1 TYR B 103 16.547 49.009 -0.657 1.00 35.17 H new ATOM 0 HD2 TYR B 103 18.251 52.257 0.920 1.00 37.78 H new ATOM 0 HE1 TYR B 103 18.582 48.337 -1.483 1.00 40.79 H new ATOM 0 HE2 TYR B 103 20.290 51.580 0.114 1.00 40.35 H new ATOM 0 HH TYR B 103 20.812 48.681 -1.465 1.00 53.37 H new ATOM 1625 N TYR B 104 16.823 51.934 3.533 1.00 29.49 N ANISOU 1625 N TYR B 104 4758 3177 3271 1548 1047 729 N ATOM 1626 CA TYR B 104 17.953 52.274 4.389 1.00 28.52 C ANISOU 1626 CA TYR B 104 4443 2994 3401 1397 1092 813 C ATOM 1627 C TYR B 104 17.794 51.728 5.805 1.00 25.31 C ANISOU 1627 C TYR B 104 3862 2670 3084 1249 901 727 C ATOM 1628 O TYR B 104 18.792 51.533 6.492 1.00 27.37 O ANISOU 1628 O TYR B 104 3955 2898 3546 1129 908 790 O ATOM 1629 CB TYR B 104 18.162 53.795 4.412 1.00 26.43 C ANISOU 1629 CB TYR B 104 4216 2623 3203 1367 1142 878 C ATOM 1630 CG TYR B 104 18.751 54.323 3.118 1.00 29.46 C ANISOU 1630 CG TYR B 104 4737 2890 3568 1484 1383 1010 C ATOM 1631 CD1 TYR B 104 19.990 53.899 2.671 1.00 32.31 C ANISOU 1631 CD1 TYR B 104 5016 3178 4081 1483 1587 1148 C ATOM 1632 CD2 TYR B 104 18.069 55.260 2.355 1.00 31.19 C ANISOU 1632 CD2 TYR B 104 5170 3063 3620 1605 1418 1006 C ATOM 1633 CE1 TYR B 104 20.532 54.368 1.482 1.00 34.96 C ANISOU 1633 CE1 TYR B 104 5474 3420 4390 1580 1831 1260 C ATOM 1634 CE2 TYR B 104 18.601 55.731 1.165 1.00 30.81 C ANISOU 1634 CE2 TYR B 104 5238 2942 3526 1675 1631 1095 C ATOM 1635 CZ TYR B 104 19.836 55.286 0.740 1.00 34.56 C ANISOU 1635 CZ TYR B 104 5628 3358 4147 1662 1844 1218 C ATOM 1636 OH TYR B 104 20.372 55.762 -0.435 1.00 39.18 O ANISOU 1636 OH TYR B 104 6326 3872 4689 1743 2078 1298 O ATOM 0 H TYR B 104 16.263 52.572 3.395 1.00 29.49 H new ATOM 0 HA TYR B 104 18.740 51.851 4.012 1.00 28.52 H new ATOM 0 HB2 TYR B 104 17.312 54.232 4.579 1.00 26.43 H new ATOM 0 HB3 TYR B 104 18.749 54.026 5.149 1.00 26.43 H new ATOM 0 HD1 TYR B 104 20.471 53.286 3.179 1.00 32.31 H new ATOM 0 HD2 TYR B 104 17.244 55.576 2.646 1.00 31.19 H new ATOM 0 HE1 TYR B 104 21.361 54.062 1.191 1.00 34.96 H new ATOM 0 HE2 TYR B 104 18.126 56.346 0.654 1.00 30.81 H new ATOM 0 HH TYR B 104 21.141 55.442 -0.542 1.00 39.18 H new ATOM 1646 N TYR B 105 16.567 51.440 6.236 1.00 25.06 N ANISOU 1646 N TYR B 105 3867 2743 2912 1260 734 592 N ATOM 1647 CA TYR B 105 16.385 50.784 7.524 1.00 22.92 C ANISOU 1647 CA TYR B 105 3460 2547 2702 1137 579 514 C ATOM 1648 C TYR B 105 16.709 49.289 7.472 1.00 25.91 C ANISOU 1648 C TYR B 105 3776 2979 3092 1133 585 505 C ATOM 1649 O TYR B 105 17.125 48.708 8.480 1.00 23.38 O ANISOU 1649 O TYR B 105 3322 2680 2883 1021 509 494 O ATOM 1650 CB TYR B 105 14.954 50.988 8.037 1.00 21.53 C ANISOU 1650 CB TYR B 105 3331 2458 2392 1152 428 389 C ATOM 1651 CG TYR B 105 14.784 52.250 8.845 1.00 21.77 C ANISOU 1651 CG TYR B 105 3370 2437 2465 1094 378 381 C ATOM 1652 CD1 TYR B 105 15.278 52.329 10.139 1.00 23.30 C ANISOU 1652 CD1 TYR B 105 3471 2601 2782 947 297 373 C ATOM 1653 CD2 TYR B 105 14.143 53.354 8.321 1.00 25.09 C ANISOU 1653 CD2 TYR B 105 3918 2824 2791 1192 404 381 C ATOM 1654 CE1 TYR B 105 15.134 53.469 10.888 1.00 23.80 C ANISOU 1654 CE1 TYR B 105 3585 2595 2863 895 246 359 C ATOM 1655 CE2 TYR B 105 14.009 54.484 9.055 1.00 25.06 C ANISOU 1655 CE2 TYR B 105 3949 2756 2816 1147 369 373 C ATOM 1656 CZ TYR B 105 14.492 54.532 10.346 1.00 24.51 C ANISOU 1656 CZ TYR B 105 3804 2650 2858 997 289 358 C ATOM 1657 OH TYR B 105 14.345 55.677 11.084 1.00 31.07 O ANISOU 1657 OH TYR B 105 4714 3395 3696 955 249 344 O ATOM 0 H TYR B 105 15.842 51.613 5.807 1.00 25.06 H new ATOM 0 HA TYR B 105 17.012 51.198 8.138 1.00 22.92 H new ATOM 0 HB2 TYR B 105 14.346 51.011 7.281 1.00 21.53 H new ATOM 0 HB3 TYR B 105 14.701 50.226 8.581 1.00 21.53 H new ATOM 0 HD1 TYR B 105 15.715 51.595 10.506 1.00 23.30 H new ATOM 0 HD2 TYR B 105 13.800 53.322 7.457 1.00 25.09 H new ATOM 0 HE1 TYR B 105 15.471 53.512 11.754 1.00 23.80 H new ATOM 0 HE2 TYR B 105 13.591 55.229 8.688 1.00 25.06 H new ATOM 0 HH TYR B 105 13.933 56.252 10.631 1.00 31.07 H new ATOM 1667 N LEU B 106 16.551 48.661 6.308 1.00 22.03 N ANISOU 1667 N LEU B 106 3404 2493 2475 1260 673 512 N ATOM 1668 CA LEU B 106 16.717 47.211 6.221 1.00 23.58 C ANISOU 1668 CA LEU B 106 3583 2728 2649 1270 673 489 C ATOM 1669 C LEU B 106 17.981 46.735 5.506 1.00 26.73 C ANISOU 1669 C LEU B 106 3979 3043 3133 1330 876 615 C ATOM 1670 O LEU B 106 18.207 45.533 5.378 1.00 27.18 O ANISOU 1670 O LEU B 106 4043 3114 3170 1356 901 606 O ATOM 1671 CB LEU B 106 15.495 46.618 5.534 1.00 25.89 C ANISOU 1671 CB LEU B 106 4031 3086 2721 1361 590 386 C ATOM 1672 CG LEU B 106 14.258 46.614 6.426 1.00 29.28 C ANISOU 1672 CG LEU B 106 4402 3619 3105 1289 390 266 C ATOM 1673 CD1 LEU B 106 13.053 46.240 5.587 1.00 28.99 C ANISOU 1673 CD1 LEU B 106 4504 3635 2876 1380 300 187 C ATOM 1674 CD2 LEU B 106 14.404 45.685 7.642 1.00 26.06 C ANISOU 1674 CD2 LEU B 106 3849 3261 2792 1161 306 224 C ATOM 0 H LEU B 106 16.351 49.049 5.567 1.00 22.03 H new ATOM 0 HA LEU B 106 16.812 46.902 7.135 1.00 23.58 H new ATOM 0 HB2 LEU B 106 15.306 47.123 4.728 1.00 25.89 H new ATOM 0 HB3 LEU B 106 15.693 45.709 5.259 1.00 25.89 H new ATOM 0 HG LEU B 106 14.142 47.505 6.791 1.00 29.28 H new ATOM 0 HD11 LEU B 106 12.259 46.234 6.145 1.00 28.99 H new ATOM 0 HD12 LEU B 106 12.942 46.888 4.874 1.00 28.99 H new ATOM 0 HD13 LEU B 106 13.186 45.358 5.205 1.00 28.99 H new ATOM 0 HD21 LEU B 106 13.594 45.719 8.174 1.00 26.06 H new ATOM 0 HD22 LEU B 106 14.553 44.776 7.339 1.00 26.06 H new ATOM 0 HD23 LEU B 106 15.157 45.973 8.181 1.00 26.06 H new ATOM 1686 N SER B 107 18.809 47.668 5.041 1.00 24.49 N ANISOU 1686 N SER B 107 3688 2664 2952 1356 1036 738 N ATOM 1687 CA SER B 107 20.037 47.346 4.338 1.00 24.90 C ANISOU 1687 CA SER B 107 3720 2627 3113 1425 1269 883 C ATOM 1688 C SER B 107 21.180 47.161 5.322 1.00 24.87 C ANISOU 1688 C SER B 107 3453 2607 3391 1294 1268 971 C ATOM 1689 O SER B 107 21.534 48.095 6.036 1.00 28.09 O ANISOU 1689 O SER B 107 3728 2985 3959 1172 1206 1010 O ATOM 1690 CB SER B 107 20.401 48.447 3.349 1.00 31.20 C ANISOU 1690 CB SER B 107 4627 3320 3906 1513 1463 993 C ATOM 1691 OG SER B 107 21.719 48.237 2.860 1.00 37.04 O ANISOU 1691 OG SER B 107 5293 3968 4814 1559 1711 1159 O ATOM 0 H SER B 107 18.668 48.512 5.128 1.00 24.49 H new ATOM 0 HA SER B 107 19.891 46.519 3.852 1.00 24.90 H new ATOM 0 HB2 SER B 107 19.770 48.453 2.612 1.00 31.20 H new ATOM 0 HB3 SER B 107 20.341 49.314 3.780 1.00 31.20 H new ATOM 0 HG SER B 107 21.916 48.845 2.314 1.00 37.04 H new ATOM 1697 N ALA B 108 21.771 45.966 5.338 1.00 28.98 N ANISOU 1697 N ALA B 108 3909 3134 3969 1324 1329 1007 N ATOM 1698 CA ALA B 108 22.857 45.671 6.250 1.00 27.31 C ANISOU 1698 CA ALA B 108 3440 2911 4027 1215 1310 1097 C ATOM 1699 C ALA B 108 24.070 46.565 6.017 1.00 28.99 C ANISOU 1699 C ALA B 108 3499 3021 4494 1189 1477 1282 C ATOM 1700 O ALA B 108 24.833 46.836 6.937 1.00 30.39 O ANISOU 1700 O ALA B 108 3445 3182 4919 1047 1387 1350 O ATOM 1701 CB ALA B 108 23.257 44.193 6.117 1.00 30.58 C ANISOU 1701 CB ALA B 108 3842 3339 4438 1293 1380 1115 C ATOM 0 H ALA B 108 21.551 45.314 4.823 1.00 28.98 H new ATOM 0 HA ALA B 108 22.540 45.849 7.149 1.00 27.31 H new ATOM 0 HB1 ALA B 108 23.984 43.998 6.729 1.00 30.58 H new ATOM 0 HB2 ALA B 108 22.496 43.631 6.331 1.00 30.58 H new ATOM 0 HB3 ALA B 108 23.544 44.016 5.207 1.00 30.58 H new ATOM 1707 N LEU B 109 24.244 47.033 4.781 1.00 31.94 N ANISOU 1707 N LEU B 109 4010 3318 4809 1321 1716 1367 N ATOM 1708 CA LEU B 109 25.338 47.920 4.427 1.00 37.78 C ANISOU 1708 CA LEU B 109 4619 3947 5788 1304 1912 1555 C ATOM 1709 C LEU B 109 25.324 49.214 5.243 1.00 36.84 C ANISOU 1709 C LEU B 109 4392 3804 5802 1122 1747 1550 C ATOM 1710 O LEU B 109 26.356 49.868 5.397 1.00 42.10 O ANISOU 1710 O LEU B 109 4864 4385 6748 1030 1823 1703 O ATOM 1711 CB LEU B 109 25.256 48.254 2.933 1.00 40.63 C ANISOU 1711 CB LEU B 109 5222 4229 5986 1488 2188 1618 C ATOM 1712 CG LEU B 109 26.514 48.269 2.061 1.00 58.79 C ANISOU 1712 CG LEU B 109 7455 6444 8438 1542 2514 1821 C ATOM 1713 CD1 LEU B 109 26.323 49.316 0.973 1.00 57.24 C ANISOU 1713 CD1 LEU B 109 7453 6185 8109 1628 2691 1839 C ATOM 1714 CD2 LEU B 109 27.805 48.521 2.834 1.00 60.49 C ANISOU 1714 CD2 LEU B 109 7294 6594 9096 1433 2555 2004 C ATOM 0 H LEU B 109 23.724 46.840 4.124 1.00 31.94 H new ATOM 0 HA LEU B 109 26.168 47.459 4.628 1.00 37.78 H new ATOM 0 HB2 LEU B 109 24.640 47.620 2.533 1.00 40.63 H new ATOM 0 HB3 LEU B 109 24.848 49.131 2.859 1.00 40.63 H new ATOM 0 HG LEU B 109 26.620 47.383 1.681 1.00 58.79 H new ATOM 0 HD11 LEU B 109 27.111 49.342 0.407 1.00 57.24 H new ATOM 0 HD12 LEU B 109 25.548 49.088 0.437 1.00 57.24 H new ATOM 0 HD13 LEU B 109 26.189 50.186 1.381 1.00 57.24 H new ATOM 0 HD21 LEU B 109 28.556 48.517 2.220 1.00 60.49 H new ATOM 0 HD22 LEU B 109 27.755 49.383 3.276 1.00 60.49 H new ATOM 0 HD23 LEU B 109 27.926 47.824 3.498 1.00 60.49 H new ATOM 1726 N GLU B 110 24.152 49.586 5.757 1.00 30.95 N ANISOU 1726 N GLU B 110 3774 3122 4863 1071 1524 1380 N ATOM 1727 CA GLU B 110 23.983 50.888 6.398 1.00 30.02 C ANISOU 1727 CA GLU B 110 3634 2961 4810 932 1389 1361 C ATOM 1728 C GLU B 110 23.972 50.833 7.917 1.00 30.09 C ANISOU 1728 C GLU B 110 3497 3012 4923 748 1110 1286 C ATOM 1729 O GLU B 110 23.446 51.732 8.576 1.00 30.17 O ANISOU 1729 O GLU B 110 3568 3006 4891 653 951 1209 O ATOM 1730 CB GLU B 110 22.683 51.544 5.919 1.00 33.81 C ANISOU 1730 CB GLU B 110 4375 3463 5007 1019 1352 1239 C ATOM 1731 CG GLU B 110 22.454 51.461 4.415 1.00 42.39 C ANISOU 1731 CG GLU B 110 5673 4518 5915 1222 1581 1279 C ATOM 1732 CD GLU B 110 23.530 52.152 3.603 1.00 47.60 C ANISOU 1732 CD GLU B 110 6305 5041 6739 1255 1851 1472 C ATOM 1733 OE1 GLU B 110 24.402 52.821 4.192 1.00 45.10 O ANISOU 1733 OE1 GLU B 110 5791 4652 6692 1104 1846 1575 O ATOM 1734 OE2 GLU B 110 23.506 52.013 2.364 1.00 55.71 O ANISOU 1734 OE2 GLU B 110 7519 6023 7626 1431 2070 1525 O ATOM 0 H GLU B 110 23.443 49.099 5.744 1.00 30.95 H new ATOM 0 HA GLU B 110 24.758 51.411 6.138 1.00 30.02 H new ATOM 0 HB2 GLU B 110 21.935 51.124 6.373 1.00 33.81 H new ATOM 0 HB3 GLU B 110 22.688 52.477 6.184 1.00 33.81 H new ATOM 0 HG2 GLU B 110 22.409 50.528 4.153 1.00 42.39 H new ATOM 0 HG3 GLU B 110 21.594 51.857 4.203 1.00 42.39 H new ATOM 1741 N TYR B 111 24.534 49.768 8.476 1.00 26.62 N ANISOU 1741 N TYR B 111 2895 2617 4602 711 1053 1307 N ATOM 1742 CA TYR B 111 24.686 49.653 9.919 1.00 27.54 C ANISOU 1742 CA TYR B 111 2881 2757 4828 541 792 1257 C ATOM 1743 C TYR B 111 26.142 49.388 10.246 1.00 30.86 C ANISOU 1743 C TYR B 111 3026 3121 5580 455 810 1425 C ATOM 1744 O TYR B 111 26.743 48.483 9.679 1.00 32.79 O ANISOU 1744 O TYR B 111 3178 3379 5901 558 976 1518 O ATOM 1745 CB TYR B 111 23.811 48.536 10.470 1.00 25.73 C ANISOU 1745 CB TYR B 111 2726 2644 4405 573 655 1105 C ATOM 1746 CG TYR B 111 22.350 48.889 10.503 1.00 22.83 C ANISOU 1746 CG TYR B 111 2575 2335 3764 612 572 941 C ATOM 1747 CD1 TYR B 111 21.593 48.953 9.333 1.00 22.55 C ANISOU 1747 CD1 TYR B 111 2714 2323 3531 765 711 906 C ATOM 1748 CD2 TYR B 111 21.723 49.178 11.704 1.00 24.74 C ANISOU 1748 CD2 TYR B 111 2852 2603 3946 504 353 828 C ATOM 1749 CE1 TYR B 111 20.257 49.279 9.365 1.00 22.42 C ANISOU 1749 CE1 TYR B 111 2860 2364 3293 804 622 770 C ATOM 1750 CE2 TYR B 111 20.394 49.510 11.740 1.00 22.46 C ANISOU 1750 CE2 TYR B 111 2733 2367 3433 552 299 696 C ATOM 1751 CZ TYR B 111 19.673 49.567 10.571 1.00 23.18 C ANISOU 1751 CZ TYR B 111 2955 2490 3361 699 428 672 C ATOM 1752 OH TYR B 111 18.350 49.875 10.612 1.00 24.08 O ANISOU 1752 OH TYR B 111 3206 2664 3280 750 361 553 O ATOM 0 H TYR B 111 24.836 49.096 8.032 1.00 26.62 H new ATOM 0 HA TYR B 111 24.404 50.484 10.333 1.00 27.54 H new ATOM 0 HB2 TYR B 111 23.933 47.740 9.929 1.00 25.73 H new ATOM 0 HB3 TYR B 111 24.105 48.316 11.368 1.00 25.73 H new ATOM 0 HD1 TYR B 111 21.999 48.772 8.516 1.00 22.55 H new ATOM 0 HD2 TYR B 111 22.210 49.146 12.496 1.00 24.74 H new ATOM 0 HE1 TYR B 111 19.758 49.304 8.581 1.00 22.42 H new ATOM 0 HE2 TYR B 111 19.981 49.696 12.552 1.00 22.46 H new ATOM 0 HH TYR B 111 17.960 49.522 9.957 1.00 24.08 H new ATOM 1762 N VAL B 112 26.697 50.168 11.169 1.00 30.86 N ANISOU 1762 N VAL B 112 2900 3050 5774 269 630 1465 N ATOM 1763 CA VAL B 112 28.116 50.075 11.527 1.00 31.40 C ANISOU 1763 CA VAL B 112 2673 3055 6201 161 607 1641 C ATOM 1764 C VAL B 112 28.382 49.237 12.770 1.00 36.08 C ANISOU 1764 C VAL B 112 3146 3696 6868 67 350 1602 C ATOM 1765 O VAL B 112 29.451 48.640 12.892 1.00 39.48 O ANISOU 1765 O VAL B 112 3330 4116 7556 50 363 1743 O ATOM 1766 CB VAL B 112 28.709 51.502 11.739 1.00 35.56 C ANISOU 1766 CB VAL B 112 3124 3447 6940 -9 546 1733 C ATOM 1767 CG1 VAL B 112 29.970 51.473 12.583 1.00 51.33 C ANISOU 1767 CG1 VAL B 112 4822 5383 9297 -187 371 1869 C ATOM 1768 CG2 VAL B 112 28.969 52.170 10.395 1.00 41.32 C ANISOU 1768 CG2 VAL B 112 3880 4104 7717 87 863 1857 C ATOM 0 H VAL B 112 26.264 50.768 11.608 1.00 30.86 H new ATOM 0 HA VAL B 112 28.549 49.626 10.784 1.00 31.40 H new ATOM 0 HB VAL B 112 28.053 52.025 12.227 1.00 35.56 H new ATOM 0 HG11 VAL B 112 30.308 52.376 12.692 1.00 51.33 H new ATOM 0 HG12 VAL B 112 29.768 51.096 13.454 1.00 51.33 H new ATOM 0 HG13 VAL B 112 30.641 50.928 12.143 1.00 51.33 H new ATOM 0 HG21 VAL B 112 29.337 53.056 10.539 1.00 41.32 H new ATOM 0 HG22 VAL B 112 29.599 51.637 9.885 1.00 41.32 H new ATOM 0 HG23 VAL B 112 28.136 52.243 9.903 1.00 41.32 H new ATOM 1778 N TYR B 113 27.410 49.135 13.680 1.00 29.99 N ANISOU 1778 N TYR B 113 2548 2977 5868 21 129 1421 N ATOM 1779 CA TYR B 113 27.632 48.390 14.920 1.00 31.67 C ANISOU 1779 CA TYR B 113 2687 3221 6126 -69 -122 1382 C ATOM 1780 C TYR B 113 26.925 47.047 14.883 1.00 27.91 C ANISOU 1780 C TYR B 113 2307 2861 5437 65 -81 1279 C ATOM 1781 O TYR B 113 25.717 46.984 14.723 1.00 29.41 O ANISOU 1781 O TYR B 113 2713 3112 5350 135 -56 1132 O ATOM 1782 CB TYR B 113 27.169 49.206 16.119 1.00 34.98 C ANISOU 1782 CB TYR B 113 3243 3589 6459 -229 -404 1267 C ATOM 1783 CG TYR B 113 27.812 50.569 16.165 1.00 36.95 C ANISOU 1783 CG TYR B 113 3434 3703 6903 -375 -462 1357 C ATOM 1784 CD1 TYR B 113 29.098 50.739 16.654 1.00 41.65 C ANISOU 1784 CD1 TYR B 113 3784 4211 7829 -528 -608 1505 C ATOM 1785 CD2 TYR B 113 27.140 51.678 15.699 1.00 37.27 C ANISOU 1785 CD2 TYR B 113 3658 3694 6808 -362 -376 1302 C ATOM 1786 CE1 TYR B 113 29.695 51.986 16.690 1.00 46.73 C ANISOU 1786 CE1 TYR B 113 4371 4717 8667 -683 -673 1591 C ATOM 1787 CE2 TYR B 113 27.728 52.935 15.730 1.00 39.90 C ANISOU 1787 CE2 TYR B 113 3957 3885 7317 -504 -425 1385 C ATOM 1788 CZ TYR B 113 29.002 53.081 16.225 1.00 45.44 C ANISOU 1788 CZ TYR B 113 4417 4497 8350 -672 -574 1528 C ATOM 1789 OH TYR B 113 29.580 54.332 16.251 1.00 52.22 O ANISOU 1789 OH TYR B 113 5242 5202 9397 -832 -634 1613 O ATOM 0 H TYR B 113 26.628 49.484 13.600 1.00 29.99 H new ATOM 0 HA TYR B 113 28.584 48.224 15.007 1.00 31.67 H new ATOM 0 HB2 TYR B 113 26.205 49.306 16.087 1.00 34.98 H new ATOM 0 HB3 TYR B 113 27.377 48.725 16.935 1.00 34.98 H new ATOM 0 HD1 TYR B 113 29.569 49.999 16.964 1.00 41.65 H new ATOM 0 HD2 TYR B 113 26.280 51.583 15.359 1.00 37.27 H new ATOM 0 HE1 TYR B 113 30.557 52.084 17.025 1.00 46.73 H new ATOM 0 HE2 TYR B 113 27.261 53.676 15.417 1.00 39.90 H new ATOM 0 HH TYR B 113 29.222 54.819 15.668 1.00 52.22 H new ATOM 1799 N TRP B 114 27.704 45.974 15.039 1.00 29.10 N ANISOU 1799 N TRP B 114 2286 3036 5735 97 -78 1366 N ATOM 1800 CA TRP B 114 27.221 44.599 14.883 1.00 30.03 C ANISOU 1800 CA TRP B 114 2481 3244 5685 229 -9 1297 C ATOM 1801 C TRP B 114 27.409 43.744 16.114 1.00 33.84 C ANISOU 1801 C TRP B 114 2916 3750 6190 162 -240 1264 C ATOM 1802 O TRP B 114 28.457 43.793 16.768 1.00 35.07 O ANISOU 1802 O TRP B 114 2872 3855 6597 66 -385 1378 O ATOM 1803 CB TRP B 114 27.935 43.934 13.695 1.00 32.38 C ANISOU 1803 CB TRP B 114 2666 3538 6099 389 278 1438 C ATOM 1804 CG TRP B 114 27.404 44.475 12.448 1.00 34.43 C ANISOU 1804 CG TRP B 114 3074 3789 6219 497 510 1423 C ATOM 1805 CD1 TRP B 114 27.788 45.630 11.832 1.00 33.13 C ANISOU 1805 CD1 TRP B 114 2866 3550 6173 474 630 1519 C ATOM 1806 CD2 TRP B 114 26.336 43.936 11.673 1.00 28.47 C ANISOU 1806 CD2 TRP B 114 2558 3091 5167 638 633 1302 C ATOM 1807 NE1 TRP B 114 27.023 45.843 10.718 1.00 28.28 N ANISOU 1807 NE1 TRP B 114 2462 2945 5338 606 823 1464 N ATOM 1808 CE2 TRP B 114 26.107 44.831 10.605 1.00 28.90 C ANISOU 1808 CE2 TRP B 114 2715 3106 5159 704 812 1328 C ATOM 1809 CE3 TRP B 114 25.524 42.804 11.791 1.00 32.43 C ANISOU 1809 CE3 TRP B 114 3204 3667 5450 704 592 1175 C ATOM 1810 CZ2 TRP B 114 25.124 44.607 9.640 1.00 33.83 C ANISOU 1810 CZ2 TRP B 114 3581 3764 5509 843 935 1233 C ATOM 1811 CZ3 TRP B 114 24.541 42.586 10.827 1.00 31.12 C ANISOU 1811 CZ3 TRP B 114 3265 3534 5028 826 713 1080 C ATOM 1812 CH2 TRP B 114 24.355 43.482 9.769 1.00 31.06 C ANISOU 1812 CH2 TRP B 114 3354 3486 4960 897 871 1109 C ATOM 0 H TRP B 114 28.538 46.025 15.241 1.00 29.10 H new ATOM 0 HA TRP B 114 26.265 44.662 14.728 1.00 30.03 H new ATOM 0 HB2 TRP B 114 28.890 44.094 13.748 1.00 32.38 H new ATOM 0 HB3 TRP B 114 27.806 42.973 13.724 1.00 32.38 H new ATOM 0 HD1 TRP B 114 28.470 46.190 12.126 1.00 33.13 H new ATOM 0 HE1 TRP B 114 27.104 46.506 10.176 1.00 28.28 H new ATOM 0 HE3 TRP B 114 25.637 42.209 12.497 1.00 32.43 H new ATOM 0 HZ2 TRP B 114 24.996 45.200 8.935 1.00 33.83 H new ATOM 0 HZ3 TRP B 114 24.000 41.832 10.888 1.00 31.12 H new ATOM 0 HH2 TRP B 114 23.693 43.309 9.139 1.00 31.06 H new ATOM 1823 N GLY B 115 26.391 42.938 16.403 1.00 29.53 N ANISOU 1823 N GLY B 115 2555 3277 5387 214 -274 1116 N ATOM 1824 CA GLY B 115 26.499 41.924 17.429 1.00 31.59 C ANISOU 1824 CA GLY B 115 2805 3561 5635 185 -444 1086 C ATOM 1825 C GLY B 115 27.242 40.713 16.901 1.00 34.91 C ANISOU 1825 C GLY B 115 3098 3998 6170 311 -299 1195 C ATOM 1826 O GLY B 115 27.735 40.717 15.768 1.00 35.39 O ANISOU 1826 O GLY B 115 3073 4043 6332 418 -62 1301 O ATOM 0 H GLY B 115 25.627 42.968 16.010 1.00 29.53 H new ATOM 0 HA2 GLY B 115 26.964 42.285 18.200 1.00 31.59 H new ATOM 0 HA3 GLY B 115 25.614 41.663 17.728 1.00 31.59 H new ATOM 1830 N GLN B 116 27.310 39.678 17.730 1.00 34.91 N ANISOU 1830 N GLN B 116 3106 4017 6142 309 -428 1170 N ATOM 1831 CA GLN B 116 28.117 38.496 17.449 1.00 36.08 C ANISOU 1831 CA GLN B 116 3128 4165 6417 426 -326 1283 C ATOM 1832 C GLN B 116 27.321 37.451 16.701 1.00 34.93 C ANISOU 1832 C GLN B 116 3170 4063 6040 570 -137 1195 C ATOM 1833 O GLN B 116 27.882 36.589 16.044 1.00 33.14 O ANISOU 1833 O GLN B 116 2888 3823 5881 707 38 1285 O ATOM 1834 CB GLN B 116 28.657 37.899 18.750 1.00 39.65 C ANISOU 1834 CB GLN B 116 3510 4601 6954 352 -575 1307 C ATOM 1835 CG GLN B 116 29.688 38.769 19.475 1.00 47.76 C ANISOU 1835 CG GLN B 116 4380 5566 8200 191 -764 1392 C ATOM 1836 CD GLN B 116 29.125 40.096 19.984 1.00 57.32 C ANISOU 1836 CD GLN B 116 5660 6746 9372 51 -949 1323 C ATOM 1837 OE1 GLN B 116 29.781 41.135 19.891 1.00 67.73 O ANISOU 1837 OE1 GLN B 116 6855 8004 10876 -46 -986 1406 O ATOM 1838 NE2 GLN B 116 27.914 40.062 20.530 1.00 54.17 N ANISOU 1838 NE2 GLN B 116 5511 6379 8693 27 -1033 1152 N ATOM 0 H GLN B 116 26.886 39.641 18.477 1.00 34.91 H new ATOM 0 HA GLN B 116 28.859 38.773 16.889 1.00 36.08 H new ATOM 0 HB2 GLN B 116 27.912 37.734 19.349 1.00 39.65 H new ATOM 0 HB3 GLN B 116 29.059 37.038 18.554 1.00 39.65 H new ATOM 0 HG2 GLN B 116 30.049 38.271 20.225 1.00 47.76 H new ATOM 0 HG3 GLN B 116 30.427 38.950 18.873 1.00 47.76 H new ATOM 0 HE21 GLN B 116 27.485 39.318 20.578 1.00 54.17 H new ATOM 0 HE22 GLN B 116 27.559 40.784 20.835 1.00 54.17 H new ATOM 1847 N GLY B 117 26.007 37.532 16.827 1.00 30.06 N ANISOU 1847 N GLY B 117 2777 3491 5155 536 -179 1021 N ATOM 1848 CA GLY B 117 25.101 36.665 16.105 1.00 30.49 C ANISOU 1848 CA GLY B 117 3022 3582 4982 641 -36 923 C ATOM 1849 C GLY B 117 24.646 35.509 16.967 1.00 25.58 C ANISOU 1849 C GLY B 117 2505 2980 4236 622 -152 840 C ATOM 1850 O GLY B 117 25.383 35.077 17.854 1.00 30.19 O ANISOU 1850 O GLY B 117 2987 3538 4945 591 -279 906 O ATOM 0 H GLY B 117 25.614 38.099 17.340 1.00 30.06 H new ATOM 0 HA2 GLY B 117 24.330 37.174 15.809 1.00 30.49 H new ATOM 0 HA3 GLY B 117 25.540 36.325 15.309 1.00 30.49 H new ATOM 1854 N THR B 118 23.440 35.022 16.696 1.00 27.36 N ANISOU 1854 N THR B 118 2928 3244 4225 640 -114 702 N ATOM 1855 CA THR B 118 22.916 33.827 17.362 1.00 27.64 C ANISOU 1855 CA THR B 118 3083 3288 4132 627 -185 625 C ATOM 1856 C THR B 118 22.265 32.911 16.313 1.00 26.35 C ANISOU 1856 C THR B 118 3080 3126 3806 726 -28 563 C ATOM 1857 O THR B 118 21.536 33.360 15.431 1.00 23.80 O ANISOU 1857 O THR B 118 2844 2827 3372 749 50 502 O ATOM 1858 CB THR B 118 21.929 34.195 18.500 1.00 33.46 C ANISOU 1858 CB THR B 118 3912 4059 4742 494 -359 504 C ATOM 1859 OG1 THR B 118 21.568 33.012 19.223 1.00 31.45 O ANISOU 1859 OG1 THR B 118 3761 3798 4389 478 -417 453 O ATOM 1860 CG2 THR B 118 20.680 34.887 17.974 1.00 28.27 C ANISOU 1860 CG2 THR B 118 3358 3453 3930 472 -316 392 C ATOM 0 H THR B 118 22.902 35.371 16.123 1.00 27.36 H new ATOM 0 HA THR B 118 23.649 33.350 17.783 1.00 27.64 H new ATOM 0 HB THR B 118 22.377 34.820 19.091 1.00 33.46 H new ATOM 0 HG1 THR B 118 21.535 33.184 20.044 1.00 31.45 H new ATOM 0 HG21 THR B 118 20.091 35.099 18.715 1.00 28.27 H new ATOM 0 HG22 THR B 118 20.931 35.705 17.517 1.00 28.27 H new ATOM 0 HG23 THR B 118 20.220 34.299 17.355 1.00 28.27 H new ATOM 1868 N GLN B 119 22.553 31.619 16.405 1.00 23.87 N ANISOU 1868 N GLN B 119 2820 2775 3475 788 5 583 N ATOM 1869 CA GLN B 119 22.102 30.658 15.406 1.00 23.00 C ANISOU 1869 CA GLN B 119 2884 2637 3219 885 146 536 C ATOM 1870 C GLN B 119 20.631 30.323 15.563 1.00 24.50 C ANISOU 1870 C GLN B 119 3247 2864 3199 797 69 377 C ATOM 1871 O GLN B 119 20.183 30.023 16.660 1.00 23.74 O ANISOU 1871 O GLN B 119 3167 2787 3068 697 -59 323 O ATOM 1872 CB GLN B 119 22.929 29.371 15.501 1.00 26.84 C ANISOU 1872 CB GLN B 119 3385 3055 3760 985 209 616 C ATOM 1873 CG GLN B 119 22.493 28.275 14.520 1.00 25.13 C ANISOU 1873 CG GLN B 119 3394 2780 3373 1085 347 562 C ATOM 1874 CD GLN B 119 22.830 28.614 13.084 1.00 30.09 C ANISOU 1874 CD GLN B 119 4069 3371 3992 1223 548 615 C ATOM 1875 OE1 GLN B 119 23.940 29.040 12.792 1.00 35.28 O ANISOU 1875 OE1 GLN B 119 4570 4006 4830 1315 664 758 O ATOM 1876 NE2 GLN B 119 21.874 28.431 12.181 1.00 31.17 N ANISOU 1876 NE2 GLN B 119 4425 3496 3924 1236 588 507 N ATOM 0 H GLN B 119 23.013 31.275 17.045 1.00 23.87 H new ATOM 0 HA GLN B 119 22.226 31.068 14.536 1.00 23.00 H new ATOM 0 HB2 GLN B 119 23.861 29.584 15.340 1.00 26.84 H new ATOM 0 HB3 GLN B 119 22.869 29.025 16.405 1.00 26.84 H new ATOM 0 HG2 GLN B 119 22.923 27.440 14.761 1.00 25.13 H new ATOM 0 HG3 GLN B 119 21.536 28.135 14.600 1.00 25.13 H new ATOM 0 HE21 GLN B 119 21.106 28.130 12.423 1.00 31.17 H new ATOM 0 HE22 GLN B 119 22.023 28.614 11.354 1.00 31.17 H new ATOM 1885 N VAL B 120 19.900 30.346 14.449 1.00 22.47 N ANISOU 1885 N VAL B 120 3121 2610 2807 838 150 311 N ATOM 1886 CA VAL B 120 18.512 29.908 14.391 1.00 19.87 C ANISOU 1886 CA VAL B 120 2943 2308 2301 762 82 173 C ATOM 1887 C VAL B 120 18.401 28.817 13.310 1.00 21.92 C ANISOU 1887 C VAL B 120 3401 2492 2437 856 183 149 C ATOM 1888 O VAL B 120 18.701 29.059 12.151 1.00 22.20 O ANISOU 1888 O VAL B 120 3503 2491 2441 969 302 183 O ATOM 1889 CB VAL B 120 17.547 31.062 14.048 1.00 18.74 C ANISOU 1889 CB VAL B 120 2786 2237 2098 710 37 104 C ATOM 1890 CG1 VAL B 120 16.153 30.533 13.794 1.00 21.81 C ANISOU 1890 CG1 VAL B 120 3308 2648 2330 645 -27 -19 C ATOM 1891 CG2 VAL B 120 17.546 32.136 15.135 1.00 21.41 C ANISOU 1891 CG2 VAL B 120 2976 2631 2528 618 -61 113 C ATOM 0 H VAL B 120 20.205 30.622 13.694 1.00 22.47 H new ATOM 0 HA VAL B 120 18.260 29.572 15.265 1.00 19.87 H new ATOM 0 HB VAL B 120 17.863 31.482 13.233 1.00 18.74 H new ATOM 0 HG11 VAL B 120 15.561 31.271 13.580 1.00 21.81 H new ATOM 0 HG12 VAL B 120 16.174 29.910 13.051 1.00 21.81 H new ATOM 0 HG13 VAL B 120 15.829 30.079 14.588 1.00 21.81 H new ATOM 0 HG21 VAL B 120 16.931 32.845 14.889 1.00 21.41 H new ATOM 0 HG22 VAL B 120 17.267 31.744 15.977 1.00 21.41 H new ATOM 0 HG23 VAL B 120 18.439 32.502 15.229 1.00 21.41 H new ATOM 1901 N THR B 121 17.972 27.623 13.701 1.00 20.66 N ANISOU 1901 N THR B 121 3358 2293 2197 811 139 93 N ATOM 1902 CA THR B 121 17.828 26.520 12.773 1.00 20.01 C ANISOU 1902 CA THR B 121 3500 2118 1985 884 212 60 C ATOM 1903 C THR B 121 16.429 25.947 12.868 1.00 25.64 C ANISOU 1903 C THR B 121 4339 2839 2562 751 92 -72 C ATOM 1904 O THR B 121 15.987 25.593 13.961 1.00 25.03 O ANISOU 1904 O THR B 121 4214 2790 2508 633 2 -104 O ATOM 1905 CB THR B 121 18.860 25.420 13.074 1.00 25.35 C ANISOU 1905 CB THR B 121 4215 2701 2714 977 297 142 C ATOM 1906 OG1 THR B 121 20.184 25.961 12.949 1.00 25.11 O ANISOU 1906 OG1 THR B 121 4030 2665 2847 1101 411 284 O ATOM 1907 CG2 THR B 121 18.694 24.282 12.099 1.00 25.09 C ANISOU 1907 CG2 THR B 121 4457 2551 2526 1059 380 102 C ATOM 0 H THR B 121 17.757 27.433 14.512 1.00 20.66 H new ATOM 0 HA THR B 121 17.981 26.852 11.874 1.00 20.01 H new ATOM 0 HB THR B 121 18.723 25.092 13.977 1.00 25.35 H new ATOM 0 HG1 THR B 121 20.749 25.361 13.114 1.00 25.11 H new ATOM 0 HG21 THR B 121 19.347 23.591 12.293 1.00 25.09 H new ATOM 0 HG22 THR B 121 17.800 23.914 12.180 1.00 25.09 H new ATOM 0 HG23 THR B 121 18.828 24.608 11.195 1.00 25.09 H new ATOM 1915 N VAL B 122 15.729 25.914 11.739 1.00 22.56 N ANISOU 1915 N VAL B 122 4107 2426 2040 767 85 -140 N ATOM 1916 CA VAL B 122 14.375 25.395 11.691 1.00 27.27 C ANISOU 1916 CA VAL B 122 4806 3026 2529 633 -47 -257 C ATOM 1917 C VAL B 122 14.382 24.102 10.899 1.00 28.44 C ANISOU 1917 C VAL B 122 5231 3034 2541 679 -18 -293 C ATOM 1918 O VAL B 122 14.634 24.090 9.696 1.00 30.02 O ANISOU 1918 O VAL B 122 5606 3161 2637 799 50 -291 O ATOM 1919 CB VAL B 122 13.386 26.405 11.064 1.00 26.66 C ANISOU 1919 CB VAL B 122 4692 3031 2408 591 -135 -317 C ATOM 1920 CG1 VAL B 122 11.961 25.886 11.190 1.00 32.89 C ANISOU 1920 CG1 VAL B 122 5523 3837 3139 432 -290 -421 C ATOM 1921 CG2 VAL B 122 13.526 27.743 11.723 1.00 25.65 C ANISOU 1921 CG2 VAL B 122 4328 3016 2401 577 -136 -273 C ATOM 0 H VAL B 122 16.028 26.192 10.982 1.00 22.56 H new ATOM 0 HA VAL B 122 14.072 25.235 12.599 1.00 27.27 H new ATOM 0 HB VAL B 122 13.592 26.508 10.122 1.00 26.66 H new ATOM 0 HG11 VAL B 122 11.348 26.525 10.795 1.00 32.89 H new ATOM 0 HG12 VAL B 122 11.884 25.036 10.729 1.00 32.89 H new ATOM 0 HG13 VAL B 122 11.742 25.766 12.127 1.00 32.89 H new ATOM 0 HG21 VAL B 122 12.902 28.368 11.322 1.00 25.65 H new ATOM 0 HG22 VAL B 122 13.336 27.659 12.670 1.00 25.65 H new ATOM 0 HG23 VAL B 122 14.431 28.070 11.603 1.00 25.65 H new ATOM 1931 N SER B 123 14.147 23.003 11.603 1.00 27.94 N ANISOU 1931 N SER B 123 5230 2916 2468 591 -58 -322 N ATOM 1932 CA SER B 123 14.060 21.711 10.951 1.00 32.36 C ANISOU 1932 CA SER B 123 6078 3326 2893 613 -47 -366 C ATOM 1933 C SER B 123 13.175 20.765 11.737 1.00 29.44 C ANISOU 1933 C SER B 123 5745 2927 2512 432 -159 -433 C ATOM 1934 O SER B 123 13.009 20.903 12.944 1.00 32.75 O ANISOU 1934 O SER B 123 5985 3422 3038 336 -189 -415 O ATOM 1935 CB SER B 123 15.452 21.117 10.750 1.00 37.46 C ANISOU 1935 CB SER B 123 6827 3862 3543 803 134 -270 C ATOM 1936 OG SER B 123 16.167 21.112 11.953 1.00 37.11 O ANISOU 1936 OG SER B 123 6590 3861 3647 806 169 -188 O ATOM 0 H SER B 123 14.036 22.986 12.456 1.00 27.94 H new ATOM 0 HA SER B 123 13.656 21.838 10.079 1.00 32.36 H new ATOM 0 HB2 SER B 123 15.376 20.212 10.410 1.00 37.46 H new ATOM 0 HB3 SER B 123 15.935 21.631 10.084 1.00 37.46 H new ATOM 0 HG SER B 123 15.930 20.453 12.417 1.00 37.11 H new ATOM 1942 N SER B 124 12.586 19.821 11.009 1.00 39.63 N ANISOU 1942 N SER B 124 7292 4097 3669 384 -222 -511 N ATOM 1943 CA SER B 124 11.652 18.849 11.565 1.00 37.02 C ANISOU 1943 CA SER B 124 6990 3726 3349 193 -328 -561 C ATOM 1944 C SER B 124 12.327 17.837 12.476 1.00 46.39 C ANISOU 1944 C SER B 124 8270 4815 4541 213 -243 -528 C ATOM 1945 O SER B 124 13.520 17.563 12.383 1.00 40.89 O ANISOU 1945 O SER B 124 7649 4052 3837 390 -104 -453 O ATOM 1946 CB SER B 124 10.941 18.103 10.429 1.00 45.46 C ANISOU 1946 CB SER B 124 8227 4705 4342 136 -416 -594 C ATOM 1947 OG SER B 124 10.239 18.998 9.584 1.00 49.40 O ANISOU 1947 OG SER B 124 8652 5285 4835 117 -515 -626 O ATOM 1948 OXT SER B 124 11.661 17.247 13.314 1.00 51.48 O ANISOU 1948 OXT SER B 124 8889 5449 5222 53 -306 -554 O ATOM 0 H SER B 124 12.720 19.726 10.165 1.00 39.63 H new ATOM 0 HA SER B 124 11.015 19.347 12.101 1.00 37.02 H new ATOM 0 HB2 SER B 124 11.592 17.607 9.908 1.00 45.46 H new ATOM 0 HB3 SER B 124 10.323 17.455 10.802 1.00 45.46 H new ATOM 0 HG SER B 124 9.861 18.566 8.971 1.00 49.40 H new TER 1954 SER B 124 ATOM 1955 N ASP A 214 30.279 65.715 7.983 1.00 40.72 N ANISOU 1955 N ASP A 214 5053 5421 4997 229 -2095 787 N ATOM 1956 CA ASP A 214 29.045 66.470 7.764 1.00 39.62 C ANISOU 1956 CA ASP A 214 5153 5272 4629 187 -1731 518 C ATOM 1957 C ASP A 214 29.276 67.581 6.753 1.00 40.85 C ANISOU 1957 C ASP A 214 5117 5346 5056 191 -1592 401 C ATOM 1958 O ASP A 214 28.370 67.933 5.991 1.00 38.23 O ANISOU 1958 O ASP A 214 4851 4927 4748 278 -1308 263 O ATOM 1959 CB ASP A 214 28.523 67.063 9.077 1.00 45.77 C ANISOU 1959 CB ASP A 214 6299 6157 4934 -70 -1834 319 C ATOM 1960 CG ASP A 214 27.118 67.620 8.948 1.00 43.79 C ANISOU 1960 CG ASP A 214 6217 5922 4500 -29 -1458 -49 C ATOM 1961 OD1 ASP A 214 26.178 66.820 8.735 1.00 39.70 O ANISOU 1961 OD1 ASP A 214 5746 5472 3866 53 -1194 -34 O ATOM 1962 OD2 ASP A 214 26.941 68.855 9.064 1.00 42.95 O ANISOU 1962 OD2 ASP A 214 6174 5733 4413 -70 -1468 -377 O ATOM 0 HA ASP A 214 28.378 65.857 7.416 1.00 39.62 H new ATOM 0 HB2 ASP A 214 28.534 66.378 9.764 1.00 45.77 H new ATOM 0 HB3 ASP A 214 29.121 67.768 9.370 1.00 45.77 H new ATOM 1967 N GLU A 215 30.486 68.135 6.758 1.00 45.94 N ANISOU 1967 N GLU A 215 5531 6020 5904 43 -1845 493 N ATOM 1968 CA GLU A 215 30.824 69.244 5.871 1.00 50.47 C ANISOU 1968 CA GLU A 215 5962 6525 6691 -105 -1789 470 C ATOM 1969 C GLU A 215 30.802 68.834 4.398 1.00 44.45 C ANISOU 1969 C GLU A 215 4929 5836 6122 16 -1453 561 C ATOM 1970 O GLU A 215 30.725 69.697 3.521 1.00 41.95 O ANISOU 1970 O GLU A 215 4610 5454 5873 -154 -1364 585 O ATOM 1971 CB GLU A 215 32.201 69.820 6.232 1.00 51.52 C ANISOU 1971 CB GLU A 215 5851 6740 6984 -376 -2142 582 C ATOM 1972 CG GLU A 215 33.335 68.808 6.176 1.00 60.42 C ANISOU 1972 CG GLU A 215 6500 8102 8356 -268 -2254 759 C ATOM 1973 CD GLU A 215 34.588 69.290 6.879 1.00 73.09 C ANISOU 1973 CD GLU A 215 7872 9807 10093 -532 -2698 846 C ATOM 1974 OE1 GLU A 215 34.777 70.522 6.989 1.00 76.70 O ANISOU 1974 OE1 GLU A 215 8449 10176 10516 -873 -2840 806 O ATOM 1975 OE2 GLU A 215 35.384 68.435 7.324 1.00 76.62 O ANISOU 1975 OE2 GLU A 215 8017 10377 10718 -400 -2970 956 O ATOM 0 H GLU A 215 31.128 67.881 7.271 1.00 45.94 H new ATOM 0 HA GLU A 215 30.145 69.925 5.997 1.00 50.47 H new ATOM 0 HB2 GLU A 215 32.403 70.551 5.627 1.00 51.52 H new ATOM 0 HB3 GLU A 215 32.159 70.195 7.126 1.00 51.52 H new ATOM 0 HG2 GLU A 215 33.041 67.977 6.581 1.00 60.42 H new ATOM 0 HG3 GLU A 215 33.544 68.614 5.249 1.00 60.42 H new ATOM 1982 N ASP A 216 30.870 67.532 4.124 1.00 38.89 N ANISOU 1982 N ASP A 216 4037 5248 5491 276 -1313 611 N ATOM 1983 CA ASP A 216 30.881 67.055 2.742 1.00 39.57 C ANISOU 1983 CA ASP A 216 3866 5457 5713 391 -976 608 C ATOM 1984 C ASP A 216 29.464 67.055 2.157 1.00 35.01 C ANISOU 1984 C ASP A 216 3611 4730 4962 483 -719 530 C ATOM 1985 O ASP A 216 29.284 66.961 0.944 1.00 33.54 O ANISOU 1985 O ASP A 216 3326 4626 4793 485 -463 528 O ATOM 1986 CB ASP A 216 31.497 65.660 2.646 1.00 37.15 C ANISOU 1986 CB ASP A 216 3223 5262 5630 688 -975 592 C ATOM 1987 CG ASP A 216 33.010 65.663 2.886 1.00 55.73 C ANISOU 1987 CG ASP A 216 5070 7824 8281 639 -1210 622 C ATOM 1988 OD1 ASP A 216 33.651 66.732 2.763 1.00 50.09 O ANISOU 1988 OD1 ASP A 216 4192 7261 7577 305 -1251 673 O ATOM 1989 OD2 ASP A 216 33.567 64.587 3.194 1.00 61.06 O ANISOU 1989 OD2 ASP A 216 5490 8485 9225 930 -1406 597 O ATOM 0 H ASP A 216 30.910 66.913 4.719 1.00 38.89 H new ATOM 0 HA ASP A 216 31.429 67.664 2.223 1.00 39.57 H new ATOM 0 HB2 ASP A 216 31.072 65.078 3.295 1.00 37.15 H new ATOM 0 HB3 ASP A 216 31.313 65.289 1.769 1.00 37.15 H new ATOM 1994 N GLY A 217 28.472 67.159 3.035 1.00 33.61 N ANISOU 1994 N GLY A 217 3788 4386 4596 529 -791 442 N ATOM 1995 CA GLY A 217 27.096 67.407 2.639 1.00 30.79 C ANISOU 1995 CA GLY A 217 3675 3896 4129 598 -612 316 C ATOM 1996 C GLY A 217 26.390 66.341 1.825 1.00 27.16 C ANISOU 1996 C GLY A 217 3194 3465 3661 789 -354 318 C ATOM 1997 O GLY A 217 25.381 66.633 1.171 1.00 25.75 O ANISOU 1997 O GLY A 217 3133 3198 3452 818 -229 245 O ATOM 0 H GLY A 217 28.582 67.087 3.885 1.00 33.61 H new ATOM 0 HA2 GLY A 217 26.577 67.559 3.444 1.00 30.79 H new ATOM 0 HA3 GLY A 217 27.077 68.232 2.129 1.00 30.79 H new ATOM 2001 N LEU A 218 26.862 65.103 1.884 1.00 25.48 N ANISOU 2001 N LEU A 218 2846 3324 3513 929 -340 383 N ATOM 2002 CA LEU A 218 26.330 64.063 1.008 1.00 24.29 C ANISOU 2002 CA LEU A 218 2674 3158 3397 1101 -134 348 C ATOM 2003 C LEU A 218 25.040 63.419 1.528 1.00 30.60 C ANISOU 2003 C LEU A 218 3742 3853 4030 1139 -98 322 C ATOM 2004 O LEU A 218 24.967 62.919 2.658 1.00 31.16 O ANISOU 2004 O LEU A 218 3952 3901 3985 1089 -258 398 O ATOM 2005 CB LEU A 218 27.387 62.987 0.777 1.00 29.05 C ANISOU 2005 CB LEU A 218 2994 3809 4236 1283 -184 349 C ATOM 2006 CG LEU A 218 28.668 63.477 0.114 1.00 31.78 C ANISOU 2006 CG LEU A 218 2935 4392 4748 1222 -123 306 C ATOM 2007 CD1 LEU A 218 29.718 62.379 0.159 1.00 40.30 C ANISOU 2007 CD1 LEU A 218 3646 5510 6158 1491 -237 206 C ATOM 2008 CD2 LEU A 218 28.421 63.922 -1.317 1.00 32.54 C ANISOU 2008 CD2 LEU A 218 2975 4663 4725 1089 197 234 C ATOM 0 H LEU A 218 27.484 64.844 2.418 1.00 25.48 H new ATOM 0 HA LEU A 218 26.102 64.501 0.173 1.00 24.29 H new ATOM 0 HB2 LEU A 218 27.613 62.586 1.631 1.00 29.05 H new ATOM 0 HB3 LEU A 218 27.002 62.286 0.228 1.00 29.05 H new ATOM 0 HG LEU A 218 28.990 64.249 0.605 1.00 31.78 H new ATOM 0 HD11 LEU A 218 30.533 62.693 -0.264 1.00 40.30 H new ATOM 0 HD12 LEU A 218 29.902 62.145 1.082 1.00 40.30 H new ATOM 0 HD13 LEU A 218 29.390 61.598 -0.313 1.00 40.30 H new ATOM 0 HD21 LEU A 218 29.254 64.227 -1.709 1.00 32.54 H new ATOM 0 HD22 LEU A 218 28.075 63.177 -1.833 1.00 32.54 H new ATOM 0 HD23 LEU A 218 27.776 64.647 -1.324 1.00 32.54 H new ATOM 2020 N ILE A 219 24.029 63.432 0.669 1.00 26.83 N ANISOU 2020 N ILE A 219 3332 3350 3514 1166 94 240 N ATOM 2021 CA ILE A 219 22.755 62.786 0.929 1.00 25.69 C ANISOU 2021 CA ILE A 219 3354 3166 3243 1163 172 198 C ATOM 2022 C ILE A 219 22.523 61.720 -0.126 1.00 26.17 C ANISOU 2022 C ILE A 219 3394 3156 3396 1274 274 192 C ATOM 2023 O ILE A 219 22.595 62.001 -1.331 1.00 27.04 O ANISOU 2023 O ILE A 219 3418 3303 3552 1308 390 129 O ATOM 2024 CB ILE A 219 21.564 63.777 0.888 1.00 26.05 C ANISOU 2024 CB ILE A 219 3450 3232 3216 1114 255 33 C ATOM 2025 CG1 ILE A 219 21.726 64.863 1.951 1.00 28.87 C ANISOU 2025 CG1 ILE A 219 3841 3627 3500 1036 147 -85 C ATOM 2026 CG2 ILE A 219 20.274 63.012 1.065 1.00 31.64 C ANISOU 2026 CG2 ILE A 219 4218 3989 3813 1077 375 -32 C ATOM 2027 CD1 ILE A 219 21.857 64.336 3.350 1.00 33.31 C ANISOU 2027 CD1 ILE A 219 4510 4327 3819 899 95 -57 C ATOM 0 H ILE A 219 24.067 63.825 -0.095 1.00 26.83 H new ATOM 0 HA ILE A 219 22.798 62.408 1.821 1.00 25.69 H new ATOM 0 HB ILE A 219 21.543 64.224 0.027 1.00 26.05 H new ATOM 0 HG12 ILE A 219 22.510 65.393 1.741 1.00 28.87 H new ATOM 0 HG13 ILE A 219 20.961 65.459 1.910 1.00 28.87 H new ATOM 0 HG21 ILE A 219 19.526 63.629 1.040 1.00 31.64 H new ATOM 0 HG22 ILE A 219 20.182 62.363 0.350 1.00 31.64 H new ATOM 0 HG23 ILE A 219 20.285 62.552 1.919 1.00 31.64 H new ATOM 0 HD11 ILE A 219 21.956 65.078 3.967 1.00 33.31 H new ATOM 0 HD12 ILE A 219 21.064 63.828 3.580 1.00 33.31 H new ATOM 0 HD13 ILE A 219 22.637 63.762 3.408 1.00 33.31 H new ATOM 2039 N SER A 220 22.271 60.493 0.316 1.00 24.58 N ANISOU 2039 N SER A 220 3306 2842 3193 1282 194 265 N ATOM 2040 CA SER A 220 21.933 59.414 -0.585 1.00 26.51 C ANISOU 2040 CA SER A 220 3583 2949 3542 1378 240 210 C ATOM 2041 C SER A 220 20.434 59.314 -0.717 1.00 24.46 C ANISOU 2041 C SER A 220 3447 2713 3134 1228 348 183 C ATOM 2042 O SER A 220 19.708 59.346 0.289 1.00 26.11 O ANISOU 2042 O SER A 220 3744 3005 3171 1033 338 250 O ATOM 2043 CB SER A 220 22.500 58.089 -0.085 1.00 27.85 C ANISOU 2043 CB SER A 220 3831 2865 3884 1465 -20 315 C ATOM 2044 OG SER A 220 23.908 58.154 0.084 1.00 34.35 O ANISOU 2044 OG SER A 220 4449 3677 4927 1646 -170 304 O ATOM 0 H SER A 220 22.292 60.268 1.146 1.00 24.58 H new ATOM 0 HA SER A 220 22.323 59.603 -1.453 1.00 26.51 H new ATOM 0 HB2 SER A 220 22.082 57.855 0.759 1.00 27.85 H new ATOM 0 HB3 SER A 220 22.281 57.384 -0.715 1.00 27.85 H new ATOM 0 HG SER A 220 24.192 57.413 0.361 1.00 34.35 H new ATOM 2050 N LEU A 221 19.970 59.232 -1.962 1.00 24.57 N ANISOU 2050 N LEU A 221 3435 2719 3183 1282 458 61 N ATOM 2051 CA LEU A 221 18.550 59.105 -2.256 1.00 24.20 C ANISOU 2051 CA LEU A 221 3441 2697 3057 1153 515 18 C ATOM 2052 C LEU A 221 18.278 57.818 -3.004 1.00 26.10 C ANISOU 2052 C LEU A 221 3796 2754 3367 1160 470 -24 C ATOM 2053 O LEU A 221 18.995 57.495 -3.951 1.00 27.86 O ANISOU 2053 O LEU A 221 4002 2914 3667 1316 490 -155 O ATOM 2054 CB LEU A 221 18.077 60.279 -3.103 1.00 23.98 C ANISOU 2054 CB LEU A 221 3319 2780 3014 1171 569 -72 C ATOM 2055 CG LEU A 221 18.286 61.686 -2.565 1.00 24.75 C ANISOU 2055 CG LEU A 221 3330 2953 3121 1187 539 -83 C ATOM 2056 CD1 LEU A 221 17.891 62.707 -3.643 1.00 24.91 C ANISOU 2056 CD1 LEU A 221 3329 2947 3191 1193 450 -103 C ATOM 2057 CD2 LEU A 221 17.467 61.898 -1.351 1.00 23.43 C ANISOU 2057 CD2 LEU A 221 3112 2888 2903 1114 569 -169 C ATOM 0 H LEU A 221 20.473 59.249 -2.659 1.00 24.57 H new ATOM 0 HA LEU A 221 18.069 59.097 -1.414 1.00 24.20 H new ATOM 0 HB2 LEU A 221 18.522 60.222 -3.963 1.00 23.98 H new ATOM 0 HB3 LEU A 221 17.128 60.163 -3.267 1.00 23.98 H new ATOM 0 HG LEU A 221 19.221 61.802 -2.333 1.00 24.75 H new ATOM 0 HD11 LEU A 221 18.023 63.605 -3.302 1.00 24.91 H new ATOM 0 HD12 LEU A 221 18.442 62.576 -4.431 1.00 24.91 H new ATOM 0 HD13 LEU A 221 16.958 62.585 -3.878 1.00 24.91 H new ATOM 0 HD21 LEU A 221 17.609 62.798 -1.018 1.00 23.43 H new ATOM 0 HD22 LEU A 221 16.529 61.778 -1.568 1.00 23.43 H new ATOM 0 HD23 LEU A 221 17.725 61.257 -0.670 1.00 23.43 H new ATOM 2069 N ILE A 222 17.254 57.078 -2.598 1.00 24.09 N ANISOU 2069 N ILE A 222 3643 2439 3069 957 418 47 N ATOM 2070 CA ILE A 222 16.826 55.927 -3.370 1.00 23.29 C ANISOU 2070 CA ILE A 222 3681 2119 3049 918 327 -11 C ATOM 2071 C ILE A 222 15.634 56.318 -4.207 1.00 24.97 C ANISOU 2071 C ILE A 222 3813 2485 3189 809 401 -114 C ATOM 2072 O ILE A 222 14.664 56.879 -3.703 1.00 23.17 O ANISOU 2072 O ILE A 222 3440 2465 2897 653 462 -86 O ATOM 2073 CB ILE A 222 16.470 54.709 -2.485 1.00 26.63 C ANISOU 2073 CB ILE A 222 4313 2310 3496 672 125 195 C ATOM 2074 CG1 ILE A 222 17.705 54.206 -1.757 1.00 38.93 C ANISOU 2074 CG1 ILE A 222 5985 3613 5194 809 -97 328 C ATOM 2075 CG2 ILE A 222 15.926 53.588 -3.341 1.00 32.46 C ANISOU 2075 CG2 ILE A 222 5217 2766 4352 602 -16 107 C ATOM 2076 CD1 ILE A 222 18.683 53.430 -2.659 1.00 31.50 C ANISOU 2076 CD1 ILE A 222 5069 2325 4572 1171 -244 96 C ATOM 0 H ILE A 222 16.798 57.226 -1.884 1.00 24.09 H new ATOM 0 HA ILE A 222 17.568 55.655 -3.932 1.00 23.29 H new ATOM 0 HB ILE A 222 15.801 54.988 -1.840 1.00 26.63 H new ATOM 0 HG12 ILE A 222 18.170 54.962 -1.365 1.00 38.93 H new ATOM 0 HG13 ILE A 222 17.428 53.633 -1.025 1.00 38.93 H new ATOM 0 HG21 ILE A 222 15.706 52.829 -2.779 1.00 32.46 H new ATOM 0 HG22 ILE A 222 15.128 53.891 -3.802 1.00 32.46 H new ATOM 0 HG23 ILE A 222 16.595 53.324 -3.992 1.00 32.46 H new ATOM 0 HD11 ILE A 222 19.445 53.139 -2.135 1.00 31.50 H new ATOM 0 HD12 ILE A 222 18.234 52.656 -3.033 1.00 31.50 H new ATOM 0 HD13 ILE A 222 18.987 54.006 -3.378 1.00 31.50 H new ATOM 2088 N PHE A 223 15.733 56.025 -5.501 1.00 26.65 N ANISOU 2088 N PHE A 223 4092 2621 3414 898 382 -278 N ATOM 2089 CA PHE A 223 14.662 56.259 -6.449 1.00 25.49 C ANISOU 2089 CA PHE A 223 3916 2573 3194 778 349 -353 C ATOM 2090 C PHE A 223 14.057 54.942 -6.897 1.00 29.00 C ANISOU 2090 C PHE A 223 4537 2798 3682 625 211 -425 C ATOM 2091 O PHE A 223 14.774 53.973 -7.114 1.00 29.51 O ANISOU 2091 O PHE A 223 4781 2599 3831 730 146 -544 O ATOM 2092 CB PHE A 223 15.175 57.023 -7.674 1.00 31.04 C ANISOU 2092 CB PHE A 223 4623 3410 3762 877 389 -456 C ATOM 2093 CG PHE A 223 15.370 58.499 -7.453 1.00 28.06 C ANISOU 2093 CG PHE A 223 4101 3199 3362 923 411 -340 C ATOM 2094 CD1 PHE A 223 16.557 58.994 -6.923 1.00 26.29 C ANISOU 2094 CD1 PHE A 223 3824 3016 3149 1042 516 -296 C ATOM 2095 CD2 PHE A 223 14.374 59.391 -7.795 1.00 24.65 C ANISOU 2095 CD2 PHE A 223 3581 2833 2951 855 255 -287 C ATOM 2096 CE1 PHE A 223 16.734 60.354 -6.732 1.00 23.63 C ANISOU 2096 CE1 PHE A 223 3399 2762 2816 1048 476 -193 C ATOM 2097 CE2 PHE A 223 14.541 60.743 -7.596 1.00 25.32 C ANISOU 2097 CE2 PHE A 223 3574 2951 3095 919 178 -201 C ATOM 2098 CZ PHE A 223 15.730 61.224 -7.075 1.00 26.81 C ANISOU 2098 CZ PHE A 223 3764 3160 3264 994 294 -150 C ATOM 0 H PHE A 223 16.437 55.679 -5.853 1.00 26.65 H new ATOM 0 HA PHE A 223 13.984 56.793 -6.006 1.00 25.49 H new ATOM 0 HB2 PHE A 223 16.019 56.635 -7.953 1.00 31.04 H new ATOM 0 HB3 PHE A 223 14.550 56.897 -8.405 1.00 31.04 H new ATOM 0 HD1 PHE A 223 17.239 58.405 -6.694 1.00 26.29 H new ATOM 0 HD2 PHE A 223 13.581 59.075 -8.164 1.00 24.65 H new ATOM 0 HE1 PHE A 223 17.529 60.676 -6.373 1.00 23.63 H new ATOM 0 HE2 PHE A 223 13.855 61.333 -7.812 1.00 25.32 H new ATOM 0 HZ PHE A 223 15.848 62.139 -6.957 1.00 26.81 H new ATOM 2108 N ASN A 224 12.738 54.906 -7.056 1.00 31.51 N ANISOU 2108 N ASN A 224 4777 3203 3993 390 128 -394 N ATOM 2109 CA ASN A 224 12.072 53.732 -7.610 1.00 35.75 C ANISOU 2109 CA ASN A 224 5487 3531 4565 182 -50 -464 C ATOM 2110 C ASN A 224 12.079 53.780 -9.126 1.00 39.98 C ANISOU 2110 C ASN A 224 6139 4083 4970 239 -123 -687 C ATOM 2111 O ASN A 224 11.063 53.505 -9.762 1.00 45.53 O ANISOU 2111 O ASN A 224 6855 4799 5646 23 -295 -726 O ATOM 2112 CB ASN A 224 10.627 53.621 -7.092 1.00 43.10 C ANISOU 2112 CB ASN A 224 6220 4617 5540 -172 -109 -338 C ATOM 2113 CG ASN A 224 9.794 54.862 -7.398 1.00 53.77 C ANISOU 2113 CG ASN A 224 7222 6310 6900 -129 -89 -385 C ATOM 2114 OD1 ASN A 224 10.146 55.668 -8.265 1.00 49.27 O ANISOU 2114 OD1 ASN A 224 6672 5777 6272 81 -137 -454 O ATOM 2115 ND2 ASN A 224 8.679 55.020 -6.683 1.00 59.45 N ANISOU 2115 ND2 ASN A 224 7601 7284 7702 -353 -47 -356 N ATOM 0 H ASN A 224 12.210 55.552 -6.849 1.00 31.51 H new ATOM 0 HA ASN A 224 12.563 52.947 -7.319 1.00 35.75 H new ATOM 0 HB2 ASN A 224 10.203 52.845 -7.491 1.00 43.10 H new ATOM 0 HB3 ASN A 224 10.642 53.474 -6.133 1.00 43.10 H new ATOM 0 HD21 ASN A 224 8.175 55.703 -6.818 1.00 59.45 H new ATOM 0 HD22 ASN A 224 8.464 54.438 -6.087 1.00 59.45 H new ATOM 2122 N LYS A 225 13.234 54.110 -9.703 1.00 31.78 N ANISOU 2122 N LYS A 225 5172 3092 3810 476 7 -836 N ATOM 2123 CA LYS A 225 13.394 54.193 -11.149 1.00 32.24 C ANISOU 2123 CA LYS A 225 5366 3276 3607 453 -5 -1063 C ATOM 2124 C LYS A 225 14.646 53.437 -11.593 1.00 34.63 C ANISOU 2124 C LYS A 225 5800 3479 3877 663 141 -1420 C ATOM 2125 O LYS A 225 15.602 53.343 -10.836 1.00 37.16 O ANISOU 2125 O LYS A 225 6026 3708 4386 895 255 -1424 O ATOM 2126 CB LYS A 225 13.475 55.653 -11.585 1.00 38.03 C ANISOU 2126 CB LYS A 225 5986 4330 4136 434 31 -904 C ATOM 2127 CG LYS A 225 12.198 56.451 -11.337 1.00 39.21 C ANISOU 2127 CG LYS A 225 5954 4542 4404 312 -189 -668 C ATOM 2128 CD LYS A 225 12.325 57.848 -11.898 1.00 50.28 C ANISOU 2128 CD LYS A 225 7326 6117 5662 300 -298 -503 C ATOM 2129 CE LYS A 225 10.999 58.592 -11.890 1.00 62.19 C ANISOU 2129 CE LYS A 225 8635 7621 7376 245 -636 -358 C ATOM 2130 NZ LYS A 225 11.125 59.905 -12.590 1.00 73.67 N ANISOU 2130 NZ LYS A 225 10155 9115 8719 206 -899 -154 N ATOM 0 H LYS A 225 13.949 54.293 -9.262 1.00 31.78 H new ATOM 0 HA LYS A 225 12.622 53.783 -11.570 1.00 32.24 H new ATOM 0 HB2 LYS A 225 14.208 56.080 -11.115 1.00 38.03 H new ATOM 0 HB3 LYS A 225 13.687 55.686 -12.531 1.00 38.03 H new ATOM 0 HG2 LYS A 225 11.444 56.000 -11.748 1.00 39.21 H new ATOM 0 HG3 LYS A 225 12.018 56.495 -10.385 1.00 39.21 H new ATOM 0 HD2 LYS A 225 12.976 58.345 -11.379 1.00 50.28 H new ATOM 0 HD3 LYS A 225 12.662 57.801 -12.806 1.00 50.28 H new ATOM 0 HE2 LYS A 225 10.318 58.054 -12.323 1.00 62.19 H new ATOM 0 HE3 LYS A 225 10.709 58.735 -10.976 1.00 62.19 H new ATOM 0 HZ1 LYS A 225 10.367 60.363 -12.501 1.00 73.67 H new ATOM 0 HZ2 LYS A 225 11.796 60.369 -12.233 1.00 73.67 H new ATOM 0 HZ3 LYS A 225 11.287 59.767 -13.454 1.00 73.67 H new ATOM 2144 N LYS A 226 14.626 52.898 -12.811 1.00 37.37 N ANISOU 2144 N LYS A 226 6334 3866 3998 589 119 -1767 N ATOM 2145 CA LYS A 226 15.793 52.228 -13.384 1.00 40.86 C ANISOU 2145 CA LYS A 226 6823 4304 4397 818 306 -2269 C ATOM 2146 C LYS A 226 16.944 53.205 -13.589 1.00 46.39 C ANISOU 2146 C LYS A 226 7308 5446 4874 911 637 -2294 C ATOM 2147 O LYS A 226 16.725 54.387 -13.834 1.00 41.91 O ANISOU 2147 O LYS A 226 6698 5202 4022 692 668 -1975 O ATOM 2148 CB LYS A 226 15.449 51.581 -14.727 1.00 48.04 C ANISOU 2148 CB LYS A 226 7980 5274 4998 656 250 -2704 C ATOM 2149 CG LYS A 226 14.246 50.661 -14.711 1.00 55.91 C ANISOU 2149 CG LYS A 226 9207 5865 6172 467 -119 -2683 C ATOM 2150 CD LYS A 226 13.812 50.303 -16.132 1.00 56.65 C ANISOU 2150 CD LYS A 226 9560 6117 5848 224 -204 -3066 C ATOM 2151 CE LYS A 226 14.940 49.669 -16.935 1.00 64.34 C ANISOU 2151 CE LYS A 226 10481 7225 6738 334 142 -3564 C ATOM 2152 NZ LYS A 226 14.514 49.339 -18.320 1.00 76.39 N ANISOU 2152 NZ LYS A 226 12305 8938 7782 34 95 -3857 N ATOM 0 H LYS A 226 13.938 52.910 -13.327 1.00 37.37 H new ATOM 0 HA LYS A 226 16.064 51.542 -12.754 1.00 40.86 H new ATOM 0 HB2 LYS A 226 15.292 52.283 -15.377 1.00 48.04 H new ATOM 0 HB3 LYS A 226 16.219 51.077 -15.034 1.00 48.04 H new ATOM 0 HG2 LYS A 226 14.460 49.852 -14.221 1.00 55.91 H new ATOM 0 HG3 LYS A 226 13.512 51.090 -14.244 1.00 55.91 H new ATOM 0 HD2 LYS A 226 13.060 49.691 -16.094 1.00 56.65 H new ATOM 0 HD3 LYS A 226 13.504 51.103 -16.586 1.00 56.65 H new ATOM 0 HE2 LYS A 226 15.696 50.276 -16.965 1.00 64.34 H new ATOM 0 HE3 LYS A 226 15.241 48.862 -16.488 1.00 64.34 H new ATOM 0 HZ1 LYS A 226 15.194 48.971 -18.760 1.00 76.39 H new ATOM 0 HZ2 LYS A 226 13.834 48.765 -18.293 1.00 76.39 H new ATOM 0 HZ3 LYS A 226 14.258 50.082 -18.737 1.00 76.39 H new ATOM 2166 N GLU A 227 18.174 52.711 -13.515 1.00 40.31 N ANISOU 2166 N GLU A 227 8245 2423 4650 212 501 -801 N ATOM 2167 CA GLU A 227 19.334 53.585 -13.646 1.00 39.24 C ANISOU 2167 CA GLU A 227 7837 2651 4423 543 574 -825 C ATOM 2168 C GLU A 227 19.354 54.322 -14.986 1.00 37.60 C ANISOU 2168 C GLU A 227 7512 2718 4057 422 540 -986 C ATOM 2169 O GLU A 227 19.719 55.494 -15.029 1.00 36.09 O ANISOU 2169 O GLU A 227 7007 2886 3818 460 571 -922 O ATOM 2170 CB GLU A 227 20.643 52.799 -13.491 1.00 43.86 C ANISOU 2170 CB GLU A 227 8563 3150 4953 1001 677 -918 C ATOM 2171 CG GLU A 227 21.884 53.702 -13.571 1.00 45.76 C ANISOU 2171 CG GLU A 227 8460 3827 5098 1301 771 -978 C ATOM 2172 CD GLU A 227 23.183 52.962 -13.331 1.00 53.74 C ANISOU 2172 CD GLU A 227 9412 4927 6079 1698 814 -1037 C ATOM 2173 OE1 GLU A 227 23.148 51.724 -13.240 1.00 54.18 O ANISOU 2173 OE1 GLU A 227 9764 4667 6155 1787 779 -1046 O ATOM 2174 OE2 GLU A 227 24.234 53.623 -13.223 1.00 64.76 O ANISOU 2174 OE2 GLU A 227 10456 6719 7430 1889 878 -1081 O ATOM 0 H GLU A 227 18.359 51.880 -13.391 1.00 40.31 H new ATOM 0 HA GLU A 227 19.261 54.239 -12.934 1.00 39.24 H new ATOM 0 HB2 GLU A 227 20.639 52.334 -12.640 1.00 43.86 H new ATOM 0 HB3 GLU A 227 20.694 52.122 -14.184 1.00 43.86 H new ATOM 0 HG2 GLU A 227 21.915 54.121 -14.445 1.00 45.76 H new ATOM 0 HG3 GLU A 227 21.800 54.414 -12.918 1.00 45.76 H new ATOM 2181 N SER A 228 18.968 53.633 -16.059 1.00 41.13 N ANISOU 2181 N SER A 228 8239 2982 4407 270 483 -1194 N ATOM 2182 CA SER A 228 19.014 54.222 -17.390 1.00 41.04 C ANISOU 2182 CA SER A 228 8177 3221 4196 187 452 -1353 C ATOM 2183 C SER A 228 18.057 55.405 -17.472 1.00 41.89 C ANISOU 2183 C SER A 228 8003 3612 4302 -93 328 -1201 C ATOM 2184 O SER A 228 18.328 56.391 -18.164 1.00 44.48 O ANISOU 2184 O SER A 228 8191 4237 4472 -75 341 -1205 O ATOM 2185 CB SER A 228 18.684 53.177 -18.469 1.00 45.76 C ANISOU 2185 CB SER A 228 9087 3599 4699 70 386 -1600 C ATOM 2186 OG SER A 228 17.349 52.706 -18.369 1.00 52.51 O ANISOU 2186 OG SER A 228 10040 4257 5653 -306 242 -1593 O ATOM 0 H SER A 228 18.677 52.824 -16.035 1.00 41.13 H new ATOM 0 HA SER A 228 19.916 54.539 -17.554 1.00 41.04 H new ATOM 0 HB2 SER A 228 18.823 53.566 -19.347 1.00 45.76 H new ATOM 0 HB3 SER A 228 19.296 52.429 -18.390 1.00 45.76 H new ATOM 0 HG SER A 228 17.311 52.089 -17.801 1.00 52.51 H new ATOM 2192 N ASP A 229 16.945 55.316 -16.749 1.00 40.55 N ANISOU 2192 N ASP A 229 7763 3352 4291 -339 217 -1067 N ATOM 2193 CA ASP A 229 15.965 56.395 -16.744 1.00 41.77 C ANISOU 2193 CA ASP A 229 7638 3787 4444 -551 79 -938 C ATOM 2194 C ASP A 229 16.497 57.590 -15.969 1.00 42.93 C ANISOU 2194 C ASP A 229 7491 4178 4643 -377 156 -725 C ATOM 2195 O ASP A 229 16.327 58.721 -16.392 1.00 41.77 O ANISOU 2195 O ASP A 229 7188 4290 4392 -402 106 -667 O ATOM 2196 CB ASP A 229 14.632 55.920 -16.154 1.00 42.85 C ANISOU 2196 CB ASP A 229 7738 3811 4730 -869 -43 -889 C ATOM 2197 CG ASP A 229 13.900 54.960 -17.070 1.00 57.99 C ANISOU 2197 CG ASP A 229 9896 5561 6576 -1141 -151 -1137 C ATOM 2198 OD1 ASP A 229 14.323 54.809 -18.234 1.00 65.25 O ANISOU 2198 OD1 ASP A 229 10992 6494 7307 -1067 -163 -1338 O ATOM 2199 OD2 ASP A 229 12.899 54.358 -16.629 1.00 67.52 O ANISOU 2199 OD2 ASP A 229 11111 6640 7904 -1452 -213 -1148 O ATOM 0 H ASP A 229 16.740 54.642 -16.256 1.00 40.55 H new ATOM 0 HA ASP A 229 15.808 56.667 -17.662 1.00 41.77 H new ATOM 0 HB2 ASP A 229 14.795 55.487 -15.301 1.00 42.85 H new ATOM 0 HB3 ASP A 229 14.067 56.689 -15.979 1.00 42.85 H new ATOM 2204 N ILE A 230 17.143 57.337 -14.836 1.00 35.21 N ANISOU 2204 N ILE A 230 6464 3107 3808 -193 275 -618 N ATOM 2205 CA ILE A 230 17.748 58.399 -14.053 1.00 34.90 C ANISOU 2205 CA ILE A 230 6143 3301 3816 -30 356 -461 C ATOM 2206 C ILE A 230 18.805 59.142 -14.871 1.00 35.28 C ANISOU 2206 C ILE A 230 6148 3562 3693 110 469 -556 C ATOM 2207 O ILE A 230 18.775 60.366 -14.984 1.00 38.20 O ANISOU 2207 O ILE A 230 6348 4155 4012 58 470 -468 O ATOM 2208 CB ILE A 230 18.393 57.836 -12.763 1.00 32.88 C ANISOU 2208 CB ILE A 230 5870 2926 3698 195 459 -374 C ATOM 2209 CG1 ILE A 230 17.329 57.240 -11.820 1.00 33.22 C ANISOU 2209 CG1 ILE A 230 5952 2775 3895 19 386 -232 C ATOM 2210 CG2 ILE A 230 19.207 58.882 -12.072 1.00 32.70 C ANISOU 2210 CG2 ILE A 230 5551 3180 3695 376 549 -285 C ATOM 2211 CD1 ILE A 230 16.379 58.253 -11.218 1.00 36.41 C ANISOU 2211 CD1 ILE A 230 6053 3404 4376 -160 296 -65 C ATOM 0 H ILE A 230 17.241 56.550 -14.504 1.00 35.21 H new ATOM 0 HA ILE A 230 17.044 59.020 -13.807 1.00 34.90 H new ATOM 0 HB ILE A 230 18.991 57.116 -13.019 1.00 32.88 H new ATOM 0 HG12 ILE A 230 16.812 56.582 -12.310 1.00 33.22 H new ATOM 0 HG13 ILE A 230 17.779 56.769 -11.101 1.00 33.22 H new ATOM 0 HG21 ILE A 230 19.601 58.508 -11.268 1.00 32.70 H new ATOM 0 HG22 ILE A 230 19.912 59.188 -12.664 1.00 32.70 H new ATOM 0 HG23 ILE A 230 18.638 59.631 -11.834 1.00 32.70 H new ATOM 0 HD11 ILE A 230 15.745 57.799 -10.641 1.00 36.41 H new ATOM 0 HD12 ILE A 230 16.882 58.900 -10.699 1.00 36.41 H new ATOM 0 HD13 ILE A 230 15.900 58.710 -11.927 1.00 36.41 H new ATOM 2223 N ARG A 231 19.743 58.402 -15.439 1.00 35.25 N ANISOU 2223 N ARG A 231 6318 3484 3590 284 578 -741 N ATOM 2224 CA ARG A 231 20.809 59.023 -16.220 1.00 37.60 C ANISOU 2224 CA ARG A 231 6560 4018 3707 392 726 -855 C ATOM 2225 C ARG A 231 20.265 59.718 -17.469 1.00 45.50 C ANISOU 2225 C ARG A 231 7645 5131 4510 184 662 -878 C ATOM 2226 O ARG A 231 20.729 60.794 -17.846 1.00 45.87 O ANISOU 2226 O ARG A 231 7596 5400 4433 157 761 -839 O ATOM 2227 CB ARG A 231 21.860 57.986 -16.609 1.00 42.29 C ANISOU 2227 CB ARG A 231 7315 4537 4216 650 849 -1082 C ATOM 2228 CG ARG A 231 22.697 57.484 -15.438 1.00 40.93 C ANISOU 2228 CG ARG A 231 7040 4340 4172 962 932 -1070 C ATOM 2229 CD ARG A 231 24.019 56.892 -15.918 1.00 53.05 C ANISOU 2229 CD ARG A 231 8549 6001 5608 1242 1049 -1286 C ATOM 2230 NE ARG A 231 24.744 56.169 -14.871 1.00 61.07 N ANISOU 2230 NE ARG A 231 9456 6991 6755 1540 1042 -1256 N ATOM 2231 CZ ARG A 231 25.593 56.727 -14.011 1.00 48.50 C ANISOU 2231 CZ ARG A 231 7499 5695 5234 1658 1089 -1204 C ATOM 2232 NH1 ARG A 231 25.834 58.032 -14.043 1.00 55.37 N ANISOU 2232 NH1 ARG A 231 8073 6880 6085 1479 1166 -1180 N ATOM 2233 NH2 ARG A 231 26.202 55.974 -13.106 1.00 58.68 N ANISOU 2233 NH2 ARG A 231 8738 6954 6604 1926 1047 -1173 N ATOM 0 H ARG A 231 19.784 57.545 -15.388 1.00 35.25 H new ATOM 0 HA ARG A 231 21.223 59.700 -15.661 1.00 37.60 H new ATOM 0 HB2 ARG A 231 21.417 57.230 -17.026 1.00 42.29 H new ATOM 0 HB3 ARG A 231 22.450 58.371 -17.275 1.00 42.29 H new ATOM 0 HG2 ARG A 231 22.871 58.215 -14.825 1.00 40.93 H new ATOM 0 HG3 ARG A 231 22.199 56.813 -14.946 1.00 40.93 H new ATOM 0 HD2 ARG A 231 23.846 56.289 -16.658 1.00 53.05 H new ATOM 0 HD3 ARG A 231 24.581 57.606 -16.258 1.00 53.05 H new ATOM 0 HE ARG A 231 24.611 55.322 -14.807 1.00 61.07 H new ATOM 0 HH11 ARG A 231 25.440 58.528 -14.624 1.00 55.37 H new ATOM 0 HH12 ARG A 231 26.385 58.381 -13.482 1.00 55.37 H new ATOM 0 HH21 ARG A 231 26.048 55.128 -13.076 1.00 58.68 H new ATOM 0 HH22 ARG A 231 26.751 56.331 -12.549 1.00 58.68 H new ATOM 2247 N GLY A 232 19.270 59.105 -18.099 1.00 38.91 N ANISOU 2247 N GLY A 232 7009 4144 3632 30 496 -945 N ATOM 2248 CA GLY A 232 18.703 59.641 -19.323 1.00 45.17 C ANISOU 2248 CA GLY A 232 7906 5059 4197 -121 400 -986 C ATOM 2249 C GLY A 232 18.051 61.000 -19.149 1.00 37.65 C ANISOU 2249 C GLY A 232 6791 4283 3229 -221 311 -774 C ATOM 2250 O GLY A 232 17.959 61.767 -20.102 1.00 42.71 O ANISOU 2250 O GLY A 232 7524 5067 3637 -261 294 -762 O ATOM 0 H GLY A 232 18.909 58.373 -17.830 1.00 38.91 H new ATOM 0 HA2 GLY A 232 19.403 59.710 -19.991 1.00 45.17 H new ATOM 0 HA3 GLY A 232 18.044 59.017 -19.666 1.00 45.17 H new ATOM 2254 N GLN A 233 17.599 61.295 -17.935 1.00 37.92 N ANISOU 2254 N GLN A 233 6617 4301 3491 -238 258 -606 N ATOM 2255 CA GLN A 233 16.927 62.564 -17.657 1.00 41.09 C ANISOU 2255 CA GLN A 233 6871 4849 3894 -292 162 -418 C ATOM 2256 C GLN A 233 17.568 63.262 -16.466 1.00 31.70 C ANISOU 2256 C GLN A 233 5462 3710 2872 -200 298 -278 C ATOM 2257 O GLN A 233 16.886 63.867 -15.638 1.00 32.88 O ANISOU 2257 O GLN A 233 5442 3904 3148 -222 204 -132 O ATOM 2258 CB GLN A 233 15.429 62.338 -17.410 1.00 50.07 C ANISOU 2258 CB GLN A 233 7929 5981 5113 -429 -86 -383 C ATOM 2259 CG GLN A 233 15.055 61.578 -16.152 1.00 53.53 C ANISOU 2259 CG GLN A 233 8225 6296 5818 -479 -98 -339 C ATOM 2260 CD GLN A 233 13.674 60.929 -16.258 1.00 59.40 C ANISOU 2260 CD GLN A 233 8948 7026 6597 -697 -302 -409 C ATOM 2261 OE1 GLN A 233 13.021 60.993 -17.306 1.00 65.03 O ANISOU 2261 OE1 GLN A 233 9734 7844 7130 -785 -459 -522 O ATOM 2262 NE2 GLN A 233 13.223 60.309 -15.171 1.00 56.57 N ANISOU 2262 NE2 GLN A 233 8481 6565 6449 -797 -296 -353 N ATOM 0 H GLN A 233 17.671 60.773 -17.255 1.00 37.92 H new ATOM 0 HA GLN A 233 17.025 63.137 -18.433 1.00 41.09 H new ATOM 0 HB2 GLN A 233 14.992 63.204 -17.382 1.00 50.07 H new ATOM 0 HB3 GLN A 233 15.065 61.861 -18.172 1.00 50.07 H new ATOM 0 HG2 GLN A 233 15.720 60.893 -15.980 1.00 53.53 H new ATOM 0 HG3 GLN A 233 15.069 62.183 -15.394 1.00 53.53 H new ATOM 0 HE21 GLN A 233 13.705 60.284 -14.459 1.00 56.57 H new ATOM 0 HE22 GLN A 233 12.450 59.933 -15.180 1.00 56.57 H new ATOM 2271 N GLN A 234 18.890 63.191 -16.381 1.00 36.28 N ANISOU 2271 N GLN A 234 6024 4322 3438 -88 516 -351 N ATOM 2272 CA GLN A 234 19.566 63.694 -15.195 1.00 34.15 C ANISOU 2272 CA GLN A 234 5518 4130 3327 1 637 -271 C ATOM 2273 C GLN A 234 19.418 65.219 -15.048 1.00 34.46 C ANISOU 2273 C GLN A 234 5474 4285 3336 -74 651 -129 C ATOM 2274 O GLN A 234 19.231 65.714 -13.929 1.00 32.74 O ANISOU 2274 O GLN A 234 5059 4097 3282 -48 627 -21 O ATOM 2275 CB GLN A 234 21.037 63.300 -15.224 1.00 37.39 C ANISOU 2275 CB GLN A 234 5886 4622 3698 147 859 -428 C ATOM 2276 CG GLN A 234 21.724 63.449 -13.883 1.00 43.57 C ANISOU 2276 CG GLN A 234 6401 5503 4651 284 946 -398 C ATOM 2277 CD GLN A 234 23.033 62.688 -13.809 1.00 43.32 C ANISOU 2277 CD GLN A 234 6308 5566 4588 508 1107 -589 C ATOM 2278 OE1 GLN A 234 23.085 61.493 -14.096 1.00 51.34 O ANISOU 2278 OE1 GLN A 234 7493 6432 5583 644 1077 -693 O ATOM 2279 NE2 GLN A 234 24.095 63.376 -13.420 1.00 53.07 N ANISOU 2279 NE2 GLN A 234 7297 7058 5811 554 1275 -660 N ATOM 0 H GLN A 234 19.405 62.862 -16.986 1.00 36.28 H new ATOM 0 HA GLN A 234 19.142 63.290 -14.422 1.00 34.15 H new ATOM 0 HB2 GLN A 234 21.113 62.379 -15.518 1.00 37.39 H new ATOM 0 HB3 GLN A 234 21.499 63.846 -15.879 1.00 37.39 H new ATOM 0 HG2 GLN A 234 21.891 64.389 -13.712 1.00 43.57 H new ATOM 0 HG3 GLN A 234 21.131 63.134 -13.183 1.00 43.57 H new ATOM 0 HE21 GLN A 234 24.020 64.211 -13.228 1.00 53.07 H new ATOM 0 HE22 GLN A 234 24.860 62.988 -13.360 1.00 53.07 H new ATOM 2288 N GLN A 235 19.484 65.951 -16.163 1.00 33.42 N ANISOU 2288 N GLN A 235 5525 4194 2979 -158 691 -126 N ATOM 2289 CA GLN A 235 19.302 67.411 -16.145 1.00 37.70 C ANISOU 2289 CA GLN A 235 6096 4771 3459 -223 706 21 C ATOM 2290 C GLN A 235 17.987 67.771 -15.488 1.00 31.73 C ANISOU 2290 C GLN A 235 5255 3978 2822 -194 467 163 C ATOM 2291 O GLN A 235 17.912 68.674 -14.629 1.00 30.14 O ANISOU 2291 O GLN A 235 4929 3793 2730 -176 476 266 O ATOM 2292 CB GLN A 235 19.303 68.015 -17.555 1.00 37.21 C ANISOU 2292 CB GLN A 235 6341 4709 3087 -299 744 38 C ATOM 2293 CG GLN A 235 20.642 68.164 -18.227 1.00 48.43 C ANISOU 2293 CG GLN A 235 7813 6212 4377 -371 1019 -70 C ATOM 2294 CD GLN A 235 20.548 69.019 -19.492 1.00 54.04 C ANISOU 2294 CD GLN A 235 8744 6899 4889 -436 1007 10 C ATOM 2295 OE1 GLN A 235 20.091 70.166 -19.454 1.00 43.84 O ANISOU 2295 OE1 GLN A 235 7540 5527 3590 -456 947 168 O ATOM 2296 NE2 GLN A 235 20.967 68.455 -20.619 1.00 46.49 N ANISOU 2296 NE2 GLN A 235 7895 6003 3764 -444 1065 -102 N ATOM 0 H GLN A 235 19.634 65.622 -16.944 1.00 33.42 H new ATOM 0 HA GLN A 235 20.050 67.773 -15.645 1.00 37.70 H new ATOM 0 HB2 GLN A 235 18.740 67.464 -18.121 1.00 37.21 H new ATOM 0 HB3 GLN A 235 18.888 68.891 -17.509 1.00 37.21 H new ATOM 0 HG2 GLN A 235 21.271 68.568 -17.609 1.00 48.43 H new ATOM 0 HG3 GLN A 235 20.990 67.287 -18.454 1.00 48.43 H new ATOM 0 HE21 GLN A 235 21.280 67.654 -20.609 1.00 46.49 H new ATOM 0 HE22 GLN A 235 20.926 68.891 -21.359 1.00 46.49 H new ATOM 2305 N GLN A 236 16.938 67.076 -15.909 1.00 29.80 N ANISOU 2305 N GLN A 236 5066 3711 2546 -198 253 142 N ATOM 2306 CA GLN A 236 15.603 67.340 -15.392 1.00 25.51 C ANISOU 2306 CA GLN A 236 4400 3203 2087 -177 18 238 C ATOM 2307 C GLN A 236 15.494 66.974 -13.916 1.00 27.33 C ANISOU 2307 C GLN A 236 4352 3438 2593 -157 26 275 C ATOM 2308 O GLN A 236 14.884 67.702 -13.138 1.00 25.72 O ANISOU 2308 O GLN A 236 3995 3298 2478 -110 -57 379 O ATOM 2309 CB GLN A 236 14.561 66.575 -16.221 1.00 34.51 C ANISOU 2309 CB GLN A 236 5620 4372 3118 -231 -200 152 C ATOM 2310 CG GLN A 236 14.686 66.821 -17.730 1.00 50.33 C ANISOU 2310 CG GLN A 236 7919 6396 4808 -228 -218 101 C ATOM 2311 CD GLN A 236 15.603 65.826 -18.434 1.00 56.64 C ANISOU 2311 CD GLN A 236 8866 7126 5528 -282 -64 -66 C ATOM 2312 OE1 GLN A 236 16.822 65.983 -18.454 1.00 56.91 O ANISOU 2312 OE1 GLN A 236 8946 7136 5542 -267 180 -84 O ATOM 2313 NE2 GLN A 236 15.009 64.794 -19.013 1.00 53.72 N ANISOU 2313 NE2 GLN A 236 8557 6746 5106 -349 -206 -217 N ATOM 0 H GLN A 236 16.978 66.447 -16.494 1.00 29.80 H new ATOM 0 HA GLN A 236 15.430 68.291 -15.468 1.00 25.51 H new ATOM 0 HB2 GLN A 236 14.652 65.625 -16.046 1.00 34.51 H new ATOM 0 HB3 GLN A 236 13.672 66.833 -15.930 1.00 34.51 H new ATOM 0 HG2 GLN A 236 13.804 66.778 -18.132 1.00 50.33 H new ATOM 0 HG3 GLN A 236 15.021 67.719 -17.877 1.00 50.33 H new ATOM 0 HE21 GLN A 236 14.153 64.716 -18.979 1.00 53.72 H new ATOM 0 HE22 GLN A 236 15.479 64.202 -19.423 1.00 53.72 H new ATOM 2322 N LEU A 237 16.061 65.828 -13.540 1.00 27.25 N ANISOU 2322 N LEU A 237 4302 3358 2694 -165 121 190 N ATOM 2323 CA LEU A 237 16.033 65.386 -12.156 1.00 24.75 C ANISOU 2323 CA LEU A 237 3776 3032 2596 -125 144 241 C ATOM 2324 C LEU A 237 16.738 66.395 -11.252 1.00 22.44 C ANISOU 2324 C LEU A 237 3319 2828 2378 -33 264 310 C ATOM 2325 O LEU A 237 16.222 66.778 -10.207 1.00 22.14 O ANISOU 2325 O LEU A 237 3094 2854 2463 -1 207 402 O ATOM 2326 CB LEU A 237 16.677 64.005 -12.019 1.00 27.07 C ANISOU 2326 CB LEU A 237 4144 3194 2947 -92 239 144 C ATOM 2327 CG LEU A 237 16.776 63.503 -10.589 1.00 33.27 C ANISOU 2327 CG LEU A 237 4775 3952 3915 -11 280 218 C ATOM 2328 CD1 LEU A 237 15.385 63.472 -9.922 1.00 36.69 C ANISOU 2328 CD1 LEU A 237 5082 4410 4447 -135 131 327 C ATOM 2329 CD2 LEU A 237 17.424 62.132 -10.578 1.00 36.08 C ANISOU 2329 CD2 LEU A 237 5293 4129 4286 76 365 128 C ATOM 0 H LEU A 237 16.467 65.293 -14.077 1.00 27.25 H new ATOM 0 HA LEU A 237 15.106 65.322 -11.878 1.00 24.75 H new ATOM 0 HB2 LEU A 237 16.165 63.367 -12.540 1.00 27.07 H new ATOM 0 HB3 LEU A 237 17.567 64.035 -12.403 1.00 27.07 H new ATOM 0 HG LEU A 237 17.329 64.112 -10.074 1.00 33.27 H new ATOM 0 HD11 LEU A 237 15.470 63.149 -9.011 1.00 36.69 H new ATOM 0 HD12 LEU A 237 15.010 64.366 -9.914 1.00 36.69 H new ATOM 0 HD13 LEU A 237 14.800 62.881 -10.421 1.00 36.69 H new ATOM 0 HD21 LEU A 237 17.487 61.811 -9.665 1.00 36.08 H new ATOM 0 HD22 LEU A 237 16.887 61.516 -11.100 1.00 36.08 H new ATOM 0 HD23 LEU A 237 18.313 62.191 -10.962 1.00 36.08 H new ATOM 2341 N VAL A 238 17.914 66.835 -11.665 1.00 24.16 N ANISOU 2341 N VAL A 238 3597 3073 2509 -13 440 243 N ATOM 2342 CA VAL A 238 18.675 67.786 -10.868 1.00 22.27 C ANISOU 2342 CA VAL A 238 3199 2930 2332 23 571 258 C ATOM 2343 C VAL A 238 17.908 69.105 -10.710 1.00 22.81 C ANISOU 2343 C VAL A 238 3275 3002 2390 -7 478 376 C ATOM 2344 O VAL A 238 17.860 69.674 -9.611 1.00 24.38 O ANISOU 2344 O VAL A 238 3290 3261 2711 43 478 418 O ATOM 2345 CB VAL A 238 20.052 68.034 -11.500 1.00 27.84 C ANISOU 2345 CB VAL A 238 3959 3698 2919 -14 797 130 C ATOM 2346 CG1 VAL A 238 20.737 69.214 -10.852 1.00 28.86 C ANISOU 2346 CG1 VAL A 238 3948 3929 3088 -61 933 121 C ATOM 2347 CG2 VAL A 238 20.931 66.766 -11.360 1.00 28.41 C ANISOU 2347 CG2 VAL A 238 3962 3812 3020 110 888 -11 C ATOM 0 H VAL A 238 18.290 66.598 -12.401 1.00 24.16 H new ATOM 0 HA VAL A 238 18.805 67.406 -9.985 1.00 22.27 H new ATOM 0 HB VAL A 238 19.927 68.235 -12.441 1.00 27.84 H new ATOM 0 HG11 VAL A 238 21.603 69.353 -11.266 1.00 28.86 H new ATOM 0 HG12 VAL A 238 20.193 70.008 -10.969 1.00 28.86 H new ATOM 0 HG13 VAL A 238 20.855 69.040 -9.905 1.00 28.86 H new ATOM 0 HG21 VAL A 238 21.799 66.928 -11.761 1.00 28.41 H new ATOM 0 HG22 VAL A 238 21.044 66.552 -10.421 1.00 28.41 H new ATOM 0 HG23 VAL A 238 20.501 66.023 -11.811 1.00 28.41 H new ATOM 2357 N GLU A 239 17.296 69.595 -11.784 1.00 20.89 N ANISOU 2357 N GLU A 239 3258 2697 1982 -53 388 422 N ATOM 2358 CA GLU A 239 16.526 70.818 -11.669 1.00 19.66 C ANISOU 2358 CA GLU A 239 3156 2523 1792 -12 278 533 C ATOM 2359 C GLU A 239 15.302 70.628 -10.781 1.00 19.06 C ANISOU 2359 C GLU A 239 2863 2527 1851 78 73 592 C ATOM 2360 O GLU A 239 14.942 71.535 -10.056 1.00 21.36 O ANISOU 2360 O GLU A 239 3069 2847 2201 159 30 651 O ATOM 2361 CB GLU A 239 16.100 71.376 -13.027 1.00 22.70 C ANISOU 2361 CB GLU A 239 3864 2834 1927 -18 204 583 C ATOM 2362 CG GLU A 239 15.415 72.747 -12.922 1.00 23.55 C ANISOU 2362 CG GLU A 239 4096 2884 1969 88 99 704 C ATOM 2363 CD GLU A 239 16.260 73.813 -12.197 1.00 24.85 C ANISOU 2363 CD GLU A 239 4268 2962 2210 39 296 718 C ATOM 2364 OE1 GLU A 239 17.485 73.879 -12.460 1.00 25.58 O ANISOU 2364 OE1 GLU A 239 4431 3021 2267 -124 545 649 O ATOM 2365 OE2 GLU A 239 15.698 74.560 -11.357 1.00 24.79 O ANISOU 2365 OE2 GLU A 239 4178 2946 2296 154 204 769 O ATOM 0 H GLU A 239 17.315 69.242 -12.568 1.00 20.89 H new ATOM 0 HA GLU A 239 17.118 71.466 -11.255 1.00 19.66 H new ATOM 0 HB2 GLU A 239 16.880 71.452 -13.599 1.00 22.70 H new ATOM 0 HB3 GLU A 239 15.495 70.749 -13.454 1.00 22.70 H new ATOM 0 HG2 GLU A 239 15.207 73.064 -13.815 1.00 23.55 H new ATOM 0 HG3 GLU A 239 14.572 72.642 -12.454 1.00 23.55 H new ATOM 2372 N ASER A 240 14.636 69.480 -10.837 0.60 19.62 N ANISOU 2372 N ASER A 240 2853 2640 1963 48 -43 562 N ATOM 2373 N BSER A 240 14.689 69.444 -10.819 0.40 23.20 N ANISOU 2373 N BSER A 240 3303 3090 2420 46 -34 559 N ATOM 2374 CA ASER A 240 13.499 69.271 -9.951 0.60 21.77 C ANISOU 2374 CA ASER A 240 2889 3027 2357 80 -197 605 C ATOM 2375 CA BSER A 240 13.517 69.168 -9.989 0.40 22.90 C ANISOU 2375 CA BSER A 240 3036 3165 2499 71 -195 599 C ATOM 2376 C ASER A 240 13.930 69.308 -8.481 0.60 21.20 C ANISOU 2376 C ASER A 240 2590 3003 2463 129 -90 636 C ATOM 2377 C BSER A 240 13.882 69.185 -8.501 0.40 21.26 C ANISOU 2377 C BSER A 240 2595 3010 2473 121 -96 634 C ATOM 2378 O ASER A 240 13.223 69.838 -7.632 0.60 21.69 O ANISOU 2378 O ASER A 240 2470 3176 2593 203 -171 687 O ATOM 2379 O BSER A 240 13.078 69.598 -7.669 0.40 22.13 O ANISOU 2379 O BSER A 240 2516 3239 2653 183 -188 685 O ATOM 2380 CB ASER A 240 12.803 67.948 -10.260 0.60 22.32 C ANISOU 2380 CB ASER A 240 2930 3111 2441 -40 -295 547 C ATOM 2381 CB BSER A 240 12.865 67.824 -10.379 0.40 25.03 C ANISOU 2381 CB BSER A 240 3298 3439 2774 -53 -289 536 C ATOM 2382 OG ASER A 240 12.064 68.005 -11.470 0.60 28.81 O ANISOU 2382 OG ASER A 240 3887 3973 3088 -67 -461 500 O ATOM 2383 OG BSER A 240 13.632 66.675 -10.015 0.40 22.62 O ANISOU 2383 OG BSER A 240 3006 3022 2564 -111 -146 493 O ATOM 0 H ASER A 240 14.819 68.826 -11.365 0.60 23.20 H new ATOM 0 H BSER A 240 14.936 68.789 -11.318 0.40 23.20 H new ATOM 0 HA ASER A 240 12.872 69.995 -10.105 0.60 22.90 H new ATOM 0 HA BSER A 240 12.869 69.872 -10.148 0.40 22.90 H new ATOM 0 HB2ASER A 240 13.465 67.242 -10.319 0.60 25.03 H new ATOM 0 HB2BSER A 240 11.993 67.765 -9.959 0.40 25.03 H new ATOM 0 HB3ASER A 240 12.208 67.718 -9.529 0.60 25.03 H new ATOM 0 HB3BSER A 240 12.719 67.813 -11.338 0.40 25.03 H new ATOM 0 HG ASER A 240 11.313 68.352 -11.324 0.60 22.62 H new ATOM 0 HG BSER A 240 14.444 66.818 -10.175 0.40 22.62 H new ATOM 2394 N LEU A 241 15.100 68.758 -8.180 1.00 18.03 N ANISOU 2394 N LEU A 241 2187 2547 2114 120 84 589 N ATOM 2395 CA LEU A 241 15.620 68.813 -6.814 1.00 18.93 C ANISOU 2395 CA LEU A 241 2093 2741 2358 201 177 604 C ATOM 2396 C LEU A 241 15.928 70.263 -6.441 1.00 19.67 C ANISOU 2396 C LEU A 241 2143 2882 2450 253 219 603 C ATOM 2397 O LEU A 241 15.596 70.727 -5.345 1.00 20.47 O ANISOU 2397 O LEU A 241 2059 3085 2635 332 188 634 O ATOM 2398 CB LEU A 241 16.863 67.945 -6.654 1.00 20.90 C ANISOU 2398 CB LEU A 241 2352 2962 2628 238 333 528 C ATOM 2399 CG LEU A 241 16.575 66.444 -6.742 1.00 19.88 C ANISOU 2399 CG LEU A 241 2303 2729 2521 218 304 535 C ATOM 2400 CD1 LEU A 241 17.861 65.669 -6.881 1.00 21.31 C ANISOU 2400 CD1 LEU A 241 2559 2863 2676 319 445 436 C ATOM 2401 CD2 LEU A 241 15.782 65.945 -5.536 1.00 22.65 C ANISOU 2401 CD2 LEU A 241 2509 3121 2977 231 248 642 C ATOM 0 H ALEU A 241 15.606 68.351 -8.744 0.60 18.03 H new ATOM 0 H BLEU A 241 15.652 68.426 -8.750 0.40 18.03 H new ATOM 0 HA LEU A 241 14.942 68.463 -6.215 1.00 18.93 H new ATOM 0 HB2 LEU A 241 17.506 68.184 -7.339 1.00 20.90 H new ATOM 0 HB3 LEU A 241 17.276 68.138 -5.798 1.00 20.90 H new ATOM 0 HG LEU A 241 16.030 66.298 -7.531 1.00 19.88 H new ATOM 0 HD11 LEU A 241 17.663 64.721 -6.936 1.00 21.31 H new ATOM 0 HD12 LEU A 241 18.323 65.950 -7.687 1.00 21.31 H new ATOM 0 HD13 LEU A 241 18.425 65.837 -6.110 1.00 21.31 H new ATOM 0 HD21 LEU A 241 15.619 64.993 -5.627 1.00 22.65 H new ATOM 0 HD22 LEU A 241 16.288 66.110 -4.725 1.00 22.65 H new ATOM 0 HD23 LEU A 241 14.934 66.414 -5.489 1.00 22.65 H new ATOM 2414 N HIS A 242 16.503 70.998 -7.385 1.00 17.44 N ANISOU 2414 N HIS A 242 2062 2511 2055 194 295 564 N ATOM 2415 CA HIS A 242 16.722 72.437 -7.177 1.00 19.50 C ANISOU 2415 CA HIS A 242 2373 2740 2295 199 345 564 C ATOM 2416 C HIS A 242 15.419 73.179 -6.876 1.00 23.06 C ANISOU 2416 C HIS A 242 2814 3200 2749 317 155 652 C ATOM 2417 O HIS A 242 15.391 74.012 -5.974 1.00 20.42 O ANISOU 2417 O HIS A 242 2381 2896 2482 388 164 642 O ATOM 2418 CB HIS A 242 17.403 73.027 -8.406 1.00 18.94 C ANISOU 2418 CB HIS A 242 2597 2534 2064 76 469 538 C ATOM 2419 CG HIS A 242 17.628 74.506 -8.329 1.00 18.67 C ANISOU 2419 CG HIS A 242 2716 2389 1990 35 546 547 C ATOM 2420 ND1 HIS A 242 17.127 75.374 -9.280 1.00 19.56 N ANISOU 2420 ND1 HIS A 242 3178 2319 1935 42 493 641 N ATOM 2421 CD2 HIS A 242 18.330 75.263 -7.451 1.00 19.77 C ANISOU 2421 CD2 HIS A 242 2746 2550 2216 -19 676 464 C ATOM 2422 CE1 HIS A 242 17.503 76.607 -8.976 1.00 24.08 C ANISOU 2422 CE1 HIS A 242 3889 2758 2502 -14 602 631 C ATOM 2423 NE2 HIS A 242 18.215 76.568 -7.864 1.00 22.44 N ANISOU 2423 NE2 HIS A 242 3391 2679 2457 -71 712 510 N ATOM 0 H HIS A 242 16.772 70.695 -8.144 1.00 17.44 H new ATOM 0 HA HIS A 242 17.294 72.547 -6.401 1.00 19.50 H new ATOM 0 HB2 HIS A 242 18.257 72.586 -8.534 1.00 18.94 H new ATOM 0 HB3 HIS A 242 16.863 72.832 -9.188 1.00 18.94 H new ATOM 0 HD1 HIS A 242 16.649 75.150 -9.959 1.00 19.56 H new ATOM 0 HD2 HIS A 242 18.800 74.957 -6.709 1.00 19.77 H new ATOM 0 HE1 HIS A 242 17.300 77.372 -9.464 1.00 24.08 H new ATOM 2430 N LYS A 243 14.340 72.850 -7.589 1.00 19.60 N ANISOU 2430 N LYS A 243 2448 2768 2231 354 -23 708 N ATOM 2431 CA LYS A 243 13.027 73.444 -7.329 1.00 19.41 C ANISOU 2431 CA LYS A 243 2355 2829 2191 508 -227 760 C ATOM 2432 C LYS A 243 12.506 73.087 -5.919 1.00 22.14 C ANISOU 2432 C LYS A 243 2379 3332 2701 527 -244 708 C ATOM 2433 O LYS A 243 11.958 73.934 -5.222 1.00 25.92 O ANISOU 2433 O LYS A 243 2827 3809 3214 587 -278 628 O ATOM 2434 CB LYS A 243 12.033 72.997 -8.410 1.00 23.04 C ANISOU 2434 CB LYS A 243 2902 3335 2516 523 -417 776 C ATOM 2435 CG LYS A 243 10.627 73.522 -8.223 1.00 27.51 C ANISOU 2435 CG LYS A 243 3367 4001 3087 645 -616 722 C ATOM 2436 CD LYS A 243 9.691 73.087 -9.336 1.00 35.20 C ANISOU 2436 CD LYS A 243 4391 5060 3922 649 -808 702 C ATOM 2437 CE LYS A 243 8.323 73.727 -9.147 1.00 42.19 C ANISOU 2437 CE LYS A 243 5154 6034 4843 746 -958 634 C ATOM 2438 NZ LYS A 243 7.327 73.301 -10.161 1.00 57.37 N ANISOU 2438 NZ LYS A 243 7056 8105 6638 749 -1146 595 N ATOM 0 H LYS A 243 14.348 72.280 -8.233 1.00 19.60 H new ATOM 0 HA LYS A 243 13.119 74.409 -7.361 1.00 19.41 H new ATOM 0 HB2 LYS A 243 12.362 73.286 -9.276 1.00 23.04 H new ATOM 0 HB3 LYS A 243 12.005 72.028 -8.427 1.00 23.04 H new ATOM 0 HG2 LYS A 243 10.279 73.211 -7.372 1.00 27.51 H new ATOM 0 HG3 LYS A 243 10.649 74.491 -8.183 1.00 27.51 H new ATOM 0 HD2 LYS A 243 10.059 73.342 -10.196 1.00 35.20 H new ATOM 0 HD3 LYS A 243 9.607 72.121 -9.338 1.00 35.20 H new ATOM 0 HE2 LYS A 243 7.989 73.506 -8.263 1.00 42.19 H new ATOM 0 HE3 LYS A 243 8.417 74.692 -9.182 1.00 42.19 H new ATOM 0 HZ1 LYS A 243 6.550 73.705 -10.002 1.00 57.37 H new ATOM 0 HZ2 LYS A 243 7.616 73.524 -10.973 1.00 57.37 H new ATOM 0 HZ3 LYS A 243 7.217 72.419 -10.117 1.00 57.37 H new ATOM 2452 N VAL A 244 12.681 71.835 -5.489 1.00 21.09 N ANISOU 2452 N VAL A 244 2104 3260 2649 424 -184 698 N ATOM 2453 CA VAL A 244 12.237 71.422 -4.169 1.00 19.10 C ANISOU 2453 CA VAL A 244 1742 3040 2474 365 -139 605 C ATOM 2454 C VAL A 244 12.899 72.275 -3.069 1.00 20.59 C ANISOU 2454 C VAL A 244 1956 3182 2685 389 -52 520 C ATOM 2455 O VAL A 244 12.287 72.555 -2.025 1.00 22.37 O ANISOU 2455 O VAL A 244 2149 3438 2914 394 -64 470 O ATOM 2456 CB VAL A 244 12.540 69.906 -3.960 1.00 23.61 C ANISOU 2456 CB VAL A 244 2257 3624 3089 278 -80 659 C ATOM 2457 CG1 VAL A 244 12.460 69.526 -2.486 1.00 29.76 C ANISOU 2457 CG1 VAL A 244 3027 4393 3888 256 -19 607 C ATOM 2458 CG2 VAL A 244 11.584 69.092 -4.783 1.00 26.42 C ANISOU 2458 CG2 VAL A 244 2542 4060 3436 202 -211 727 C ATOM 0 H VAL A 244 13.055 71.214 -5.951 1.00 21.09 H new ATOM 0 HA VAL A 244 11.279 71.560 -4.106 1.00 19.10 H new ATOM 0 HB VAL A 244 13.446 69.721 -4.252 1.00 23.61 H new ATOM 0 HG11 VAL A 244 12.652 68.581 -2.384 1.00 29.76 H new ATOM 0 HG12 VAL A 244 13.108 70.043 -1.983 1.00 29.76 H new ATOM 0 HG13 VAL A 244 11.569 69.712 -2.152 1.00 29.76 H new ATOM 0 HG21 VAL A 244 11.769 68.148 -4.656 1.00 26.42 H new ATOM 0 HG22 VAL A 244 10.674 69.283 -4.506 1.00 26.42 H new ATOM 0 HG23 VAL A 244 11.690 69.318 -5.720 1.00 26.42 H new ATOM 2468 N LEU A 245 14.137 72.681 -3.330 1.00 19.46 N ANISOU 2468 N LEU A 245 2429 2816 2150 336 414 293 N ATOM 2469 CA LEU A 245 14.922 73.524 -2.436 1.00 18.91 C ANISOU 2469 CA LEU A 245 2456 2750 1979 367 417 285 C ATOM 2470 C LEU A 245 14.548 75.012 -2.498 1.00 19.04 C ANISOU 2470 C LEU A 245 2394 2733 2106 398 379 242 C ATOM 2471 O LEU A 245 15.128 75.813 -1.752 1.00 20.01 O ANISOU 2471 O LEU A 245 2602 2842 2158 418 372 218 O ATOM 2472 CB LEU A 245 16.405 73.377 -2.757 1.00 20.99 C ANISOU 2472 CB LEU A 245 2780 3057 2137 383 297 336 C ATOM 2473 CG LEU A 245 17.018 72.024 -2.371 1.00 23.48 C ANISOU 2473 CG LEU A 245 3192 3364 2366 386 300 364 C ATOM 2474 CD1 LEU A 245 18.266 71.745 -3.150 1.00 23.47 C ANISOU 2474 CD1 LEU A 245 3143 3395 2379 409 204 378 C ATOM 2475 CD2 LEU A 245 17.301 71.928 -0.901 1.00 21.92 C ANISOU 2475 CD2 LEU A 245 3175 3112 2041 390 312 366 C ATOM 0 H LEU A 245 14.554 72.468 -4.051 1.00 19.46 H new ATOM 0 HA LEU A 245 14.723 73.218 -1.537 1.00 18.91 H new ATOM 0 HB2 LEU A 245 16.532 73.515 -3.709 1.00 20.99 H new ATOM 0 HB3 LEU A 245 16.893 74.080 -2.301 1.00 20.99 H new ATOM 0 HG LEU A 245 16.355 71.352 -2.593 1.00 23.48 H new ATOM 0 HD11 LEU A 245 18.628 70.885 -2.884 1.00 23.47 H new ATOM 0 HD12 LEU A 245 18.059 71.729 -4.098 1.00 23.47 H new ATOM 0 HD13 LEU A 245 18.920 72.440 -2.974 1.00 23.47 H new ATOM 0 HD21 LEU A 245 17.686 71.060 -0.701 1.00 21.92 H new ATOM 0 HD22 LEU A 245 17.925 72.625 -0.645 1.00 21.92 H new ATOM 0 HD23 LEU A 245 16.475 72.036 -0.404 1.00 21.92 H new ATOM 2487 N GLY A 246 13.611 75.370 -3.361 1.00 19.09 N ANISOU 2487 N GLY A 246 2254 2703 2297 403 317 228 N ATOM 2488 CA GLY A 246 13.185 76.759 -3.509 1.00 20.52 C ANISOU 2488 CA GLY A 246 2355 2810 2633 447 234 191 C ATOM 2489 C GLY A 246 13.617 77.415 -4.814 1.00 20.67 C ANISOU 2489 C GLY A 246 2390 2814 2650 434 6 279 C ATOM 2490 O GLY A 246 13.135 78.507 -5.158 1.00 20.20 O ANISOU 2490 O GLY A 246 2275 2655 2743 467 -124 271 O ATOM 0 H GLY A 246 13.202 74.818 -3.879 1.00 19.09 H new ATOM 0 HA2 GLY A 246 12.218 76.798 -3.445 1.00 20.52 H new ATOM 0 HA3 GLY A 246 13.539 77.275 -2.768 1.00 20.52 H new ATOM 2494 N GLY A 247 14.533 76.774 -5.542 1.00 19.38 N ANISOU 2494 N GLY A 247 2321 2728 2316 380 -32 356 N ATOM 2495 CA GLY A 247 14.899 77.264 -6.853 1.00 20.74 C ANISOU 2495 CA GLY A 247 2566 2882 2433 327 -190 439 C ATOM 2496 C GLY A 247 15.748 78.532 -6.923 1.00 20.39 C ANISOU 2496 C GLY A 247 2594 2804 2348 301 -249 483 C ATOM 2497 O GLY A 247 15.917 79.071 -8.011 1.00 21.82 O ANISOU 2497 O GLY A 247 2875 2939 2476 232 -372 564 O ATOM 0 H GLY A 247 14.946 76.062 -5.291 1.00 19.38 H new ATOM 0 HA2 GLY A 247 15.379 76.557 -7.313 1.00 20.74 H new ATOM 0 HA3 GLY A 247 14.082 77.423 -7.351 1.00 20.74 H new ATOM 2501 N HIS A 248 16.297 78.996 -5.810 1.00 20.36 N ANISOU 2501 N HIS A 248 2577 2808 2351 335 -174 437 N ATOM 2502 CA HIS A 248 17.073 80.237 -5.865 1.00 19.10 C ANISOU 2502 CA HIS A 248 2473 2594 2189 297 -246 472 C ATOM 2503 C HIS A 248 18.436 80.008 -6.509 1.00 19.81 C ANISOU 2503 C HIS A 248 2617 2755 2155 195 -202 532 C ATOM 2504 O HIS A 248 18.953 78.891 -6.480 1.00 20.45 O ANISOU 2504 O HIS A 248 2670 2929 2170 192 -102 511 O ATOM 2505 CB HIS A 248 17.264 80.812 -4.467 1.00 20.47 C ANISOU 2505 CB HIS A 248 2637 2736 2404 354 -203 384 C ATOM 2506 CG HIS A 248 16.071 81.524 -3.931 1.00 21.51 C ANISOU 2506 CG HIS A 248 2720 2757 2697 437 -216 300 C ATOM 2507 ND1 HIS A 248 16.175 82.537 -2.998 1.00 29.29 N ANISOU 2507 ND1 HIS A 248 3741 3656 3733 475 -215 216 N ATOM 2508 CD2 HIS A 248 14.752 81.407 -4.215 1.00 22.41 C ANISOU 2508 CD2 HIS A 248 2728 2811 2975 493 -230 263 C ATOM 2509 CE1 HIS A 248 14.970 83.006 -2.724 1.00 26.17 C ANISOU 2509 CE1 HIS A 248 3262 3155 3527 558 -192 119 C ATOM 2510 NE2 HIS A 248 14.088 82.342 -3.448 1.00 23.67 N ANISOU 2510 NE2 HIS A 248 2834 2850 3309 572 -207 146 N ATOM 0 H HIS A 248 16.239 78.627 -5.036 1.00 20.36 H new ATOM 0 HA HIS A 248 16.575 80.868 -6.407 1.00 19.10 H new ATOM 0 HB2 HIS A 248 17.497 80.091 -3.861 1.00 20.47 H new ATOM 0 HB3 HIS A 248 18.015 81.426 -4.481 1.00 20.47 H new ATOM 0 HD2 HIS A 248 14.367 80.809 -4.814 1.00 22.41 H new ATOM 0 HE1 HIS A 248 14.776 83.688 -2.123 1.00 26.17 H new ATOM 0 HE2 HIS A 248 13.238 82.471 -3.442 1.00 23.67 H new ATOM 2517 N GLN A 249 19.040 81.063 -7.046 1.00 19.42 N ANISOU 2517 N GLN A 249 2633 2644 2103 106 -259 595 N ATOM 2518 CA GLN A 249 20.327 80.901 -7.712 1.00 18.99 C ANISOU 2518 CA GLN A 249 2601 2645 1970 -17 -155 632 C ATOM 2519 C GLN A 249 21.493 80.786 -6.718 1.00 21.38 C ANISOU 2519 C GLN A 249 2782 2992 2351 -2 -96 561 C ATOM 2520 O GLN A 249 22.635 80.564 -7.120 1.00 26.71 O ANISOU 2520 O GLN A 249 3395 3707 3046 -89 9 555 O ATOM 2521 CB GLN A 249 20.602 82.031 -8.695 1.00 22.69 C ANISOU 2521 CB GLN A 249 3210 3016 2397 -161 -205 736 C ATOM 2522 CG GLN A 249 20.723 83.404 -8.105 1.00 22.58 C ANISOU 2522 CG GLN A 249 3200 2878 2501 -166 -319 749 C ATOM 2523 CD GLN A 249 21.202 84.408 -9.096 1.00 19.56 C ANISOU 2523 CD GLN A 249 2980 2388 2065 -345 -341 869 C ATOM 2524 OE1 GLN A 249 20.745 84.461 -10.245 1.00 21.90 O ANISOU 2524 OE1 GLN A 249 3471 2628 2221 -429 -392 973 O ATOM 2525 NE2 GLN A 249 22.156 85.232 -8.675 1.00 24.92 N ANISOU 2525 NE2 GLN A 249 3611 3015 2842 -427 -317 862 N ATOM 0 H GLN A 249 18.730 81.865 -7.037 1.00 19.42 H new ATOM 0 HA GLN A 249 20.266 80.067 -8.203 1.00 18.99 H new ATOM 0 HB2 GLN A 249 21.423 81.829 -9.170 1.00 22.69 H new ATOM 0 HB3 GLN A 249 19.890 82.043 -9.353 1.00 22.69 H new ATOM 0 HG2 GLN A 249 19.861 83.681 -7.758 1.00 22.58 H new ATOM 0 HG3 GLN A 249 21.336 83.377 -7.353 1.00 22.58 H new ATOM 0 HE21 GLN A 249 22.453 85.170 -7.870 1.00 24.92 H new ATOM 0 HE22 GLN A 249 22.476 85.827 -9.207 1.00 24.92 H new ATOM 2534 N THR A 250 21.214 80.929 -5.440 1.00 22.29 N ANISOU 2534 N THR A 250 2867 3083 2519 100 -166 496 N ATOM 2535 CA THR A 250 22.226 80.733 -4.424 1.00 22.74 C ANISOU 2535 CA THR A 250 2856 3155 2630 123 -189 432 C ATOM 2536 C THR A 250 22.428 79.268 -4.035 1.00 22.63 C ANISOU 2536 C THR A 250 2799 3218 2583 193 -144 393 C ATOM 2537 O THR A 250 23.321 78.984 -3.252 1.00 25.09 O ANISOU 2537 O THR A 250 3062 3519 2952 218 -217 349 O ATOM 2538 CB THR A 250 21.880 81.516 -3.146 1.00 24.28 C ANISOU 2538 CB THR A 250 3121 3267 2837 186 -297 371 C ATOM 2539 OG1 THR A 250 20.534 81.239 -2.768 1.00 23.76 O ANISOU 2539 OG1 THR A 250 3118 3196 2714 274 -252 339 O ATOM 2540 CG2 THR A 250 22.031 82.994 -3.375 1.00 25.42 C ANISOU 2540 CG2 THR A 250 3293 3301 3062 117 -376 393 C ATOM 0 H THR A 250 20.438 81.141 -5.136 1.00 22.29 H new ATOM 0 HA THR A 250 23.048 81.059 -4.822 1.00 22.74 H new ATOM 0 HB THR A 250 22.487 81.241 -2.441 1.00 24.28 H new ATOM 0 HG1 THR A 250 20.516 80.965 -1.974 1.00 23.76 H new ATOM 0 HG21 THR A 250 21.809 83.472 -2.561 1.00 25.42 H new ATOM 0 HG22 THR A 250 22.947 83.191 -3.626 1.00 25.42 H new ATOM 0 HG23 THR A 250 21.434 83.274 -4.086 1.00 25.42 H new ATOM 2548 N LEU A 251 21.602 78.365 -4.563 1.00 21.53 N ANISOU 2548 N LEU A 251 2685 3127 2368 223 -64 411 N ATOM 2549 CA LEU A 251 21.730 76.926 -4.315 1.00 20.12 C ANISOU 2549 CA LEU A 251 2486 2995 2164 281 -23 383 C ATOM 2550 C LEU A 251 21.934 76.158 -5.604 1.00 21.28 C ANISOU 2550 C LEU A 251 2591 3194 2299 236 89 391 C ATOM 2551 O LEU A 251 21.221 76.375 -6.578 1.00 23.04 O ANISOU 2551 O LEU A 251 2878 3423 2452 183 124 431 O ATOM 2552 CB LEU A 251 20.491 76.357 -3.613 1.00 19.41 C ANISOU 2552 CB LEU A 251 2485 2895 1996 346 -7 373 C ATOM 2553 CG LEU A 251 20.166 76.887 -2.223 1.00 21.49 C ANISOU 2553 CG LEU A 251 2847 3101 2216 385 -51 335 C ATOM 2554 CD1 LEU A 251 18.908 76.211 -1.690 1.00 25.09 C ANISOU 2554 CD1 LEU A 251 3377 3548 2608 413 55 315 C ATOM 2555 CD2 LEU A 251 21.317 76.693 -1.243 1.00 24.18 C ANISOU 2555 CD2 LEU A 251 3238 3409 2541 404 -174 314 C ATOM 0 H LEU A 251 20.946 78.571 -5.080 1.00 21.53 H new ATOM 0 HA LEU A 251 22.505 76.821 -3.742 1.00 20.12 H new ATOM 0 HB2 LEU A 251 19.723 76.520 -4.183 1.00 19.41 H new ATOM 0 HB3 LEU A 251 20.598 75.395 -3.549 1.00 19.41 H new ATOM 0 HG LEU A 251 20.017 77.842 -2.306 1.00 21.49 H new ATOM 0 HD11 LEU A 251 18.707 76.553 -0.805 1.00 25.09 H new ATOM 0 HD12 LEU A 251 18.164 76.396 -2.284 1.00 25.09 H new ATOM 0 HD13 LEU A 251 19.051 75.253 -1.641 1.00 25.09 H new ATOM 0 HD21 LEU A 251 21.065 77.044 -0.374 1.00 24.18 H new ATOM 0 HD22 LEU A 251 21.518 75.747 -1.163 1.00 24.18 H new ATOM 0 HD23 LEU A 251 22.101 77.164 -1.567 1.00 24.18 H new ATOM 2567 N THR A 252 22.878 75.221 -5.583 1.00 21.08 N ANISOU 2567 N THR A 252 2476 3185 2348 262 125 342 N ATOM 2568 CA THR A 252 23.156 74.390 -6.741 1.00 23.82 C ANISOU 2568 CA THR A 252 2793 3569 2688 227 269 309 C ATOM 2569 C THR A 252 23.249 72.935 -6.311 1.00 23.16 C ANISOU 2569 C THR A 252 2682 3469 2650 327 253 260 C ATOM 2570 O THR A 252 24.091 72.586 -5.496 1.00 24.25 O ANISOU 2570 O THR A 252 2729 3561 2924 397 160 223 O ATOM 2571 CB THR A 252 24.472 74.799 -7.424 1.00 26.96 C ANISOU 2571 CB THR A 252 3062 3974 3208 139 395 261 C ATOM 2572 OG1 THR A 252 24.454 76.204 -7.722 1.00 28.57 O ANISOU 2572 OG1 THR A 252 3319 4164 3374 27 393 326 O ATOM 2573 CG2 THR A 252 24.670 74.032 -8.714 1.00 27.13 C ANISOU 2573 CG2 THR A 252 3105 4028 3175 79 607 203 C ATOM 0 H THR A 252 23.371 75.052 -4.899 1.00 21.08 H new ATOM 0 HA THR A 252 22.432 74.509 -7.376 1.00 23.82 H new ATOM 0 HB THR A 252 25.200 74.596 -6.816 1.00 26.96 H new ATOM 0 HG1 THR A 252 24.745 76.634 -7.062 1.00 28.57 H new ATOM 0 HG21 THR A 252 25.504 74.304 -9.128 1.00 27.13 H new ATOM 0 HG22 THR A 252 24.699 73.081 -8.524 1.00 27.13 H new ATOM 0 HG23 THR A 252 23.934 74.218 -9.318 1.00 27.13 H new ATOM 2581 N VAL A 253 22.388 72.098 -6.883 1.00 21.35 N ANISOU 2581 N VAL A 253 2541 3251 2319 329 307 262 N ATOM 2582 CA VAL A 253 22.431 70.648 -6.675 1.00 21.26 C ANISOU 2582 CA VAL A 253 2528 3200 2350 407 304 216 C ATOM 2583 C VAL A 253 23.486 69.983 -7.555 1.00 21.47 C ANISOU 2583 C VAL A 253 2447 3220 2490 410 437 107 C ATOM 2584 O VAL A 253 23.543 70.219 -8.764 1.00 24.11 O ANISOU 2584 O VAL A 253 2817 3599 2747 316 597 71 O ATOM 2585 CB VAL A 253 21.038 70.003 -6.970 1.00 21.25 C ANISOU 2585 CB VAL A 253 2653 3193 2228 390 309 247 C ATOM 2586 CG1 VAL A 253 21.084 68.499 -6.746 1.00 23.64 C ANISOU 2586 CG1 VAL A 253 2975 3429 2580 456 300 207 C ATOM 2587 CG2 VAL A 253 19.965 70.626 -6.121 1.00 20.43 C ANISOU 2587 CG2 VAL A 253 2606 3083 2073 386 238 317 C ATOM 0 H VAL A 253 21.757 72.355 -7.407 1.00 21.35 H new ATOM 0 HA VAL A 253 22.666 70.503 -5.745 1.00 21.26 H new ATOM 0 HB VAL A 253 20.823 70.170 -7.901 1.00 21.25 H new ATOM 0 HG11 VAL A 253 20.212 68.117 -6.934 1.00 23.64 H new ATOM 0 HG12 VAL A 253 21.744 68.104 -7.337 1.00 23.64 H new ATOM 0 HG13 VAL A 253 21.325 68.316 -5.824 1.00 23.64 H new ATOM 0 HG21 VAL A 253 19.112 70.211 -6.321 1.00 20.43 H new ATOM 0 HG22 VAL A 253 20.176 70.494 -5.184 1.00 20.43 H new ATOM 0 HG23 VAL A 253 19.914 71.576 -6.310 1.00 20.43 H new ATOM 2597 N ASN A 254 24.348 69.169 -6.918 1.00 22.80 N ANISOU 2597 N ASN A 254 2500 3314 2850 516 366 47 N ATOM 2598 CA ASN A 254 25.398 68.423 -7.604 1.00 25.93 C ANISOU 2598 CA ASN A 254 2737 3671 3443 553 498 -97 C ATOM 2599 C ASN A 254 25.193 66.942 -7.394 1.00 30.10 C ANISOU 2599 C ASN A 254 3312 4099 4026 659 430 -137 C ATOM 2600 O ASN A 254 24.840 66.510 -6.299 1.00 25.43 O ANISOU 2600 O ASN A 254 2806 3431 3424 729 221 -53 O ATOM 2601 CB ASN A 254 26.781 68.814 -7.095 1.00 24.06 C ANISOU 2601 CB ASN A 254 2249 3387 3506 600 438 -162 C ATOM 2602 CG ASN A 254 27.190 70.204 -7.510 1.00 32.82 C ANISOU 2602 CG ASN A 254 3284 4575 4612 468 558 -151 C ATOM 2603 OD1 ASN A 254 27.912 70.384 -8.484 1.00 39.21 O ANISOU 2603 OD1 ASN A 254 3969 5409 5520 385 813 -255 O ATOM 2604 ND2 ASN A 254 26.740 71.200 -6.758 1.00 30.42 N ANISOU 2604 ND2 ASN A 254 3072 4291 4194 437 396 -32 N ATOM 0 H ASN A 254 24.332 69.040 -6.068 1.00 22.80 H new ATOM 0 HA ASN A 254 25.346 68.637 -8.549 1.00 25.93 H new ATOM 0 HB2 ASN A 254 26.793 68.754 -6.127 1.00 24.06 H new ATOM 0 HB3 ASN A 254 27.434 68.178 -7.426 1.00 24.06 H new ATOM 0 HD21 ASN A 254 26.953 72.012 -6.947 1.00 30.42 H new ATOM 0 HD22 ASN A 254 26.235 71.034 -6.082 1.00 30.42 H new ATOM 2611 N VAL A 255 25.415 66.171 -8.445 1.00 26.15 N ANISOU 2611 N VAL A 255 2789 3581 3564 657 617 -268 N ATOM 2612 CA VAL A 255 25.353 64.715 -8.343 1.00 25.21 C ANISOU 2612 CA VAL A 255 2699 3334 3544 765 557 -332 C ATOM 2613 C VAL A 255 26.750 64.153 -8.106 1.00 30.11 C ANISOU 2613 C VAL A 255 3060 3830 4550 903 528 -476 C ATOM 2614 O VAL A 255 27.655 64.338 -8.918 1.00 32.63 O ANISOU 2614 O VAL A 255 3186 4171 5041 884 763 -640 O ATOM 2615 CB VAL A 255 24.733 64.089 -9.601 1.00 27.44 C ANISOU 2615 CB VAL A 255 3131 3636 3661 694 748 -419 C ATOM 2616 CG1 VAL A 255 24.724 62.582 -9.489 1.00 29.20 C ANISOU 2616 CG1 VAL A 255 3380 3699 4016 806 681 -500 C ATOM 2617 CG2 VAL A 255 23.319 64.615 -9.801 1.00 29.77 C ANISOU 2617 CG2 VAL A 255 3644 4018 3649 572 702 -281 C ATOM 0 H VAL A 255 25.604 66.467 -9.230 1.00 26.15 H new ATOM 0 HA VAL A 255 24.784 64.489 -7.591 1.00 25.21 H new ATOM 0 HB VAL A 255 25.270 64.335 -10.370 1.00 27.44 H new ATOM 0 HG11 VAL A 255 24.330 62.200 -10.289 1.00 29.20 H new ATOM 0 HG12 VAL A 255 25.633 62.259 -9.391 1.00 29.20 H new ATOM 0 HG13 VAL A 255 24.202 62.318 -8.715 1.00 29.20 H new ATOM 0 HG21 VAL A 255 22.934 64.215 -10.597 1.00 29.77 H new ATOM 0 HG22 VAL A 255 22.776 64.386 -9.030 1.00 29.77 H new ATOM 0 HG23 VAL A 255 23.344 65.579 -9.904 1.00 29.77 H new ATOM 2627 N GLU A 256 26.904 63.474 -6.970 1.00 26.93 N ANISOU 2627 N GLU A 256 2662 3278 4294 1032 234 -416 N ATOM 2628 CA GLU A 256 28.157 62.846 -6.560 1.00 30.42 C ANISOU 2628 CA GLU A 256 2858 3544 5157 1197 85 -535 C ATOM 2629 C GLU A 256 28.322 61.470 -7.191 1.00 34.94 C ANISOU 2629 C GLU A 256 3400 3972 5903 1298 173 -695 C ATOM 2630 O GLU A 256 29.431 61.057 -7.511 1.00 37.74 O ANISOU 2630 O GLU A 256 3524 4243 6573 1363 230 -853 O ATOM 2631 CB GLU A 256 28.198 62.720 -5.030 1.00 32.45 C ANISOU 2631 CB GLU A 256 3221 3663 5446 1282 -337 -375 C ATOM 2632 CG GLU A 256 29.388 61.909 -4.472 1.00 38.31 C ANISOU 2632 CG GLU A 256 3796 4184 6576 1427 -599 -448 C ATOM 2633 CD GLU A 256 30.721 62.609 -4.645 1.00 61.78 C ANISOU 2633 CD GLU A 256 6449 7195 9829 1393 -548 -563 C ATOM 2634 OE1 GLU A 256 30.731 63.812 -4.978 1.00 57.47 O ANISOU 2634 OE1 GLU A 256 5807 6811 9218 1296 -378 -568 O ATOM 2635 OE2 GLU A 256 31.764 61.950 -4.444 1.00 65.91 O ANISOU 2635 OE2 GLU A 256 6816 7567 10658 1455 -687 -654 O ATOM 0 H GLU A 256 26.266 63.364 -6.403 1.00 26.93 H new ATOM 0 HA GLU A 256 28.887 63.407 -6.864 1.00 30.42 H new ATOM 0 HB2 GLU A 256 28.223 63.611 -4.646 1.00 32.45 H new ATOM 0 HB3 GLU A 256 27.373 62.306 -4.731 1.00 32.45 H new ATOM 0 HG2 GLU A 256 29.240 61.736 -3.529 1.00 38.31 H new ATOM 0 HG3 GLU A 256 29.422 61.048 -4.917 1.00 38.31 H new ATOM 2642 N GLY A 257 27.215 60.751 -7.341 1.00 31.61 N ANISOU 2642 N GLY A 257 3256 3532 5222 1257 173 -623 N ATOM 2643 CA GLY A 257 27.254 59.412 -7.914 1.00 32.37 C ANISOU 2643 CA GLY A 257 3373 3472 5456 1343 234 -772 C ATOM 2644 C GLY A 257 25.862 58.873 -8.193 1.00 28.65 C ANISOU 2644 C GLY A 257 3217 3018 4651 1237 259 -679 C ATOM 2645 O GLY A 257 24.880 59.349 -7.617 1.00 27.82 O ANISOU 2645 O GLY A 257 3296 2998 4277 1132 161 -479 O ATOM 0 H GLY A 257 26.430 61.021 -7.117 1.00 31.61 H new ATOM 0 HA2 GLY A 257 27.765 59.428 -8.738 1.00 32.37 H new ATOM 0 HA3 GLY A 257 27.716 58.814 -7.306 1.00 32.37 H new ATOM 2649 N VAL A 258 25.795 57.902 -9.101 1.00 34.09 N ANISOU 2649 N VAL A 258 3948 3617 5389 1260 404 -850 N ATOM 2650 CA VAL A 258 24.567 57.190 -9.432 1.00 31.85 C ANISOU 2650 CA VAL A 258 3935 3298 4868 1168 395 -800 C ATOM 2651 C VAL A 258 24.907 55.709 -9.489 1.00 38.04 C ANISOU 2651 C VAL A 258 4730 3814 5908 1307 315 -936 C ATOM 2652 O VAL A 258 25.875 55.312 -10.151 1.00 38.86 O ANISOU 2652 O VAL A 258 4658 3836 6272 1418 472 -1184 O ATOM 2653 CB VAL A 258 23.971 57.644 -10.781 1.00 29.33 C ANISOU 2653 CB VAL A 258 3729 3148 4266 1008 661 -891 C ATOM 2654 CG1 VAL A 258 22.716 56.837 -11.114 1.00 33.05 C ANISOU 2654 CG1 VAL A 258 4452 3550 4555 916 593 -857 C ATOM 2655 CG2 VAL A 258 23.666 59.113 -10.754 1.00 29.45 C ANISOU 2655 CG2 VAL A 258 3738 3388 4063 884 709 -755 C ATOM 0 H VAL A 258 26.478 57.634 -9.550 1.00 34.09 H new ATOM 0 HA VAL A 258 23.897 57.379 -8.757 1.00 31.85 H new ATOM 0 HB VAL A 258 24.628 57.482 -11.476 1.00 29.33 H new ATOM 0 HG11 VAL A 258 22.355 57.135 -11.964 1.00 33.05 H new ATOM 0 HG12 VAL A 258 22.942 55.896 -11.172 1.00 33.05 H new ATOM 0 HG13 VAL A 258 22.053 56.968 -10.418 1.00 33.05 H new ATOM 0 HG21 VAL A 258 23.293 59.382 -11.608 1.00 29.45 H new ATOM 0 HG22 VAL A 258 23.026 59.298 -10.049 1.00 29.45 H new ATOM 0 HG23 VAL A 258 24.482 59.610 -10.587 1.00 29.45 H new ATOM 2665 N LYS A 259 24.129 54.893 -8.781 1.00 31.15 N ANISOU 2665 N LYS A 259 4061 2786 4987 1294 90 -785 N ATOM 2666 CA LYS A 259 24.389 53.457 -8.700 1.00 32.64 C ANISOU 2666 CA LYS A 259 4300 2675 5425 1423 -44 -878 C ATOM 2667 C LYS A 259 23.102 52.645 -8.748 1.00 34.06 C ANISOU 2667 C LYS A 259 4764 2762 5415 1292 -103 -784 C ATOM 2668 O LYS A 259 22.166 52.926 -8.011 1.00 32.99 O ANISOU 2668 O LYS A 259 4783 2681 5072 1157 -200 -552 O ATOM 2669 CB LYS A 259 25.146 53.121 -7.409 1.00 42.95 C ANISOU 2669 CB LYS A 259 5554 3765 7000 1583 -379 -763 C ATOM 2670 CG LYS A 259 26.491 53.811 -7.273 1.00 54.08 C ANISOU 2670 CG LYS A 259 6646 5255 8646 1685 -371 -842 C ATOM 2671 CD LYS A 259 27.304 53.293 -6.079 1.00 63.60 C ANISOU 2671 CD LYS A 259 7829 6289 10046 1764 -726 -709 C ATOM 2672 CE LYS A 259 26.813 53.858 -4.747 1.00 60.75 C ANISOU 2672 CE LYS A 259 7684 5937 9461 1693 -994 -427 C ATOM 2673 NZ LYS A 259 27.818 53.697 -3.653 1.00 58.81 N ANISOU 2673 NZ LYS A 259 7390 5582 9372 1742 -1322 -345 N ATOM 0 H LYS A 259 23.440 55.154 -8.337 1.00 31.15 H new ATOM 0 HA LYS A 259 24.930 53.222 -9.470 1.00 32.64 H new ATOM 0 HB2 LYS A 259 24.592 53.363 -6.650 1.00 42.95 H new ATOM 0 HB3 LYS A 259 25.281 52.161 -7.367 1.00 42.95 H new ATOM 0 HG2 LYS A 259 27.001 53.681 -8.088 1.00 54.08 H new ATOM 0 HG3 LYS A 259 26.352 54.766 -7.175 1.00 54.08 H new ATOM 0 HD2 LYS A 259 27.255 52.325 -6.054 1.00 63.60 H new ATOM 0 HD3 LYS A 259 28.237 53.527 -6.201 1.00 63.60 H new ATOM 0 HE2 LYS A 259 26.605 54.799 -4.855 1.00 60.75 H new ATOM 0 HE3 LYS A 259 25.989 53.413 -4.494 1.00 60.75 H new ATOM 0 HZ1 LYS A 259 27.493 54.038 -2.898 1.00 58.81 H new ATOM 0 HZ2 LYS A 259 27.994 52.832 -3.536 1.00 58.81 H new ATOM 0 HZ3 LYS A 259 28.567 54.124 -3.873 1.00 58.81 H new ATOM 2687 N THR A 260 23.059 51.625 -9.600 1.00 34.45 N ANISOU 2687 N THR A 260 4874 2655 5558 1323 -29 -981 N ATOM 2688 CA THR A 260 21.913 50.724 -9.615 1.00 34.24 C ANISOU 2688 CA THR A 260 5100 2489 5421 1199 -121 -906 C ATOM 2689 C THR A 260 21.932 49.885 -8.340 1.00 40.48 C ANISOU 2689 C THR A 260 6013 3000 6367 1260 -417 -716 C ATOM 2690 O THR A 260 22.995 49.468 -7.878 1.00 48.33 O ANISOU 2690 O THR A 260 6911 3798 7654 1460 -576 -763 O ATOM 2691 CB THR A 260 21.910 49.807 -10.856 1.00 39.56 C ANISOU 2691 CB THR A 260 5841 3034 6156 1217 9 -1186 C ATOM 2692 OG1 THR A 260 20.754 48.957 -10.826 1.00 48.24 O ANISOU 2692 OG1 THR A 260 7174 3985 7171 1077 -112 -1103 O ATOM 2693 CG2 THR A 260 23.150 48.959 -10.887 1.00 43.96 C ANISOU 2693 CG2 THR A 260 6265 3335 7103 1461 -21 -1398 C ATOM 0 H THR A 260 23.675 51.439 -10.171 1.00 34.45 H new ATOM 0 HA THR A 260 21.104 51.258 -9.657 1.00 34.24 H new ATOM 0 HB THR A 260 21.889 50.363 -11.651 1.00 39.56 H new ATOM 0 HG1 THR A 260 20.754 48.460 -11.503 1.00 48.24 H new ATOM 0 HG21 THR A 260 23.133 48.389 -11.672 1.00 43.96 H new ATOM 0 HG22 THR A 260 23.933 49.531 -10.920 1.00 43.96 H new ATOM 0 HG23 THR A 260 23.186 48.409 -10.089 1.00 43.96 H new ATOM 2701 N LYS A 261 20.750 49.659 -7.770 1.00 36.65 N ANISOU 2701 N LYS A 261 5745 2481 5699 1075 -494 -501 N ATOM 2702 CA LYS A 261 20.594 48.814 -6.579 1.00 36.20 C ANISOU 2702 CA LYS A 261 5905 2139 5711 1066 -745 -291 C ATOM 2703 C LYS A 261 19.701 47.605 -6.839 1.00 37.75 C ANISOU 2703 C LYS A 261 6310 2101 5932 943 -779 -292 C ATOM 2704 O LYS A 261 19.817 46.567 -6.185 1.00 41.26 O ANISOU 2704 O LYS A 261 6920 2256 6500 963 -971 -193 O ATOM 2705 CB LYS A 261 20.014 49.650 -5.438 1.00 34.46 C ANISOU 2705 CB LYS A 261 5791 2057 5245 919 -766 -13 C ATOM 2706 CG LYS A 261 20.960 50.708 -4.911 1.00 40.24 C ANISOU 2706 CG LYS A 261 6374 2940 5975 1043 -820 20 C ATOM 2707 CD LYS A 261 22.085 50.041 -4.116 1.00 44.88 C ANISOU 2707 CD LYS A 261 6995 3262 6796 1225 -1124 58 C ATOM 2708 CE LYS A 261 22.807 51.016 -3.198 1.00 64.49 C ANISOU 2708 CE LYS A 261 9403 5882 9219 1267 -1243 167 C ATOM 2709 NZ LYS A 261 24.045 51.555 -3.818 1.00 72.53 N ANISOU 2709 NZ LYS A 261 10054 7011 10494 1450 -1205 -47 N ATOM 0 H LYS A 261 20.012 49.991 -8.062 1.00 36.65 H new ATOM 0 HA LYS A 261 21.471 48.477 -6.339 1.00 36.20 H new ATOM 0 HB2 LYS A 261 19.200 50.080 -5.745 1.00 34.46 H new ATOM 0 HB3 LYS A 261 19.765 49.059 -4.710 1.00 34.46 H new ATOM 0 HG2 LYS A 261 21.331 51.219 -5.647 1.00 40.24 H new ATOM 0 HG3 LYS A 261 20.479 51.333 -4.346 1.00 40.24 H new ATOM 0 HD2 LYS A 261 21.717 49.316 -3.587 1.00 44.88 H new ATOM 0 HD3 LYS A 261 22.723 49.648 -4.732 1.00 44.88 H new ATOM 0 HE2 LYS A 261 22.212 51.749 -2.975 1.00 64.49 H new ATOM 0 HE3 LYS A 261 23.031 50.570 -2.366 1.00 64.49 H new ATOM 0 HZ1 LYS A 261 24.144 52.409 -3.589 1.00 72.53 H new ATOM 0 HZ2 LYS A 261 24.747 51.089 -3.533 1.00 72.53 H new ATOM 0 HZ3 LYS A 261 23.986 51.490 -4.704 1.00 72.53 H new ATOM 2723 N ALA A 262 18.778 47.759 -7.781 1.00 37.16 N ANISOU 2723 N ALA A 262 6218 2179 5724 786 -602 -389 N ATOM 2724 CA ALA A 262 17.923 46.654 -8.218 1.00 38.66 C ANISOU 2724 CA ALA A 262 6571 2155 5963 656 -636 -435 C ATOM 2725 C ALA A 262 17.258 47.059 -9.529 1.00 37.24 C ANISOU 2725 C ALA A 262 6318 2180 5650 544 -476 -617 C ATOM 2726 O ALA A 262 17.488 48.162 -10.020 1.00 35.37 O ANISOU 2726 O ALA A 262 5935 2229 5274 569 -342 -681 O ATOM 2727 CB ALA A 262 16.887 46.296 -7.162 1.00 49.82 C ANISOU 2727 CB ALA A 262 8181 3442 7307 436 -703 -157 C ATOM 0 H ALA A 262 18.628 48.503 -8.185 1.00 37.16 H new ATOM 0 HA ALA A 262 18.462 45.859 -8.352 1.00 38.66 H new ATOM 0 HB1 ALA A 262 16.339 45.563 -7.482 1.00 49.82 H new ATOM 0 HB2 ALA A 262 17.336 46.030 -6.344 1.00 49.82 H new ATOM 0 HB3 ALA A 262 16.325 47.067 -6.986 1.00 49.82 H new ATOM 2733 N ASP A 263 16.454 46.167 -10.100 1.00 44.38 N ANISOU 2733 N ASP A 263 7352 2915 6597 415 -521 -697 N ATOM 2734 CA ASP A 263 15.947 46.368 -11.458 1.00 45.13 C ANISOU 2734 CA ASP A 263 7440 3135 6571 328 -445 -907 C ATOM 2735 C ASP A 263 15.344 47.750 -11.610 1.00 46.15 C ANISOU 2735 C ASP A 263 7443 3605 6488 212 -358 -816 C ATOM 2736 O ASP A 263 15.662 48.475 -12.553 1.00 42.83 O ANISOU 2736 O ASP A 263 6982 3378 5915 250 -263 -965 O ATOM 2737 CB ASP A 263 14.917 45.292 -11.817 1.00 40.78 C ANISOU 2737 CB ASP A 263 7047 2344 6102 151 -564 -948 C ATOM 2738 CG ASP A 263 15.565 43.952 -12.142 1.00 45.94 C ANISOU 2738 CG ASP A 263 7847 2656 6952 284 -643 -1140 C ATOM 2739 OD1 ASP A 263 16.805 43.911 -12.251 1.00 53.84 O ANISOU 2739 OD1 ASP A 263 8794 3626 8037 524 -582 -1281 O ATOM 2740 OD2 ASP A 263 14.844 42.937 -12.307 1.00 46.98 O ANISOU 2740 OD2 ASP A 263 8124 2536 7188 151 -761 -1165 O ATOM 0 H ASP A 263 16.190 45.441 -9.722 1.00 44.38 H new ATOM 0 HA ASP A 263 16.695 46.293 -12.071 1.00 45.13 H new ATOM 0 HB2 ASP A 263 14.300 45.179 -11.077 1.00 40.78 H new ATOM 0 HB3 ASP A 263 14.395 45.589 -12.579 1.00 40.78 H new ATOM 2745 N ASN A 264 14.523 48.129 -10.641 1.00 37.45 N ANISOU 2745 N ASN A 264 6293 2558 5379 71 -374 -573 N ATOM 2746 CA ASN A 264 13.844 49.414 -10.685 1.00 37.30 C ANISOU 2746 CA ASN A 264 6131 2822 5220 -34 -308 -488 C ATOM 2747 C ASN A 264 14.168 50.275 -9.464 1.00 36.80 C ANISOU 2747 C ASN A 264 5979 2895 5107 12 -231 -284 C ATOM 2748 O ASN A 264 13.320 51.035 -8.993 1.00 37.70 O ANISOU 2748 O ASN A 264 6000 3144 5179 -118 -175 -155 O ATOM 2749 CB ASN A 264 12.334 49.181 -10.816 1.00 39.89 C ANISOU 2749 CB ASN A 264 6440 3094 5623 -276 -375 -441 C ATOM 2750 CG ASN A 264 11.975 48.431 -12.090 1.00 52.86 C ANISOU 2750 CG ASN A 264 8192 4604 7290 -335 -504 -655 C ATOM 2751 OD1 ASN A 264 12.093 48.970 -13.190 1.00 56.96 O ANISOU 2751 OD1 ASN A 264 8734 5256 7653 -309 -530 -806 O ATOM 2752 ND2 ASN A 264 11.546 47.179 -11.948 1.00 57.33 N ANISOU 2752 ND2 ASN A 264 8869 4887 8028 -430 -591 -666 N ATOM 0 H ASN A 264 14.345 47.654 -9.946 1.00 37.45 H new ATOM 0 HA ASN A 264 14.162 49.905 -11.458 1.00 37.30 H new ATOM 0 HB2 ASN A 264 12.018 48.680 -10.048 1.00 39.89 H new ATOM 0 HB3 ASN A 264 11.875 50.035 -10.806 1.00 39.89 H new ATOM 0 HD21 ASN A 264 11.339 46.714 -12.641 1.00 57.33 H new ATOM 0 HD22 ASN A 264 11.476 46.835 -11.163 1.00 57.33 H new ATOM 2759 N GLN A 265 15.393 50.136 -8.949 1.00 33.05 N ANISOU 2759 N GLN A 265 5532 2362 4663 199 -242 -275 N ATOM 2760 CA GLN A 265 15.880 50.943 -7.821 1.00 32.44 C ANISOU 2760 CA GLN A 265 5410 2393 4523 260 -217 -105 C ATOM 2761 C GLN A 265 17.253 51.536 -8.113 1.00 31.09 C ANISOU 2761 C GLN A 265 5121 2334 4359 473 -198 -217 C ATOM 2762 O GLN A 265 18.179 50.802 -8.453 1.00 32.83 O ANISOU 2762 O GLN A 265 5346 2395 4731 629 -249 -360 O ATOM 2763 CB GLN A 265 15.981 50.108 -6.548 1.00 44.77 C ANISOU 2763 CB GLN A 265 7161 3703 6149 247 -322 75 C ATOM 2764 CG GLN A 265 14.725 50.023 -5.708 1.00 46.46 C ANISOU 2764 CG GLN A 265 7478 3873 6300 3 -249 267 C ATOM 2765 CD GLN A 265 15.043 49.660 -4.275 1.00 53.71 C ANISOU 2765 CD GLN A 265 8639 4608 7160 -11 -321 483 C ATOM 2766 OE1 GLN A 265 15.943 48.863 -4.011 1.00 54.80 O ANISOU 2766 OE1 GLN A 265 8921 4511 7388 131 -513 493 O ATOM 2767 NE2 GLN A 265 14.322 50.254 -3.339 1.00 50.37 N ANISOU 2767 NE2 GLN A 265 8281 4270 6587 -181 -176 648 N ATOM 0 H GLN A 265 15.968 49.569 -9.244 1.00 33.05 H new ATOM 0 HA GLN A 265 15.237 51.658 -7.695 1.00 32.44 H new ATOM 0 HB2 GLN A 265 16.246 49.208 -6.793 1.00 44.77 H new ATOM 0 HB3 GLN A 265 16.692 50.473 -5.999 1.00 44.77 H new ATOM 0 HG2 GLN A 265 14.260 50.874 -5.732 1.00 46.46 H new ATOM 0 HG3 GLN A 265 14.125 49.361 -6.086 1.00 46.46 H new ATOM 0 HE21 GLN A 265 13.701 50.806 -3.560 1.00 50.37 H new ATOM 0 HE22 GLN A 265 14.475 50.089 -2.509 1.00 50.37 H new ATOM 2776 N THR A 266 17.392 52.842 -7.938 1.00 29.55 N ANISOU 2776 N THR A 266 4851 2710 3667 224 852 -463 N ATOM 2777 CA THR A 266 18.643 53.536 -8.187 1.00 28.45 C ANISOU 2777 CA THR A 266 4548 2658 3602 457 868 -511 C ATOM 2778 C THR A 266 18.977 54.478 -7.038 1.00 26.55 C ANISOU 2778 C THR A 266 4238 2544 3305 558 728 -246 C ATOM 2779 O THR A 266 18.119 55.228 -6.580 1.00 27.62 O ANISOU 2779 O THR A 266 4371 2900 3223 430 697 -125 O ATOM 2780 CB THR A 266 18.573 54.351 -9.503 1.00 30.21 C ANISOU 2780 CB THR A 266 4674 3192 3613 376 1003 -713 C ATOM 2781 OG1 THR A 266 18.278 53.477 -10.590 1.00 34.44 O ANISOU 2781 OG1 THR A 266 5305 3639 4143 246 1131 -992 O ATOM 2782 CG2 THR A 266 19.883 55.049 -9.795 1.00 31.34 C ANISOU 2782 CG2 THR A 266 4651 3432 3826 545 1077 -777 C ATOM 0 H THR A 266 16.756 53.355 -7.669 1.00 29.55 H new ATOM 0 HA THR A 266 19.337 52.863 -8.264 1.00 28.45 H new ATOM 0 HB THR A 266 17.878 55.020 -9.398 1.00 30.21 H new ATOM 0 HG1 THR A 266 17.446 53.429 -10.694 1.00 34.44 H new ATOM 0 HG21 THR A 266 19.806 55.549 -10.623 1.00 31.34 H new ATOM 0 HG22 THR A 266 20.095 55.657 -9.069 1.00 31.34 H new ATOM 0 HG23 THR A 266 20.589 54.390 -9.880 1.00 31.34 H new ATOM 2790 N GLU A 267 20.219 54.437 -6.578 1.00 27.49 N ANISOU 2790 N GLU A 267 4275 2521 3647 789 636 -197 N ATOM 2791 CA GLU A 267 20.697 55.367 -5.574 1.00 26.13 C ANISOU 2791 CA GLU A 267 4030 2480 3418 879 484 10 C ATOM 2792 C GLU A 267 21.423 56.525 -6.235 1.00 24.65 C ANISOU 2792 C GLU A 267 3611 2547 3209 953 575 -110 C ATOM 2793 O GLU A 267 22.284 56.340 -7.082 1.00 27.29 O ANISOU 2793 O GLU A 267 3802 2843 3723 1047 701 -323 O ATOM 2794 CB GLU A 267 21.612 54.667 -4.578 1.00 28.69 C ANISOU 2794 CB GLU A 267 4405 2494 4000 1064 245 171 C ATOM 2795 CG GLU A 267 22.067 55.564 -3.453 1.00 28.69 C ANISOU 2795 CG GLU A 267 4371 2635 3895 1116 45 384 C ATOM 2796 CD GLU A 267 22.940 54.842 -2.461 1.00 32.65 C ANISOU 2796 CD GLU A 267 4957 2823 4627 1284 -284 580 C ATOM 2797 OE1 GLU A 267 24.073 54.465 -2.832 1.00 40.52 O ANISOU 2797 OE1 GLU A 267 5741 3630 6024 1540 -367 447 O ATOM 2798 OE2 GLU A 267 22.496 54.633 -1.310 1.00 35.70 O ANISOU 2798 OE2 GLU A 267 5621 3145 4798 1149 -470 858 O ATOM 0 H GLU A 267 20.808 53.868 -6.841 1.00 27.49 H new ATOM 0 HA GLU A 267 19.931 55.713 -5.090 1.00 26.13 H new ATOM 0 HB2 GLU A 267 21.148 53.901 -4.205 1.00 28.69 H new ATOM 0 HB3 GLU A 267 22.390 54.327 -5.047 1.00 28.69 H new ATOM 0 HG2 GLU A 267 22.554 56.318 -3.821 1.00 28.69 H new ATOM 0 HG3 GLU A 267 21.291 55.924 -2.995 1.00 28.69 H new ATOM 2805 N VAL A 268 21.061 57.726 -5.829 1.00 22.37 N ANISOU 2805 N VAL A 268 3290 2505 2705 884 532 6 N ATOM 2806 CA VAL A 268 21.640 58.951 -6.352 1.00 22.62 C ANISOU 2806 CA VAL A 268 3155 2751 2690 902 591 -53 C ATOM 2807 C VAL A 268 22.173 59.717 -5.167 1.00 23.85 C ANISOU 2807 C VAL A 268 3247 2951 2864 984 414 104 C ATOM 2808 O VAL A 268 21.424 60.034 -4.251 1.00 23.46 O ANISOU 2808 O VAL A 268 3303 2958 2651 913 320 236 O ATOM 2809 CB VAL A 268 20.601 59.819 -7.114 1.00 22.74 C ANISOU 2809 CB VAL A 268 3211 2982 2447 730 657 -76 C ATOM 2810 CG1 VAL A 268 21.218 61.125 -7.572 1.00 28.60 C ANISOU 2810 CG1 VAL A 268 3845 3885 3134 717 679 -76 C ATOM 2811 CG2 VAL A 268 20.045 59.072 -8.303 1.00 24.58 C ANISOU 2811 CG2 VAL A 268 3533 3198 2610 611 786 -237 C ATOM 0 H VAL A 268 20.459 57.858 -5.229 1.00 22.37 H new ATOM 0 HA VAL A 268 22.336 58.733 -6.991 1.00 22.62 H new ATOM 0 HB VAL A 268 19.876 60.015 -6.500 1.00 22.74 H new ATOM 0 HG11 VAL A 268 20.553 61.649 -8.044 1.00 28.60 H new ATOM 0 HG12 VAL A 268 21.533 61.622 -6.801 1.00 28.60 H new ATOM 0 HG13 VAL A 268 21.964 60.941 -8.164 1.00 28.60 H new ATOM 0 HG21 VAL A 268 19.400 59.631 -8.764 1.00 24.58 H new ATOM 0 HG22 VAL A 268 20.767 58.845 -8.910 1.00 24.58 H new ATOM 0 HG23 VAL A 268 19.611 58.259 -8.000 1.00 24.58 H new ATOM 2821 N ILE A 269 23.468 59.988 -5.155 1.00 24.25 N ANISOU 2821 N ILE A 269 3108 2987 3117 1113 381 56 N ATOM 2822 CA ILE A 269 24.080 60.719 -4.058 1.00 25.71 C ANISOU 2822 CA ILE A 269 3221 3219 3328 1176 178 180 C ATOM 2823 C ILE A 269 24.283 62.158 -4.506 1.00 23.32 C ANISOU 2823 C ILE A 269 2800 3124 2938 1088 263 131 C ATOM 2824 O ILE A 269 24.869 62.408 -5.564 1.00 22.99 O ANISOU 2824 O ILE A 269 2623 3140 2973 1052 441 -7 O ATOM 2825 CB ILE A 269 25.407 60.083 -3.625 1.00 28.83 C ANISOU 2825 CB ILE A 269 3447 3439 4068 1378 7 164 C ATOM 2826 CG1 ILE A 269 25.188 58.592 -3.330 1.00 30.04 C ANISOU 2826 CG1 ILE A 269 3761 3299 4354 1469 -105 228 C ATOM 2827 CG2 ILE A 269 25.966 60.793 -2.407 1.00 32.40 C ANISOU 2827 CG2 ILE A 269 3859 3949 4504 1412 -270 304 C ATOM 2828 CD1 ILE A 269 26.430 57.864 -2.868 1.00 44.52 C ANISOU 2828 CD1 ILE A 269 5429 4882 6605 1717 -364 230 C ATOM 0 H ILE A 269 24.014 59.756 -5.777 1.00 24.25 H new ATOM 0 HA ILE A 269 23.497 60.690 -3.283 1.00 25.71 H new ATOM 0 HB ILE A 269 26.052 60.172 -4.344 1.00 28.83 H new ATOM 0 HG12 ILE A 269 24.502 58.504 -2.650 1.00 30.04 H new ATOM 0 HG13 ILE A 269 24.851 58.160 -4.130 1.00 30.04 H new ATOM 0 HG21 ILE A 269 26.804 60.379 -2.147 1.00 32.40 H new ATOM 0 HG22 ILE A 269 26.120 61.727 -2.619 1.00 32.40 H new ATOM 0 HG23 ILE A 269 25.333 60.728 -1.675 1.00 32.40 H new ATOM 0 HD11 ILE A 269 26.216 56.933 -2.702 1.00 44.52 H new ATOM 0 HD12 ILE A 269 27.113 57.921 -3.554 1.00 44.52 H new ATOM 0 HD13 ILE A 269 26.759 58.271 -2.051 1.00 44.52 H new ATOM 2840 N ILE A 270 23.781 63.098 -3.707 1.00 21.19 N ANISOU 2840 N ILE A 270 2600 2951 2498 1026 152 230 N ATOM 2841 CA ILE A 270 23.877 64.514 -4.028 1.00 21.72 C ANISOU 2841 CA ILE A 270 2597 3144 2511 942 185 204 C ATOM 2842 C ILE A 270 24.494 65.326 -2.902 1.00 22.86 C ANISOU 2842 C ILE A 270 2677 3320 2689 963 1 243 C ATOM 2843 O ILE A 270 24.593 64.870 -1.759 1.00 26.63 O ANISOU 2843 O ILE A 270 3219 3761 3139 1016 -174 313 O ATOM 2844 CB ILE A 270 22.486 65.137 -4.350 1.00 23.00 C ANISOU 2844 CB ILE A 270 2890 3369 2479 841 226 219 C ATOM 2845 CG1 ILE A 270 21.576 65.123 -3.123 1.00 24.04 C ANISOU 2845 CG1 ILE A 270 3119 3518 2497 836 137 253 C ATOM 2846 CG2 ILE A 270 21.832 64.439 -5.532 1.00 25.43 C ANISOU 2846 CG2 ILE A 270 3270 3670 2722 783 360 175 C ATOM 2847 CD1 ILE A 270 20.327 65.986 -3.280 1.00 24.85 C ANISOU 2847 CD1 ILE A 270 3237 3680 2525 778 153 200 C ATOM 0 H ILE A 270 23.377 62.930 -2.967 1.00 21.19 H new ATOM 0 HA ILE A 270 24.449 64.554 -4.810 1.00 21.72 H new ATOM 0 HB ILE A 270 22.628 66.064 -4.598 1.00 23.00 H new ATOM 0 HG12 ILE A 270 21.308 64.209 -2.939 1.00 24.04 H new ATOM 0 HG13 ILE A 270 22.079 65.432 -2.353 1.00 24.04 H new ATOM 0 HG21 ILE A 270 20.969 64.845 -5.711 1.00 25.43 H new ATOM 0 HG22 ILE A 270 22.399 64.527 -6.314 1.00 25.43 H new ATOM 0 HG23 ILE A 270 21.710 63.499 -5.326 1.00 25.43 H new ATOM 0 HD11 ILE A 270 19.794 65.935 -2.471 1.00 24.85 H new ATOM 0 HD12 ILE A 270 20.587 66.907 -3.437 1.00 24.85 H new ATOM 0 HD13 ILE A 270 19.804 65.666 -4.032 1.00 24.85 H new ATOM 2859 N TYR A 271 24.891 66.549 -3.253 1.00 23.82 N ANISOU 2859 N TYR A 271 2709 3500 2843 885 27 205 N ATOM 2860 CA TYR A 271 25.204 67.574 -2.275 1.00 23.51 C ANISOU 2860 CA TYR A 271 2642 3488 2801 857 -133 204 C ATOM 2861 C TYR A 271 24.735 68.889 -2.870 1.00 21.70 C ANISOU 2861 C TYR A 271 2456 3257 2533 745 -72 187 C ATOM 2862 O TYR A 271 24.442 68.965 -4.070 1.00 23.01 O ANISOU 2862 O TYR A 271 2661 3411 2671 678 60 210 O ATOM 2863 CB TYR A 271 26.698 67.584 -1.929 1.00 24.92 C ANISOU 2863 CB TYR A 271 2599 3671 3200 893 -249 167 C ATOM 2864 CG TYR A 271 27.660 67.856 -3.067 1.00 24.45 C ANISOU 2864 CG TYR A 271 2320 3632 3336 820 -68 81 C ATOM 2865 CD1 TYR A 271 28.173 66.821 -3.850 1.00 26.12 C ANISOU 2865 CD1 TYR A 271 2391 3828 3706 886 88 1 C ATOM 2866 CD2 TYR A 271 28.097 69.146 -3.331 1.00 28.55 C ANISOU 2866 CD2 TYR A 271 2775 4179 3894 655 -31 52 C ATOM 2867 CE1 TYR A 271 29.077 67.075 -4.875 1.00 30.51 C ANISOU 2867 CE1 TYR A 271 2731 4445 4415 767 326 -134 C ATOM 2868 CE2 TYR A 271 28.997 69.408 -4.358 1.00 29.14 C ANISOU 2868 CE2 TYR A 271 2668 4296 4108 509 183 -28 C ATOM 2869 CZ TYR A 271 29.483 68.371 -5.118 1.00 31.86 C ANISOU 2869 CZ TYR A 271 2858 4675 4572 557 383 -135 C ATOM 2870 OH TYR A 271 30.363 68.655 -6.128 1.00 35.10 O ANISOU 2870 OH TYR A 271 3082 5167 5088 361 665 -263 O ATOM 0 H TYR A 271 24.985 66.803 -4.069 1.00 23.82 H new ATOM 0 HA TYR A 271 24.753 67.407 -1.432 1.00 23.51 H new ATOM 0 HB2 TYR A 271 26.845 68.253 -1.242 1.00 24.92 H new ATOM 0 HB3 TYR A 271 26.924 66.724 -1.541 1.00 24.92 H new ATOM 0 HD1 TYR A 271 27.905 65.946 -3.683 1.00 26.12 H new ATOM 0 HD2 TYR A 271 27.782 69.849 -2.811 1.00 28.55 H new ATOM 0 HE1 TYR A 271 29.406 66.376 -5.393 1.00 30.51 H new ATOM 0 HE2 TYR A 271 29.269 70.281 -4.530 1.00 29.14 H new ATOM 0 HH TYR A 271 30.509 69.482 -6.148 1.00 35.10 H new ATOM 2880 N VAL A 272 24.659 69.907 -2.026 1.00 21.90 N ANISOU 2880 N VAL A 272 2501 3270 2549 715 -195 145 N ATOM 2881 CA VAL A 272 24.144 71.216 -2.424 1.00 20.83 C ANISOU 2881 CA VAL A 272 2424 3053 2439 640 -202 126 C ATOM 2882 C VAL A 272 25.157 72.266 -2.022 1.00 22.84 C ANISOU 2882 C VAL A 272 2592 3264 2822 548 -295 76 C ATOM 2883 O VAL A 272 25.595 72.326 -0.868 1.00 24.70 O ANISOU 2883 O VAL A 272 2785 3546 3052 563 -422 -4 O ATOM 2884 CB VAL A 272 22.797 71.524 -1.772 1.00 21.94 C ANISOU 2884 CB VAL A 272 2659 3173 2504 699 -240 41 C ATOM 2885 CG1 VAL A 272 22.335 72.907 -2.173 1.00 22.76 C ANISOU 2885 CG1 VAL A 272 2793 3118 2736 672 -309 7 C ATOM 2886 CG2 VAL A 272 21.732 70.501 -2.206 1.00 21.55 C ANISOU 2886 CG2 VAL A 272 2661 3172 2354 752 -145 74 C ATOM 0 H VAL A 272 24.904 69.862 -1.203 1.00 21.90 H new ATOM 0 HA VAL A 272 24.005 71.216 -3.384 1.00 20.83 H new ATOM 0 HB VAL A 272 22.911 71.476 -0.810 1.00 21.94 H new ATOM 0 HG11 VAL A 272 21.480 73.096 -1.756 1.00 22.76 H new ATOM 0 HG12 VAL A 272 22.988 73.563 -1.883 1.00 22.76 H new ATOM 0 HG13 VAL A 272 22.240 72.950 -3.137 1.00 22.76 H new ATOM 0 HG21 VAL A 272 20.886 70.714 -1.782 1.00 21.55 H new ATOM 0 HG22 VAL A 272 21.627 70.532 -3.170 1.00 21.55 H new ATOM 0 HG23 VAL A 272 22.011 69.611 -1.940 1.00 21.55 H new ATOM 2896 N VAL A 273 25.550 73.077 -2.997 1.00 21.24 N ANISOU 2896 N VAL A 273 2390 2973 2709 410 -242 133 N ATOM 2897 CA VAL A 273 26.470 74.182 -2.763 1.00 24.03 C ANISOU 2897 CA VAL A 273 2672 3250 3208 263 -311 90 C ATOM 2898 C VAL A 273 25.639 75.441 -2.574 1.00 26.36 C ANISOU 2898 C VAL A 273 3123 3341 3553 250 -430 60 C ATOM 2899 O VAL A 273 24.762 75.735 -3.398 1.00 25.43 O ANISOU 2899 O VAL A 273 3148 3098 3416 261 -433 160 O ATOM 2900 CB VAL A 273 27.435 74.354 -3.933 1.00 26.22 C ANISOU 2900 CB VAL A 273 2874 3534 3554 53 -148 167 C ATOM 2901 CG1 VAL A 273 28.281 75.611 -3.756 1.00 28.93 C ANISOU 2901 CG1 VAL A 273 3164 3767 4061 -160 -207 131 C ATOM 2902 CG2 VAL A 273 28.312 73.112 -4.070 1.00 24.26 C ANISOU 2902 CG2 VAL A 273 2395 3465 3355 105 -17 109 C ATOM 0 H VAL A 273 25.290 73.002 -3.813 1.00 21.24 H new ATOM 0 HA VAL A 273 27.006 74.003 -1.975 1.00 24.03 H new ATOM 0 HB VAL A 273 26.923 74.459 -4.750 1.00 26.22 H new ATOM 0 HG11 VAL A 273 28.887 75.702 -4.508 1.00 28.93 H new ATOM 0 HG12 VAL A 273 27.702 76.388 -3.712 1.00 28.93 H new ATOM 0 HG13 VAL A 273 28.794 75.543 -2.935 1.00 28.93 H new ATOM 0 HG21 VAL A 273 28.923 73.227 -4.815 1.00 24.26 H new ATOM 0 HG22 VAL A 273 28.819 72.982 -3.254 1.00 24.26 H new ATOM 0 HG23 VAL A 273 27.752 72.336 -4.229 1.00 24.26 H new ATOM 2912 N GLU A 274 25.916 76.173 -1.498 1.00 26.47 N ANISOU 2912 N GLU A 274 3105 3304 3649 233 -557 -96 N ATOM 2913 CA GLU A 274 25.234 77.428 -1.204 1.00 29.39 C ANISOU 2913 CA GLU A 274 3590 3435 4142 237 -670 -201 C ATOM 2914 C GLU A 274 26.223 78.588 -1.312 1.00 32.33 C ANISOU 2914 C GLU A 274 3955 3630 4700 17 -741 -207 C ATOM 2915 O GLU A 274 27.361 78.497 -0.847 1.00 32.45 O ANISOU 2915 O GLU A 274 3820 3768 4741 -102 -753 -270 O ATOM 2916 CB GLU A 274 24.595 77.390 0.190 1.00 28.73 C ANISOU 2916 CB GLU A 274 3509 3424 3983 361 -719 -454 C ATOM 2917 CG GLU A 274 25.578 77.211 1.333 1.00 31.16 C ANISOU 2917 CG GLU A 274 3742 3897 4199 280 -799 -579 C ATOM 2918 CD GLU A 274 24.899 77.015 2.684 1.00 31.21 C ANISOU 2918 CD GLU A 274 3826 4031 4002 338 -812 -810 C ATOM 2919 OE1 GLU A 274 23.708 77.359 2.827 1.00 30.14 O ANISOU 2919 OE1 GLU A 274 3750 3815 3887 427 -729 -966 O ATOM 2920 OE2 GLU A 274 25.578 76.512 3.607 1.00 33.70 O ANISOU 2920 OE2 GLU A 274 4138 4532 4135 276 -913 -843 O ATOM 0 H GLU A 274 26.509 75.953 -0.915 1.00 26.47 H new ATOM 0 HA GLU A 274 24.523 77.557 -1.852 1.00 29.39 H new ATOM 0 HB2 GLU A 274 24.102 78.214 0.329 1.00 28.73 H new ATOM 0 HB3 GLU A 274 23.950 76.666 0.217 1.00 28.73 H new ATOM 0 HG2 GLU A 274 26.144 76.445 1.148 1.00 31.16 H new ATOM 0 HG3 GLU A 274 26.157 77.988 1.378 1.00 31.16 H new ATOM 2927 N ARG A 275 25.783 79.676 -1.929 1.00 33.29 N ANISOU 2927 N ARG A 275 4234 3437 4977 -45 -820 -135 N ATOM 2928 CA ARG A 275 26.633 80.846 -2.095 1.00 34.89 C ANISOU 2928 CA ARG A 275 4482 3405 5368 -300 -888 -115 C ATOM 2929 C ARG A 275 26.183 81.959 -1.165 1.00 38.01 C ANISOU 2929 C ARG A 275 4942 3527 5973 -235 -1061 -367 C ATOM 2930 O ARG A 275 24.986 82.232 -1.048 1.00 35.63 O ANISOU 2930 O ARG A 275 4722 3055 5762 -20 -1140 -457 O ATOM 2931 CB ARG A 275 26.612 81.329 -3.545 1.00 36.48 C ANISOU 2931 CB ARG A 275 4886 3389 5587 -491 -876 194 C ATOM 2932 CG ARG A 275 27.797 82.227 -3.892 1.00 48.27 C ANISOU 2932 CG ARG A 275 6408 4731 7202 -870 -848 272 C ATOM 2933 CD ARG A 275 27.871 82.498 -5.387 1.00 54.27 C ANISOU 2933 CD ARG A 275 7417 5353 7851 -1145 -780 619 C ATOM 2934 NE ARG A 275 26.621 83.062 -5.892 1.00 65.11 N ANISOU 2934 NE ARG A 275 9091 6378 9269 -1003 -1028 793 N ATOM 2935 CZ ARG A 275 25.638 82.358 -6.449 1.00 56.89 C ANISOU 2935 CZ ARG A 275 8127 5427 8063 -798 -1067 909 C ATOM 2936 NH1 ARG A 275 25.742 81.038 -6.607 1.00 58.01 N ANISOU 2936 NH1 ARG A 275 8105 5978 7959 -725 -840 872 N ATOM 2937 NH2 ARG A 275 24.542 82.990 -6.860 1.00 55.90 N ANISOU 2937 NH2 ARG A 275 8232 4947 8061 -661 -1367 1051 N ATOM 0 H ARG A 275 24.993 79.757 -2.260 1.00 33.29 H new ATOM 0 HA ARG A 275 27.543 80.597 -1.869 1.00 34.89 H new ATOM 0 HB2 ARG A 275 26.611 80.560 -4.137 1.00 36.48 H new ATOM 0 HB3 ARG A 275 25.787 81.813 -3.707 1.00 36.48 H new ATOM 0 HG2 ARG A 275 27.719 83.067 -3.413 1.00 48.27 H new ATOM 0 HG3 ARG A 275 28.620 81.807 -3.597 1.00 48.27 H new ATOM 0 HD2 ARG A 275 28.601 83.110 -5.570 1.00 54.27 H new ATOM 0 HD3 ARG A 275 28.068 81.673 -5.857 1.00 54.27 H new ATOM 0 HE ARG A 275 26.512 83.912 -5.824 1.00 65.11 H new ATOM 0 HH11 ARG A 275 26.452 80.628 -6.347 1.00 58.01 H new ATOM 0 HH12 ARG A 275 25.099 80.596 -6.969 1.00 58.01 H new ATOM 0 HH21 ARG A 275 24.476 83.842 -6.764 1.00 55.90 H new ATOM 0 HH22 ARG A 275 23.900 82.547 -7.221 1.00 55.90 H new ATOM 2951 N SER A 276 27.153 82.609 -0.516 1.00 38.12 N ANISOU 2951 N SER A 276 4890 3495 6098 -429 -1115 -521 N ATOM 2952 CA SER A 276 26.876 83.726 0.391 1.00 46.52 C ANISOU 2952 CA SER A 276 6024 4283 7370 -414 -1264 -820 C ATOM 2953 C SER A 276 26.832 85.053 -0.362 1.00 50.16 C ANISOU 2953 C SER A 276 6686 4233 8139 -566 -1393 -693 C ATOM 2954 O SER A 276 27.283 85.133 -1.504 1.00 47.17 O ANISOU 2954 O SER A 276 6402 3770 7750 -777 -1355 -357 O ATOM 2955 CB SER A 276 27.934 83.791 1.491 1.00 52.74 C ANISOU 2955 CB SER A 276 6668 5259 8114 -576 -1309 -1064 C ATOM 2956 OG SER A 276 28.102 82.525 2.103 1.00 62.80 O ANISOU 2956 OG SER A 276 7798 6967 9097 -465 -1257 -1096 O ATOM 0 H SER A 276 27.988 82.415 -0.589 1.00 38.12 H new ATOM 0 HA SER A 276 26.006 83.573 0.791 1.00 46.52 H new ATOM 0 HB2 SER A 276 28.778 84.088 1.117 1.00 52.74 H new ATOM 0 HB3 SER A 276 27.673 84.445 2.158 1.00 52.74 H new ATOM 0 HG SER A 276 28.687 82.579 2.703 1.00 62.80 H new ATOM 2962 N PRO A 277 26.273 86.100 0.269 1.00 62.20 N ANISOU 2962 N PRO A 277 8300 5394 9937 -476 -1542 -971 N ATOM 2963 CA PRO A 277 26.231 87.426 -0.366 1.00 60.15 C ANISOU 2963 CA PRO A 277 8268 4553 10033 -612 -1728 -848 C ATOM 2964 C PRO A 277 27.611 87.975 -0.759 1.00 57.02 C ANISOU 2964 C PRO A 277 7921 4064 9681 -1064 -1714 -676 C ATOM 2965 O PRO A 277 27.684 88.823 -1.648 1.00 68.55 O ANISOU 2965 O PRO A 277 9628 5091 11326 -1268 -1828 -401 O ATOM 2966 CB PRO A 277 25.584 88.305 0.710 1.00 65.88 C ANISOU 2966 CB PRO A 277 8996 4976 11058 -427 -1848 -1322 C ATOM 2967 CG PRO A 277 24.732 87.366 1.491 1.00 56.34 C ANISOU 2967 CG PRO A 277 7613 4161 9632 -119 -1705 -1594 C ATOM 2968 CD PRO A 277 25.493 86.068 1.521 1.00 54.77 C ANISOU 2968 CD PRO A 277 7281 4536 8995 -231 -1533 -1416 C ATOM 0 HA PRO A 277 25.748 87.398 -1.207 1.00 60.15 H new ATOM 0 HB2 PRO A 277 26.253 88.726 1.272 1.00 65.88 H new ATOM 0 HB3 PRO A 277 25.056 89.017 0.315 1.00 65.88 H new ATOM 0 HG2 PRO A 277 24.575 87.700 2.388 1.00 56.34 H new ATOM 0 HG3 PRO A 277 23.863 87.253 1.074 1.00 56.34 H new ATOM 0 HD2 PRO A 277 26.069 86.009 2.300 1.00 54.77 H new ATOM 0 HD3 PRO A 277 24.896 85.304 1.551 1.00 54.77 H new ATOM 2976 N ASN A 278 28.673 87.485 -0.121 1.00 58.75 N ANISOU 2976 N ASN A 278 7907 4677 9739 -1236 -1594 -824 N ATOM 2977 CA ASN A 278 30.034 87.921 -0.439 1.00 63.65 C ANISOU 2977 CA ASN A 278 8472 5277 10435 -1684 -1547 -722 C ATOM 2978 C ASN A 278 30.725 87.064 -1.506 1.00 56.40 C ANISOU 2978 C ASN A 278 7446 4683 9301 -1878 -1316 -387 C ATOM 2979 O ASN A 278 31.929 87.193 -1.720 1.00 69.74 O ANISOU 2979 O ASN A 278 8977 6480 11039 -2249 -1203 -361 O ATOM 2980 CB ASN A 278 30.894 87.941 0.832 1.00 64.67 C ANISOU 2980 CB ASN A 278 8356 5638 10576 -1786 -1597 -1104 C ATOM 2981 CG ASN A 278 31.060 86.567 1.464 1.00 59.92 C ANISOU 2981 CG ASN A 278 7489 5611 9666 -1580 -1527 -1198 C ATOM 2982 OD1 ASN A 278 30.776 85.539 0.853 1.00 62.78 O ANISOU 2982 OD1 ASN A 278 7800 6222 9831 -1419 -1387 -971 O ATOM 2983 ND2 ASN A 278 31.532 86.549 2.702 1.00 64.62 N ANISOU 2983 ND2 ASN A 278 7943 6396 10212 -1604 -1657 -1529 N ATOM 0 H ASN A 278 28.627 86.895 0.503 1.00 58.75 H new ATOM 0 HA ASN A 278 29.948 88.814 -0.809 1.00 63.65 H new ATOM 0 HB2 ASN A 278 31.769 88.300 0.618 1.00 64.67 H new ATOM 0 HB3 ASN A 278 30.491 88.542 1.479 1.00 64.67 H new ATOM 0 HD21 ASN A 278 31.650 85.799 3.106 1.00 64.62 H new ATOM 0 HD22 ASN A 278 31.721 87.287 3.101 1.00 64.62 H new ATOM 2990 N GLY A 279 29.969 86.190 -2.163 1.00 56.83 N ANISOU 2990 N GLY A 279 7556 4901 9134 -1643 -1228 -180 N ATOM 2991 CA GLY A 279 30.494 85.402 -3.267 1.00 56.54 C ANISOU 2991 CA GLY A 279 7461 5139 8882 -1825 -982 98 C ATOM 2992 C GLY A 279 31.136 84.090 -2.850 1.00 53.00 C ANISOU 2992 C GLY A 279 6633 5222 8283 -1714 -816 -47 C ATOM 2993 O GLY A 279 31.460 83.257 -3.692 1.00 58.13 O ANISOU 2993 O GLY A 279 7192 6126 8771 -1784 -587 105 O ATOM 0 H GLY A 279 29.142 86.039 -1.981 1.00 56.83 H new ATOM 0 HA2 GLY A 279 29.773 85.214 -3.888 1.00 56.54 H new ATOM 0 HA3 GLY A 279 31.150 85.933 -3.746 1.00 56.54 H new ATOM 2997 N THR A 280 31.328 83.915 -1.547 1.00 48.97 N ANISOU 2997 N THR A 280 5920 4860 7826 -1551 -950 -348 N ATOM 2998 CA THR A 280 31.865 82.677 -0.999 1.00 44.79 C ANISOU 2998 CA THR A 280 5067 4770 7181 -1401 -904 -465 C ATOM 2999 C THR A 280 30.881 81.530 -1.195 1.00 40.86 C ANISOU 2999 C THR A 280 4637 4446 6444 -1058 -836 -362 C ATOM 3000 O THR A 280 29.669 81.732 -1.105 1.00 39.44 O ANISOU 3000 O THR A 280 4689 4097 6198 -855 -908 -350 O ATOM 3001 CB THR A 280 32.165 82.823 0.503 1.00 45.41 C ANISOU 3001 CB THR A 280 5017 4936 7301 -1330 -1142 -775 C ATOM 3002 OG1 THR A 280 33.021 83.953 0.710 1.00 67.90 O ANISOU 3002 OG1 THR A 280 7811 7594 10393 -1668 -1228 -903 O ATOM 3003 CG2 THR A 280 32.824 81.569 1.049 1.00 49.98 C ANISOU 3003 CG2 THR A 280 5286 5918 7786 -1195 -1185 -838 C ATOM 0 H THR A 280 31.150 84.513 -0.955 1.00 48.97 H new ATOM 0 HA THR A 280 32.689 82.484 -1.473 1.00 44.79 H new ATOM 0 HB THR A 280 31.328 82.955 0.975 1.00 45.41 H new ATOM 0 HG1 THR A 280 32.568 84.659 0.670 1.00 67.90 H new ATOM 0 HG21 THR A 280 33.004 81.683 1.995 1.00 49.98 H new ATOM 0 HG22 THR A 280 32.232 80.811 0.922 1.00 49.98 H new ATOM 0 HG23 THR A 280 33.658 81.410 0.579 1.00 49.98 H new ATOM 3011 N SER A 281 31.401 80.332 -1.458 1.00 39.11 N ANISOU 3011 N SER A 281 4045 5121 5694 -1274 -812 -947 N ATOM 3012 CA SER A 281 30.568 79.140 -1.592 1.00 34.83 C ANISOU 3012 CA SER A 281 3544 4598 5091 -838 -812 -774 C ATOM 3013 C SER A 281 30.999 78.051 -0.616 1.00 32.64 C ANISOU 3013 C SER A 281 3109 4673 4619 -726 -1111 -716 C ATOM 3014 O SER A 281 32.160 77.970 -0.227 1.00 39.42 O ANISOU 3014 O SER A 281 3651 5875 5453 -899 -1350 -689 O ATOM 3015 CB SER A 281 30.613 78.609 -3.029 1.00 38.95 C ANISOU 3015 CB SER A 281 3878 5122 5798 -617 -659 -574 C ATOM 3016 OG SER A 281 29.781 79.383 -3.877 1.00 49.71 O ANISOU 3016 OG SER A 281 5439 6186 7263 -622 -408 -514 O ATOM 0 H SER A 281 32.242 80.189 -1.563 1.00 39.11 H new ATOM 0 HA SER A 281 29.656 79.393 -1.379 1.00 34.83 H new ATOM 0 HB2 SER A 281 31.525 78.629 -3.358 1.00 38.95 H new ATOM 0 HB3 SER A 281 30.326 77.682 -3.045 1.00 38.95 H new ATOM 0 HG SER A 281 29.819 79.080 -4.659 1.00 49.71 H new ATOM 3022 N ARG A 282 30.049 77.220 -0.213 1.00 31.49 N ANISOU 3022 N ARG A 282 3155 4461 4347 -441 -1097 -645 N ATOM 3023 CA ARG A 282 30.350 76.068 0.634 1.00 34.48 C ANISOU 3023 CA ARG A 282 3404 5128 4568 -264 -1333 -498 C ATOM 3024 C ARG A 282 29.222 75.060 0.501 1.00 35.01 C ANISOU 3024 C ARG A 282 3664 5011 4628 92 -1184 -385 C ATOM 3025 O ARG A 282 28.129 75.395 0.067 1.00 27.05 O ANISOU 3025 O ARG A 282 2903 3720 3655 131 -968 -448 O ATOM 3026 CB ARG A 282 30.520 76.476 2.087 1.00 39.11 C ANISOU 3026 CB ARG A 282 4129 5918 4814 -549 -1577 -627 C ATOM 3027 CG ARG A 282 29.230 76.809 2.812 1.00 37.54 C ANISOU 3027 CG ARG A 282 4419 5446 4398 -567 -1412 -802 C ATOM 3028 CD ARG A 282 29.534 77.122 4.263 1.00 48.12 C ANISOU 3028 CD ARG A 282 5923 7051 5310 -912 -1642 -957 C ATOM 3029 NE ARG A 282 28.469 77.881 4.908 1.00 56.71 N ANISOU 3029 NE ARG A 282 7523 7807 6217 -1059 -1367 -1243 N ATOM 3030 CZ ARG A 282 28.602 78.536 6.059 1.00 65.26 C ANISOU 3030 CZ ARG A 282 8900 8995 6901 -1490 -1422 -1528 C ATOM 3031 NH1 ARG A 282 29.763 78.535 6.707 1.00 70.69 N ANISOU 3031 NH1 ARG A 282 9384 10192 7283 -1867 -1831 -1539 N ATOM 3032 NH2 ARG A 282 27.570 79.201 6.563 1.00 71.13 N ANISOU 3032 NH2 ARG A 282 10132 9350 7543 -1570 -1046 -1799 N ATOM 0 H ARG A 282 29.218 77.303 -0.419 1.00 31.49 H new ATOM 0 HA ARG A 282 31.188 75.674 0.344 1.00 34.48 H new ATOM 0 HB2 ARG A 282 30.966 75.757 2.561 1.00 39.11 H new ATOM 0 HB3 ARG A 282 31.106 77.248 2.126 1.00 39.11 H new ATOM 0 HG2 ARG A 282 28.797 77.568 2.391 1.00 37.54 H new ATOM 0 HG3 ARG A 282 28.613 76.063 2.754 1.00 37.54 H new ATOM 0 HD2 ARG A 282 29.674 76.293 4.747 1.00 48.12 H new ATOM 0 HD3 ARG A 282 30.362 77.625 4.315 1.00 48.12 H new ATOM 0 HE ARG A 282 27.703 77.907 4.518 1.00 56.71 H new ATOM 0 HH11 ARG A 282 30.436 78.109 6.383 1.00 70.69 H new ATOM 0 HH12 ARG A 282 29.841 78.961 7.450 1.00 70.69 H new ATOM 0 HH21 ARG A 282 26.818 79.208 6.146 1.00 71.13 H new ATOM 0 HH22 ARG A 282 27.653 79.625 7.307 1.00 71.13 H new ATOM 3046 N ARG A 283 29.480 73.820 0.887 1.00 36.34 N ANISOU 3046 N ARG A 283 3695 5341 4771 344 -1290 -180 N ATOM 3047 CA ARG A 283 28.428 72.822 0.847 1.00 28.52 C ANISOU 3047 CA ARG A 283 2911 4155 3770 620 -1131 -91 C ATOM 3048 C ARG A 283 27.507 72.974 2.043 1.00 26.18 C ANISOU 3048 C ARG A 283 2939 3819 3189 570 -1178 -152 C ATOM 3049 O ARG A 283 27.979 73.189 3.166 1.00 29.17 O ANISOU 3049 O ARG A 283 3328 4439 3315 422 -1408 -154 O ATOM 3050 CB ARG A 283 29.018 71.414 0.828 1.00 34.42 C ANISOU 3050 CB ARG A 283 3437 4990 4650 927 -1133 167 C ATOM 3051 CG ARG A 283 29.833 71.098 -0.404 1.00 31.82 C ANISOU 3051 CG ARG A 283 2828 4634 4627 1023 -956 209 C ATOM 3052 CD ARG A 283 30.204 69.622 -0.456 1.00 36.44 C ANISOU 3052 CD ARG A 283 3278 5156 5413 1383 -805 452 C ATOM 3053 NE ARG A 283 31.117 69.353 -1.561 1.00 33.85 N ANISOU 3053 NE ARG A 283 2675 4796 5391 1475 -564 473 N ATOM 3054 CZ ARG A 283 31.489 68.142 -1.960 1.00 35.39 C ANISOU 3054 CZ ARG A 283 2847 4802 5797 1720 -269 563 C ATOM 3055 NH1 ARG A 283 31.031 67.059 -1.345 1.00 38.68 N ANISOU 3055 NH1 ARG A 283 3476 5037 6184 1880 -208 668 N ATOM 3056 NH2 ARG A 283 32.330 68.015 -2.979 1.00 41.22 N ANISOU 3056 NH2 ARG A 283 3400 5507 6755 1747 1 521 N ATOM 0 H ARG A 283 30.242 73.540 1.170 1.00 36.34 H new ATOM 0 HA ARG A 283 27.917 72.958 0.034 1.00 28.52 H new ATOM 0 HB2 ARG A 283 29.578 71.299 1.612 1.00 34.42 H new ATOM 0 HB3 ARG A 283 28.295 70.771 0.899 1.00 34.42 H new ATOM 0 HG2 ARG A 283 29.329 71.335 -1.198 1.00 31.82 H new ATOM 0 HG3 ARG A 283 30.639 71.637 -0.408 1.00 31.82 H new ATOM 0 HD2 ARG A 283 30.617 69.359 0.381 1.00 36.44 H new ATOM 0 HD3 ARG A 283 29.402 69.086 -0.557 1.00 36.44 H new ATOM 0 HE ARG A 283 31.438 70.028 -1.986 1.00 33.85 H new ATOM 0 HH11 ARG A 283 30.489 67.138 -0.682 1.00 38.68 H new ATOM 0 HH12 ARG A 283 31.276 66.278 -1.609 1.00 38.68 H new ATOM 0 HH21 ARG A 283 32.631 68.715 -3.378 1.00 41.22 H new ATOM 0 HH22 ARG A 283 32.574 67.233 -3.241 1.00 41.22 H new ATOM 3070 N VAL A 284 26.210 72.815 1.803 1.00 26.42 N ANISOU 3070 N VAL A 284 3214 3589 3235 666 -957 -184 N ATOM 3071 CA VAL A 284 25.241 72.669 2.887 1.00 25.53 C ANISOU 3071 CA VAL A 284 3390 3415 2895 691 -916 -194 C ATOM 3072 C VAL A 284 25.576 71.409 3.673 1.00 29.64 C ANISOU 3072 C VAL A 284 3868 4104 3289 878 -1055 36 C ATOM 3073 O VAL A 284 25.834 70.358 3.087 1.00 32.07 O ANISOU 3073 O VAL A 284 4021 4367 3797 1098 -998 211 O ATOM 3074 CB VAL A 284 23.809 72.578 2.366 1.00 23.52 C ANISOU 3074 CB VAL A 284 3293 2894 2752 784 -650 -193 C ATOM 3075 CG1 VAL A 284 22.827 72.447 3.506 1.00 26.94 C ANISOU 3075 CG1 VAL A 284 3994 3262 2980 814 -552 -195 C ATOM 3076 CG2 VAL A 284 23.456 73.827 1.536 1.00 23.08 C ANISOU 3076 CG2 VAL A 284 3228 2679 2862 655 -508 -299 C ATOM 0 H VAL A 284 25.867 72.789 1.015 1.00 26.42 H new ATOM 0 HA VAL A 284 25.296 73.455 3.453 1.00 25.53 H new ATOM 0 HB VAL A 284 23.750 71.789 1.805 1.00 23.52 H new ATOM 0 HG11 VAL A 284 21.926 72.391 3.152 1.00 26.94 H new ATOM 0 HG12 VAL A 284 23.025 71.644 4.013 1.00 26.94 H new ATOM 0 HG13 VAL A 284 22.899 73.221 4.086 1.00 26.94 H new ATOM 0 HG21 VAL A 284 22.544 73.754 1.213 1.00 23.08 H new ATOM 0 HG22 VAL A 284 23.539 74.618 2.091 1.00 23.08 H new ATOM 0 HG23 VAL A 284 24.062 73.896 0.781 1.00 23.08 H new ATOM 3086 N GLY A 285 25.613 71.526 4.998 1.00 29.38 N ANISOU 3086 N GLY A 285 3989 4256 2917 776 -1206 49 N ATOM 3087 CA GLY A 285 25.951 70.396 5.842 1.00 32.28 C ANISOU 3087 CA GLY A 285 4308 4826 3130 953 -1363 358 C ATOM 3088 C GLY A 285 24.938 69.289 5.642 1.00 29.51 C ANISOU 3088 C GLY A 285 4103 4191 2918 1217 -1103 499 C ATOM 3089 O GLY A 285 23.768 69.549 5.404 1.00 31.40 O ANISOU 3089 O GLY A 285 4554 4186 3190 1176 -865 340 O ATOM 0 H GLY A 285 25.445 72.254 5.424 1.00 29.38 H new ATOM 0 HA2 GLY A 285 26.841 70.075 5.627 1.00 32.28 H new ATOM 0 HA3 GLY A 285 25.965 70.669 6.773 1.00 32.28 H new ATOM 3093 N ALA A 286 25.388 68.044 5.754 1.00 34.82 N ANISOU 3093 N ALA A 286 4642 4888 3702 1483 -1127 828 N ATOM 3094 CA ALA A 286 24.513 66.904 5.493 1.00 30.13 C ANISOU 3094 CA ALA A 286 4197 3967 3283 1677 -831 939 C ATOM 3095 C ALA A 286 23.307 66.850 6.441 1.00 32.08 C ANISOU 3095 C ALA A 286 4783 4152 3252 1622 -726 935 C ATOM 3096 O ALA A 286 22.197 66.566 6.015 1.00 31.79 O ANISOU 3096 O ALA A 286 4894 3847 3340 1613 -460 844 O ATOM 3097 CB ALA A 286 25.313 65.606 5.591 1.00 33.96 C ANISOU 3097 CB ALA A 286 4482 4401 4020 1822 -780 1234 C ATOM 0 H ALA A 286 26.192 67.837 5.979 1.00 34.82 H new ATOM 0 HA ALA A 286 24.162 67.013 4.595 1.00 30.13 H new ATOM 0 HB1 ALA A 286 24.729 64.852 5.417 1.00 33.96 H new ATOM 0 HB2 ALA A 286 26.029 65.617 4.937 1.00 33.96 H new ATOM 0 HB3 ALA A 286 25.690 65.524 6.481 1.00 33.96 H new ATOM 3103 N SER A 287 23.530 67.095 7.726 1.00 33.45 N ANISOU 3103 N SER A 287 5066 4611 3030 1543 -925 1044 N ATOM 3104 CA SER A 287 22.446 67.062 8.697 1.00 33.77 C ANISOU 3104 CA SER A 287 5449 4609 2773 1471 -772 1033 C ATOM 3105 C SER A 287 21.393 68.117 8.384 1.00 32.00 C ANISOU 3105 C SER A 287 5388 4197 2573 1284 -537 660 C ATOM 3106 O SER A 287 20.192 67.850 8.457 1.00 37.47 O ANISOU 3106 O SER A 287 6241 4678 3320 1313 -251 650 O ATOM 3107 CB SER A 287 22.983 67.277 10.113 1.00 37.87 C ANISOU 3107 CB SER A 287 6086 5541 2761 1335 -1042 1175 C ATOM 3108 OG SER A 287 23.851 66.222 10.511 1.00 46.92 O ANISOU 3108 OG SER A 287 6977 6834 4016 1441 -1213 1588 O ATOM 0 H SER A 287 24.302 67.282 8.056 1.00 33.45 H new ATOM 0 HA SER A 287 22.032 66.186 8.643 1.00 33.77 H new ATOM 0 HB2 SER A 287 23.459 68.121 10.154 1.00 37.87 H new ATOM 0 HB3 SER A 287 22.241 67.339 10.735 1.00 37.87 H new ATOM 0 HG SER A 287 24.568 66.269 10.076 1.00 46.92 H new ATOM 3114 N ALA A 288 21.852 69.320 8.047 1.00 34.84 N ANISOU 3114 N ALA A 288 5678 4630 2931 1098 -635 393 N ATOM 3115 CA ALA A 288 20.952 70.413 7.682 1.00 33.20 C ANISOU 3115 CA ALA A 288 5582 4202 2832 974 -377 105 C ATOM 3116 C ALA A 288 20.142 70.073 6.441 1.00 31.54 C ANISOU 3116 C ALA A 288 5215 3740 3031 1103 -182 150 C ATOM 3117 O ALA A 288 18.936 70.318 6.385 1.00 32.70 O ANISOU 3117 O ALA A 288 5436 3714 3274 1108 86 119 O ATOM 3118 CB ALA A 288 21.739 71.709 7.449 1.00 37.09 C ANISOU 3118 CB ALA A 288 6023 4766 3305 752 -497 -151 C ATOM 0 H ALA A 288 22.687 69.525 8.023 1.00 34.84 H new ATOM 0 HA ALA A 288 20.338 70.543 8.422 1.00 33.20 H new ATOM 0 HB1 ALA A 288 21.126 72.421 7.208 1.00 37.09 H new ATOM 0 HB2 ALA A 288 22.212 71.951 8.260 1.00 37.09 H new ATOM 0 HB3 ALA A 288 22.377 71.576 6.731 1.00 37.09 H new ATOM 3124 N LEU A 289 20.801 69.502 5.443 1.00 27.11 N ANISOU 3124 N LEU A 289 4420 3184 2696 1183 -303 233 N ATOM 3125 CA LEU A 289 20.105 69.150 4.210 1.00 27.15 C ANISOU 3125 CA LEU A 289 4303 3018 2994 1205 -149 244 C ATOM 3126 C LEU A 289 19.119 68.004 4.454 1.00 33.64 C ANISOU 3126 C LEU A 289 5233 3711 3836 1269 36 390 C ATOM 3127 O LEU A 289 18.000 68.011 3.957 1.00 27.65 O ANISOU 3127 O LEU A 289 4441 2861 3203 1195 204 387 O ATOM 3128 CB LEU A 289 21.113 68.769 3.131 1.00 27.47 C ANISOU 3128 CB LEU A 289 4136 3084 3215 1233 -255 249 C ATOM 3129 CG LEU A 289 20.565 68.607 1.720 1.00 27.14 C ANISOU 3129 CG LEU A 289 3993 2942 3375 1145 -128 200 C ATOM 3130 CD1 LEU A 289 19.822 69.862 1.264 1.00 27.70 C ANISOU 3130 CD1 LEU A 289 4006 3027 3491 1020 -91 139 C ATOM 3131 CD2 LEU A 289 21.719 68.292 0.788 1.00 28.19 C ANISOU 3131 CD2 LEU A 289 3975 3101 3635 1163 -173 165 C ATOM 0 H LEU A 289 21.639 69.311 5.456 1.00 27.11 H new ATOM 0 HA LEU A 289 19.601 69.922 3.907 1.00 27.15 H new ATOM 0 HB2 LEU A 289 21.808 69.446 3.112 1.00 27.47 H new ATOM 0 HB3 LEU A 289 21.536 67.935 3.391 1.00 27.47 H new ATOM 0 HG LEU A 289 19.924 67.879 1.706 1.00 27.14 H new ATOM 0 HD11 LEU A 289 19.485 69.730 0.364 1.00 27.70 H new ATOM 0 HD12 LEU A 289 19.080 70.035 1.864 1.00 27.70 H new ATOM 0 HD13 LEU A 289 20.429 70.619 1.274 1.00 27.70 H new ATOM 0 HD21 LEU A 289 21.385 68.186 -0.116 1.00 28.19 H new ATOM 0 HD22 LEU A 289 22.362 69.018 0.812 1.00 28.19 H new ATOM 0 HD23 LEU A 289 22.149 67.470 1.072 1.00 28.19 H new ATOM 3143 N PHE A 290 19.523 67.025 5.248 1.00 32.97 N ANISOU 3143 N PHE A 290 5252 3638 3636 1392 4 561 N ATOM 3144 CA PHE A 290 18.622 65.929 5.546 1.00 28.80 C ANISOU 3144 CA PHE A 290 4859 2945 3140 1430 218 709 C ATOM 3145 C PHE A 290 17.405 66.443 6.311 1.00 27.16 C ANISOU 3145 C PHE A 290 4790 2736 2793 1353 393 685 C ATOM 3146 O PHE A 290 16.276 66.022 6.044 1.00 30.76 O ANISOU 3146 O PHE A 290 5235 3068 3383 1283 606 724 O ATOM 3147 CB PHE A 290 19.324 64.835 6.355 1.00 29.79 C ANISOU 3147 CB PHE A 290 5037 3087 3193 1568 177 946 C ATOM 3148 CG PHE A 290 18.461 63.627 6.596 1.00 33.12 C ANISOU 3148 CG PHE A 290 5566 3313 3705 1540 432 1062 C ATOM 3149 CD1 PHE A 290 17.612 63.568 7.686 1.00 32.68 C ANISOU 3149 CD1 PHE A 290 5715 3267 3436 1536 557 1177 C ATOM 3150 CD2 PHE A 290 18.496 62.557 5.723 1.00 33.40 C ANISOU 3150 CD2 PHE A 290 5539 3134 4018 1496 587 1043 C ATOM 3151 CE1 PHE A 290 16.812 62.467 7.902 1.00 32.76 C ANISOU 3151 CE1 PHE A 290 5809 3092 3547 1491 803 1286 C ATOM 3152 CE2 PHE A 290 17.696 61.454 5.930 1.00 32.92 C ANISOU 3152 CE2 PHE A 290 5611 2860 4036 1440 842 1131 C ATOM 3153 CZ PHE A 290 16.854 61.408 7.016 1.00 39.57 C ANISOU 3153 CZ PHE A 290 6605 3730 4702 1438 935 1263 C ATOM 0 H PHE A 290 20.298 66.976 5.617 1.00 32.97 H new ATOM 0 HA PHE A 290 18.333 65.543 4.704 1.00 28.80 H new ATOM 0 HB2 PHE A 290 20.129 64.562 5.887 1.00 29.79 H new ATOM 0 HB3 PHE A 290 19.603 65.201 7.209 1.00 29.79 H new ATOM 0 HD1 PHE A 290 17.581 64.281 8.282 1.00 32.68 H new ATOM 0 HD2 PHE A 290 19.065 62.581 4.988 1.00 33.40 H new ATOM 0 HE1 PHE A 290 16.247 62.437 8.640 1.00 32.76 H new ATOM 0 HE2 PHE A 290 17.726 60.740 5.335 1.00 32.92 H new ATOM 0 HZ PHE A 290 16.313 60.664 7.154 1.00 39.57 H new ATOM 3163 N SER A 291 17.636 67.353 7.259 1.00 28.84 N ANISOU 3163 N SER A 291 5131 3091 2736 1332 334 607 N ATOM 3164 CA SER A 291 16.558 67.913 8.048 1.00 33.00 C ANISOU 3164 CA SER A 291 5826 3579 3134 1277 594 552 C ATOM 3165 C SER A 291 15.526 68.576 7.128 1.00 34.39 C ANISOU 3165 C SER A 291 5803 3629 3634 1236 788 478 C ATOM 3166 O SER A 291 14.327 68.393 7.311 1.00 30.85 O ANISOU 3166 O SER A 291 5339 3100 3282 1234 1057 569 O ATOM 3167 CB SER A 291 17.101 68.918 9.068 1.00 32.99 C ANISOU 3167 CB SER A 291 6041 3726 2768 1185 537 383 C ATOM 3168 OG SER A 291 16.054 69.466 9.853 1.00 41.91 O ANISOU 3168 OG SER A 291 7383 4762 3777 1137 896 290 O ATOM 0 H SER A 291 18.417 67.656 7.456 1.00 28.84 H new ATOM 0 HA SER A 291 16.123 67.196 8.537 1.00 33.00 H new ATOM 0 HB2 SER A 291 17.747 68.481 9.645 1.00 32.99 H new ATOM 0 HB3 SER A 291 17.570 69.631 8.606 1.00 32.99 H new ATOM 0 HG SER A 291 16.374 70.012 10.405 1.00 41.91 H new ATOM 3174 N TYR A 292 15.989 69.317 6.121 1.00 28.45 N ANISOU 3174 N TYR A 292 4859 2891 3061 1203 650 373 N ATOM 3175 CA TYR A 292 15.066 69.921 5.163 1.00 28.62 C ANISOU 3175 CA TYR A 292 4636 2853 3384 1176 782 412 C ATOM 3176 C TYR A 292 14.248 68.879 4.398 1.00 22.86 C ANISOU 3176 C TYR A 292 3723 2141 2820 1100 809 576 C ATOM 3177 O TYR A 292 13.027 68.980 4.285 1.00 24.98 O ANISOU 3177 O TYR A 292 3830 2413 3248 1070 998 713 O ATOM 3178 CB TYR A 292 15.832 70.795 4.165 1.00 29.94 C ANISOU 3178 CB TYR A 292 4647 3053 3676 1139 606 321 C ATOM 3179 CG TYR A 292 14.949 71.512 3.169 1.00 23.84 C ANISOU 3179 CG TYR A 292 3598 2265 3194 1128 709 455 C ATOM 3180 CD1 TYR A 292 14.202 72.606 3.544 1.00 24.48 C ANISOU 3180 CD1 TYR A 292 3662 2211 3430 1224 989 501 C ATOM 3181 CD2 TYR A 292 14.899 71.111 1.835 1.00 23.09 C ANISOU 3181 CD2 TYR A 292 3261 2303 3211 1014 545 560 C ATOM 3182 CE1 TYR A 292 13.390 73.280 2.639 1.00 23.44 C ANISOU 3182 CE1 TYR A 292 3202 2114 3590 1231 1060 727 C ATOM 3183 CE2 TYR A 292 14.094 71.753 0.934 1.00 22.68 C ANISOU 3183 CE2 TYR A 292 2917 2329 3370 983 580 769 C ATOM 3184 CZ TYR A 292 13.373 72.856 1.323 1.00 22.49 C ANISOU 3184 CZ TYR A 292 2812 2183 3551 1139 827 902 C ATOM 3185 OH TYR A 292 12.571 73.526 0.437 1.00 24.64 O ANISOU 3185 OH TYR A 292 2739 2573 4053 1123 850 1192 O ATOM 0 H TYR A 292 16.821 69.480 5.977 1.00 28.45 H new ATOM 0 HA TYR A 292 14.448 70.464 5.677 1.00 28.62 H new ATOM 0 HB2 TYR A 292 16.350 71.452 4.656 1.00 29.94 H new ATOM 0 HB3 TYR A 292 16.464 70.240 3.682 1.00 29.94 H new ATOM 0 HD1 TYR A 292 14.242 72.902 4.425 1.00 24.48 H new ATOM 0 HD2 TYR A 292 15.421 70.395 1.553 1.00 23.09 H new ATOM 0 HE1 TYR A 292 12.870 74.000 2.913 1.00 23.44 H new ATOM 0 HE2 TYR A 292 14.035 71.443 0.059 1.00 22.68 H new ATOM 0 HH TYR A 292 12.566 73.121 -0.299 1.00 24.64 H new ATOM 3195 N PHE A 293 14.924 67.858 3.883 1.00 26.34 N ANISOU 3195 N PHE A 293 4181 2590 3236 1045 650 563 N ATOM 3196 CA PHE A 293 14.263 66.881 3.023 1.00 25.81 C ANISOU 3196 CA PHE A 293 3997 2516 3293 868 692 631 C ATOM 3197 C PHE A 293 13.259 65.994 3.781 1.00 23.96 C ANISOU 3197 C PHE A 293 3857 2196 3052 824 916 758 C ATOM 3198 O PHE A 293 12.318 65.493 3.171 1.00 30.55 O ANISOU 3198 O PHE A 293 4535 3069 4003 603 990 825 O ATOM 3199 CB PHE A 293 15.314 65.980 2.335 1.00 26.24 C ANISOU 3199 CB PHE A 293 4124 2502 3342 826 585 535 C ATOM 3200 CG PHE A 293 16.038 66.621 1.160 1.00 26.69 C ANISOU 3200 CG PHE A 293 4028 2668 3445 760 419 422 C ATOM 3201 CD1 PHE A 293 15.394 67.441 0.258 1.00 26.13 C ANISOU 3201 CD1 PHE A 293 3729 2762 3436 608 364 460 C ATOM 3202 CD2 PHE A 293 17.379 66.342 0.947 1.00 33.50 C ANISOU 3202 CD2 PHE A 293 4949 3480 4300 858 338 332 C ATOM 3203 CE1 PHE A 293 16.078 68.014 -0.811 1.00 28.93 C ANISOU 3203 CE1 PHE A 293 3970 3225 3798 535 229 392 C ATOM 3204 CE2 PHE A 293 18.063 66.895 -0.118 1.00 33.86 C ANISOU 3204 CE2 PHE A 293 4863 3622 4381 785 234 231 C ATOM 3205 CZ PHE A 293 17.417 67.730 -0.996 1.00 29.97 C ANISOU 3205 CZ PHE A 293 4198 3287 3903 610 179 249 C ATOM 0 H PHE A 293 15.761 67.712 4.018 1.00 26.34 H new ATOM 0 HA PHE A 293 13.765 67.389 2.363 1.00 25.81 H new ATOM 0 HB2 PHE A 293 15.972 65.711 2.995 1.00 26.24 H new ATOM 0 HB3 PHE A 293 14.875 65.172 2.026 1.00 26.24 H new ATOM 0 HD1 PHE A 293 14.487 67.615 0.365 1.00 26.13 H new ATOM 0 HD2 PHE A 293 17.826 65.773 1.531 1.00 33.50 H new ATOM 0 HE1 PHE A 293 15.636 68.585 -1.397 1.00 28.93 H new ATOM 0 HE2 PHE A 293 18.964 66.701 -0.241 1.00 33.86 H new ATOM 0 HZ PHE A 293 17.879 68.103 -1.712 1.00 29.97 H new ATOM 3215 N GLU A 294 13.446 65.814 5.094 1.00 24.48 N ANISOU 3215 N GLU A 294 4166 2184 2949 986 1016 804 N ATOM 3216 CA GLU A 294 12.552 64.985 5.902 1.00 26.34 C ANISOU 3216 CA GLU A 294 4523 2328 3157 952 1264 951 C ATOM 3217 C GLU A 294 11.317 65.730 6.402 1.00 27.62 C ANISOU 3217 C GLU A 294 4568 2550 3377 952 1508 1026 C ATOM 3218 O GLU A 294 10.396 65.125 6.902 1.00 31.44 O ANISOU 3218 O GLU A 294 5067 2986 3891 883 1749 1160 O ATOM 3219 CB GLU A 294 13.296 64.398 7.113 1.00 35.97 C ANISOU 3219 CB GLU A 294 6066 3478 4124 1119 1273 1039 C ATOM 3220 CG GLU A 294 13.602 65.371 8.246 1.00 47.34 C ANISOU 3220 CG GLU A 294 7674 5045 5269 1238 1265 994 C ATOM 3221 CD GLU A 294 14.068 64.673 9.523 1.00 54.01 C ANISOU 3221 CD GLU A 294 8822 5916 5784 1332 1273 1173 C ATOM 3222 OE1 GLU A 294 14.061 63.416 9.580 1.00 39.37 O ANISOU 3222 OE1 GLU A 294 6977 3953 4028 1334 1312 1328 O ATOM 3223 OE2 GLU A 294 14.434 65.390 10.480 1.00 47.23 O ANISOU 3223 OE2 GLU A 294 8149 5220 4578 1348 1230 1113 O ATOM 0 H GLU A 294 14.093 66.169 5.536 1.00 24.48 H new ATOM 0 HA GLU A 294 12.251 64.277 5.311 1.00 26.34 H new ATOM 0 HB2 GLU A 294 12.768 63.668 7.472 1.00 35.97 H new ATOM 0 HB3 GLU A 294 14.133 64.017 6.803 1.00 35.97 H new ATOM 0 HG2 GLU A 294 14.287 65.993 7.955 1.00 47.34 H new ATOM 0 HG3 GLU A 294 12.808 65.893 8.440 1.00 47.34 H new ATOM 3230 N GLN A 295 11.301 67.055 6.282 1.00 27.00 N ANISOU 3230 N GLN A 295 4368 2540 3352 1043 1504 956 N ATOM 3231 CA GLN A 295 10.099 67.790 6.622 1.00 29.17 C ANISOU 3231 CA GLN A 295 4476 2817 3790 1094 1818 1064 C ATOM 3232 C GLN A 295 8.935 67.253 5.788 1.00 29.84 C ANISOU 3232 C GLN A 295 4170 3017 4152 907 1857 1277 C ATOM 3233 O GLN A 295 9.085 67.014 4.593 1.00 28.60 O ANISOU 3233 O GLN A 295 3803 2982 4082 730 1597 1285 O ATOM 3234 CB GLN A 295 10.301 69.287 6.373 1.00 28.61 C ANISOU 3234 CB GLN A 295 4309 2726 3834 1227 1843 982 C ATOM 3235 CG GLN A 295 11.309 69.952 7.290 1.00 34.82 C ANISOU 3235 CG GLN A 295 5485 3421 4324 1311 1850 731 C ATOM 3236 CD GLN A 295 11.070 69.604 8.743 1.00 50.66 C ANISOU 3236 CD GLN A 295 7844 5380 6025 1328 2116 695 C ATOM 3237 OE1 GLN A 295 9.989 69.854 9.285 1.00 47.33 O ANISOU 3237 OE1 GLN A 295 7400 4875 5709 1386 2533 773 O ATOM 3238 NE2 GLN A 295 12.068 68.998 9.379 1.00 52.83 N ANISOU 3238 NE2 GLN A 295 8419 5735 5920 1282 1891 623 N ATOM 0 H GLN A 295 11.962 67.534 6.011 1.00 27.00 H new ATOM 0 HA GLN A 295 9.899 67.671 7.564 1.00 29.17 H new ATOM 0 HB2 GLN A 295 10.585 69.414 5.454 1.00 28.61 H new ATOM 0 HB3 GLN A 295 9.447 69.737 6.471 1.00 28.61 H new ATOM 0 HG2 GLN A 295 12.205 69.680 7.036 1.00 34.82 H new ATOM 0 HG3 GLN A 295 11.262 70.914 7.177 1.00 34.82 H new ATOM 0 HE21 GLN A 295 12.807 68.840 8.968 1.00 52.83 H new ATOM 0 HE22 GLN A 295 11.975 68.764 10.201 1.00 52.83 H new ATOM 3247 N ALA A 296 7.786 67.049 6.420 1.00 31.58 N ANISOU 3247 N ALA A 296 3910 2912 5177 953 1893 414 N ATOM 3248 CA ALA A 296 6.655 66.382 5.771 1.00 30.79 C ANISOU 3248 CA ALA A 296 3658 2696 5345 925 1885 458 C ATOM 3249 C ALA A 296 6.284 66.921 4.386 1.00 32.58 C ANISOU 3249 C ALA A 296 3728 2876 5775 955 1634 479 C ATOM 3250 O ALA A 296 6.045 66.140 3.468 1.00 31.90 O ANISOU 3250 O ALA A 296 3580 2768 5772 943 1530 536 O ATOM 3251 CB ALA A 296 5.445 66.448 6.672 1.00 33.63 C ANISOU 3251 CB ALA A 296 3890 2976 5912 861 2108 362 C ATOM 0 H ALA A 296 7.637 67.290 7.232 1.00 31.58 H new ATOM 0 HA ALA A 296 6.946 65.468 5.625 1.00 30.79 H new ATOM 0 HB1 ALA A 296 4.696 66.006 6.242 1.00 33.63 H new ATOM 0 HB2 ALA A 296 5.642 66.005 7.512 1.00 33.63 H new ATOM 0 HB3 ALA A 296 5.218 67.376 6.842 1.00 33.63 H new ATOM 3257 N HIS A 297 6.241 68.242 4.220 1.00 28.93 N ANISOU 3257 N HIS A 297 3246 2371 5376 1005 1544 439 N ATOM 3258 CA HIS A 297 5.898 68.814 2.923 1.00 29.26 C ANISOU 3258 CA HIS A 297 3237 2331 5549 1084 1280 485 C ATOM 3259 C HIS A 297 6.954 68.517 1.883 1.00 28.38 C ANISOU 3259 C HIS A 297 3297 2237 5249 1039 1117 574 C ATOM 3260 O HIS A 297 6.634 68.204 0.746 1.00 32.50 O ANISOU 3260 O HIS A 297 3774 2729 5847 1051 904 647 O ATOM 3261 CB HIS A 297 5.693 70.328 3.041 1.00 31.01 C ANISOU 3261 CB HIS A 297 3517 2430 5833 1182 1258 435 C ATOM 3262 CG HIS A 297 4.388 70.696 3.659 1.00 33.75 C ANISOU 3262 CG HIS A 297 3639 2751 6432 1280 1327 329 C ATOM 3263 ND1 HIS A 297 3.401 71.362 2.968 1.00 40.32 N ANISOU 3263 ND1 HIS A 297 4354 3506 7461 1492 1118 308 N ATOM 3264 CD2 HIS A 297 3.889 70.447 4.892 1.00 36.51 C ANISOU 3264 CD2 HIS A 297 3862 3152 6857 1209 1579 217 C ATOM 3265 CE1 HIS A 297 2.355 71.522 3.758 1.00 40.44 C ANISOU 3265 CE1 HIS A 297 4128 3555 7682 1556 1247 157 C ATOM 3266 NE2 HIS A 297 2.620 70.966 4.927 1.00 41.28 N ANISOU 3266 NE2 HIS A 297 4233 3727 7727 1352 1542 99 N ATOM 0 H HIS A 297 6.405 68.817 4.838 1.00 28.93 H new ATOM 0 HA HIS A 297 5.069 68.400 2.635 1.00 29.26 H new ATOM 0 HB2 HIS A 297 6.413 70.706 3.570 1.00 31.01 H new ATOM 0 HB3 HIS A 297 5.750 70.726 2.158 1.00 31.01 H new ATOM 0 HD2 HIS A 297 4.325 70.007 5.586 1.00 36.51 H new ATOM 0 HE1 HIS A 297 1.564 71.954 3.530 1.00 40.44 H new ATOM 0 HE2 HIS A 297 2.085 70.935 5.599 1.00 41.28 H new ATOM 3273 N ILE A 298 8.213 68.592 2.289 1.00 25.84 N ANISOU 3273 N ILE A 298 3153 1978 4686 990 1230 541 N ATOM 3274 CA ILE A 298 9.314 68.371 1.360 1.00 24.53 C ANISOU 3274 CA ILE A 298 3144 1826 4348 943 1128 572 C ATOM 3275 C ILE A 298 9.411 66.892 1.000 1.00 31.08 C ANISOU 3275 C ILE A 298 3922 2758 5129 924 1065 626 C ATOM 3276 O ILE A 298 9.577 66.542 -0.167 1.00 28.62 O ANISOU 3276 O ILE A 298 3644 2422 4808 858 887 686 O ATOM 3277 CB ILE A 298 10.644 68.872 1.943 1.00 26.36 C ANISOU 3277 CB ILE A 298 3528 2183 4304 885 1289 422 C ATOM 3278 CG1 ILE A 298 10.542 70.360 2.291 1.00 25.28 C ANISOU 3278 CG1 ILE A 298 3503 1883 4219 858 1423 345 C ATOM 3279 CG2 ILE A 298 11.793 68.608 0.953 1.00 22.85 C ANISOU 3279 CG2 ILE A 298 3196 1891 3594 723 1146 356 C ATOM 3280 CD1 ILE A 298 10.151 71.255 1.125 1.00 26.66 C ANISOU 3280 CD1 ILE A 298 3860 1773 4498 839 1262 446 C ATOM 0 H ILE A 298 8.453 68.769 3.096 1.00 25.84 H new ATOM 0 HA ILE A 298 9.134 68.879 0.553 1.00 24.53 H new ATOM 0 HB ILE A 298 10.835 68.385 2.760 1.00 26.36 H new ATOM 0 HG12 ILE A 298 9.891 70.470 3.001 1.00 25.28 H new ATOM 0 HG13 ILE A 298 11.396 70.658 2.641 1.00 25.28 H new ATOM 0 HG21 ILE A 298 12.627 68.928 1.332 1.00 22.85 H new ATOM 0 HG22 ILE A 298 11.861 67.656 0.782 1.00 22.85 H new ATOM 0 HG23 ILE A 298 11.617 69.074 0.121 1.00 22.85 H new ATOM 0 HD11 ILE A 298 10.108 72.177 1.424 1.00 26.66 H new ATOM 0 HD12 ILE A 298 10.812 71.175 0.420 1.00 26.66 H new ATOM 0 HD13 ILE A 298 9.283 70.985 0.786 1.00 26.66 H new ATOM 3292 N LYS A 299 9.285 66.021 1.994 1.00 26.41 N ANISOU 3292 N LYS A 299 3301 2255 4479 956 1222 607 N ATOM 3293 CA LYS A 299 9.280 64.570 1.760 1.00 28.24 C ANISOU 3293 CA LYS A 299 3566 2503 4662 950 1227 661 C ATOM 3294 C LYS A 299 8.229 64.168 0.734 1.00 24.69 C ANISOU 3294 C LYS A 299 2969 1933 4477 872 1122 723 C ATOM 3295 O LYS A 299 8.495 63.356 -0.160 1.00 26.16 O ANISOU 3295 O LYS A 299 3200 2109 4630 812 1029 763 O ATOM 3296 CB LYS A 299 9.020 63.817 3.065 1.00 28.24 C ANISOU 3296 CB LYS A 299 3648 2503 4578 998 1463 664 C ATOM 3297 CG LYS A 299 9.070 62.295 2.949 1.00 27.04 C ANISOU 3297 CG LYS A 299 3654 2287 4332 1012 1540 726 C ATOM 3298 CD LYS A 299 9.202 61.676 4.363 1.00 30.29 C ANISOU 3298 CD LYS A 299 4307 2679 4523 1119 1777 753 C ATOM 3299 CE LYS A 299 8.882 60.207 4.445 1.00 55.00 C ANISOU 3299 CE LYS A 299 7689 5625 7582 1110 1961 824 C ATOM 3300 NZ LYS A 299 9.145 59.753 5.838 1.00 62.03 N ANISOU 3300 NZ LYS A 299 8912 6479 8177 1259 2171 878 N ATOM 0 H LYS A 299 9.200 66.246 2.820 1.00 26.41 H new ATOM 0 HA LYS A 299 10.155 64.334 1.414 1.00 28.24 H new ATOM 0 HB2 LYS A 299 9.675 64.100 3.723 1.00 28.24 H new ATOM 0 HB3 LYS A 299 8.148 64.074 3.404 1.00 28.24 H new ATOM 0 HG2 LYS A 299 8.267 61.967 2.515 1.00 27.04 H new ATOM 0 HG3 LYS A 299 9.821 62.027 2.396 1.00 27.04 H new ATOM 0 HD2 LYS A 299 10.109 61.814 4.679 1.00 30.29 H new ATOM 0 HD3 LYS A 299 8.615 62.156 4.968 1.00 30.29 H new ATOM 0 HE2 LYS A 299 7.955 60.048 4.206 1.00 55.00 H new ATOM 0 HE3 LYS A 299 9.426 59.706 3.817 1.00 55.00 H new ATOM 0 HZ1 LYS A 299 8.961 58.885 5.907 1.00 62.03 H new ATOM 0 HZ2 LYS A 299 10.001 59.892 6.039 1.00 62.03 H new ATOM 0 HZ3 LYS A 299 8.630 60.211 6.402 1.00 62.03 H new ATOM 3314 N ALA A 300 7.041 64.752 0.843 1.00 28.72 N ANISOU 3314 N ALA A 300 3280 2374 5259 885 1134 705 N ATOM 3315 CA ALA A 300 5.974 64.452 -0.094 1.00 27.35 C ANISOU 3315 CA ALA A 300 2879 2149 5364 854 1013 718 C ATOM 3316 C ALA A 300 6.350 64.873 -1.501 1.00 30.50 C ANISOU 3316 C ALA A 300 3332 2568 5690 824 681 791 C ATOM 3317 O ALA A 300 6.089 64.153 -2.459 1.00 32.11 O ANISOU 3317 O ALA A 300 3468 2829 5903 701 545 798 O ATOM 3318 CB ALA A 300 4.685 65.130 0.332 1.00 33.70 C ANISOU 3318 CB ALA A 300 3394 2927 6482 951 1063 628 C ATOM 0 H ALA A 300 6.835 65.323 1.452 1.00 28.72 H new ATOM 0 HA ALA A 300 5.836 63.492 -0.092 1.00 27.35 H new ATOM 0 HB1 ALA A 300 3.983 64.920 -0.304 1.00 33.70 H new ATOM 0 HB2 ALA A 300 4.429 64.814 1.212 1.00 33.70 H new ATOM 0 HB3 ALA A 300 4.818 66.090 0.360 1.00 33.70 H new ATOM 3324 N ASN A 301 6.954 66.047 -1.640 1.00 28.46 N ANISOU 3324 N ASN A 301 3233 2257 5323 892 578 826 N ATOM 3325 CA ASN A 301 7.404 66.496 -2.956 1.00 28.36 C ANISOU 3325 CA ASN A 301 3382 2217 5178 822 309 901 C ATOM 3326 C ASN A 301 8.471 65.568 -3.516 1.00 31.55 C ANISOU 3326 C ASN A 301 3921 2736 5331 625 299 875 C ATOM 3327 O ASN A 301 8.485 65.280 -4.710 1.00 30.39 O ANISOU 3327 O ASN A 301 3809 2618 5119 494 100 910 O ATOM 3328 CB ASN A 301 7.947 67.915 -2.895 1.00 30.36 C ANISOU 3328 CB ASN A 301 3885 2339 5312 867 298 912 C ATOM 3329 CG ASN A 301 6.857 68.945 -2.704 1.00 38.97 C ANISOU 3329 CG ASN A 301 4908 3334 6563 1064 218 906 C ATOM 3330 OD1 ASN A 301 5.706 68.709 -3.047 1.00 39.03 O ANISOU 3330 OD1 ASN A 301 4668 3374 6787 1195 69 924 O ATOM 3331 ND2 ASN A 301 7.216 70.093 -2.155 1.00 38.35 N ANISOU 3331 ND2 ASN A 301 5033 3138 6402 1098 329 859 N ATOM 0 H ASN A 301 7.112 66.594 -0.996 1.00 28.46 H new ATOM 0 HA ASN A 301 6.633 66.480 -3.544 1.00 28.36 H new ATOM 0 HB2 ASN A 301 8.584 67.983 -2.166 1.00 30.36 H new ATOM 0 HB3 ASN A 301 8.431 68.108 -3.713 1.00 30.36 H new ATOM 0 HD21 ASN A 301 6.631 70.710 -2.026 1.00 38.35 H new ATOM 0 HD22 ASN A 301 8.035 70.223 -1.927 1.00 38.35 H new ATOM 3338 N MET A 302 9.365 65.111 -2.643 1.00 28.02 N ANISOU 3338 N MET A 302 3544 2372 4731 631 504 795 N ATOM 3339 CA MET A 302 10.425 64.188 -3.039 1.00 26.32 C ANISOU 3339 CA MET A 302 3426 2285 4288 529 504 727 C ATOM 3340 C MET A 302 9.821 62.865 -3.514 1.00 27.20 C ANISOU 3340 C MET A 302 3457 2376 4501 464 499 761 C ATOM 3341 O MET A 302 10.257 62.294 -4.513 1.00 26.92 O ANISOU 3341 O MET A 302 3474 2391 4362 316 396 731 O ATOM 3342 CB MET A 302 11.386 63.965 -1.868 1.00 23.24 C ANISOU 3342 CB MET A 302 3099 2024 3709 657 690 624 C ATOM 3343 CG MET A 302 12.196 65.209 -1.493 1.00 26.64 C ANISOU 3343 CG MET A 302 3597 2546 3980 633 728 504 C ATOM 3344 SD MET A 302 13.437 65.627 -2.695 1.00 27.68 S ANISOU 3344 SD MET A 302 3852 2817 3850 375 612 339 S ATOM 3345 CE MET A 302 14.780 64.511 -2.203 1.00 20.02 C ANISOU 3345 CE MET A 302 2806 2184 2617 498 672 118 C ATOM 0 H MET A 302 9.375 65.325 -1.810 1.00 28.02 H new ATOM 0 HA MET A 302 10.926 64.572 -3.776 1.00 26.32 H new ATOM 0 HB2 MET A 302 10.879 63.674 -1.094 1.00 23.24 H new ATOM 0 HB3 MET A 302 11.997 63.246 -2.094 1.00 23.24 H new ATOM 0 HG2 MET A 302 11.592 65.960 -1.386 1.00 26.64 H new ATOM 0 HG3 MET A 302 12.622 65.063 -0.634 1.00 26.64 H new ATOM 0 HE1 MET A 302 15.437 64.462 -2.915 1.00 20.02 H new ATOM 0 HE2 MET A 302 15.202 64.848 -1.397 1.00 20.02 H new ATOM 0 HE3 MET A 302 14.420 63.626 -2.034 1.00 20.02 H new ATOM 3355 N GLN A 303 8.799 62.391 -2.809 1.00 26.64 N ANISOU 3355 N GLN A 303 3267 2228 4625 524 650 788 N ATOM 3356 CA GLN A 303 8.164 61.136 -3.174 1.00 26.55 C ANISOU 3356 CA GLN A 303 3206 2179 4701 395 726 771 C ATOM 3357 C GLN A 303 7.505 61.239 -4.539 1.00 29.05 C ANISOU 3357 C GLN A 303 3361 2555 5121 225 481 769 C ATOM 3358 O GLN A 303 7.483 60.272 -5.302 1.00 28.59 O ANISOU 3358 O GLN A 303 3315 2519 5028 43 477 724 O ATOM 3359 CB GLN A 303 7.150 60.723 -2.092 1.00 28.73 C ANISOU 3359 CB GLN A 303 3403 2366 5146 420 999 745 C ATOM 3360 CG GLN A 303 7.830 60.209 -0.838 1.00 29.95 C ANISOU 3360 CG GLN A 303 3822 2446 5113 566 1253 767 C ATOM 3361 CD GLN A 303 6.903 60.070 0.360 1.00 38.15 C ANISOU 3361 CD GLN A 303 4847 3383 6268 564 1551 739 C ATOM 3362 OE1 GLN A 303 5.955 60.831 0.518 1.00 40.11 O ANISOU 3362 OE1 GLN A 303 4824 3664 6751 533 1549 679 O ATOM 3363 NE2 GLN A 303 7.192 59.104 1.219 1.00 45.89 N ANISOU 3363 NE2 GLN A 303 6146 4228 7060 614 1815 772 N ATOM 0 H GLN A 303 8.462 62.780 -2.120 1.00 26.64 H new ATOM 0 HA GLN A 303 8.845 60.447 -3.232 1.00 26.55 H new ATOM 0 HB2 GLN A 303 6.592 61.484 -1.867 1.00 28.73 H new ATOM 0 HB3 GLN A 303 6.564 60.036 -2.445 1.00 28.73 H new ATOM 0 HG2 GLN A 303 8.228 59.345 -1.029 1.00 29.95 H new ATOM 0 HG3 GLN A 303 8.555 60.810 -0.606 1.00 29.95 H new ATOM 0 HE21 GLN A 303 7.865 58.589 1.076 1.00 45.89 H new ATOM 0 HE22 GLN A 303 6.706 58.992 1.920 1.00 45.89 H new ATOM 3372 N SER A 304 7.019 62.428 -4.877 1.00 30.97 N ANISOU 3372 N SER A 304 3491 2819 5459 302 266 814 N ATOM 3373 CA SER A 304 6.450 62.641 -6.197 1.00 30.46 C ANISOU 3373 CA SER A 304 3317 2833 5423 207 -34 834 C ATOM 3374 C SER A 304 7.493 62.546 -7.315 1.00 32.48 C ANISOU 3374 C SER A 304 3809 3119 5414 29 -187 858 C ATOM 3375 O SER A 304 7.135 62.314 -8.466 1.00 35.12 O ANISOU 3375 O SER A 304 4094 3541 5711 -123 -393 856 O ATOM 3376 CB SER A 304 5.748 63.997 -6.259 1.00 34.25 C ANISOU 3376 CB SER A 304 3708 3281 6023 426 -249 902 C ATOM 3377 OG SER A 304 4.522 63.972 -5.547 1.00 57.75 O ANISOU 3377 OG SER A 304 6352 6304 9286 553 -156 809 O ATOM 0 H SER A 304 7.010 63.116 -4.362 1.00 30.97 H new ATOM 0 HA SER A 304 5.807 61.929 -6.342 1.00 30.46 H new ATOM 0 HB2 SER A 304 6.327 64.681 -5.888 1.00 34.25 H new ATOM 0 HB3 SER A 304 5.583 64.237 -7.184 1.00 34.25 H new ATOM 0 HG SER A 304 4.155 64.726 -5.593 1.00 57.75 H new ATOM 3383 N LEU A 305 8.772 62.727 -6.989 1.00 26.01 N ANISOU 3383 N LEU A 305 3218 2271 4395 29 -81 839 N ATOM 3384 CA LEU A 305 9.849 62.544 -7.965 1.00 24.86 C ANISOU 3384 CA LEU A 305 3261 2188 3995 -181 -158 781 C ATOM 3385 C LEU A 305 10.355 61.114 -8.054 1.00 22.98 C ANISOU 3385 C LEU A 305 3020 2005 3706 -282 -6 669 C ATOM 3386 O LEU A 305 11.255 60.817 -8.859 1.00 29.09 O ANISOU 3386 O LEU A 305 3908 2854 4292 -458 -41 568 O ATOM 3387 CB LEU A 305 11.034 63.443 -7.628 1.00 25.33 C ANISOU 3387 CB LEU A 305 3519 2256 3850 -170 -97 720 C ATOM 3388 CG LEU A 305 10.733 64.929 -7.546 1.00 27.40 C ANISOU 3388 CG LEU A 305 3907 2388 4115 -94 -186 816 C ATOM 3389 CD1 LEU A 305 11.985 65.694 -7.125 1.00 29.18 C ANISOU 3389 CD1 LEU A 305 4326 2647 4114 -170 -34 677 C ATOM 3390 CD2 LEU A 305 10.224 65.461 -8.878 1.00 26.86 C ANISOU 3390 CD2 LEU A 305 3988 2243 3976 -207 -466 934 C ATOM 0 H LEU A 305 9.039 62.957 -6.205 1.00 26.01 H new ATOM 0 HA LEU A 305 9.461 62.779 -8.823 1.00 24.86 H new ATOM 0 HB2 LEU A 305 11.403 63.158 -6.778 1.00 25.33 H new ATOM 0 HB3 LEU A 305 11.723 63.306 -8.297 1.00 25.33 H new ATOM 0 HG LEU A 305 10.038 65.059 -6.882 1.00 27.40 H new ATOM 0 HD11 LEU A 305 11.784 66.642 -7.075 1.00 29.18 H new ATOM 0 HD12 LEU A 305 12.279 65.380 -6.256 1.00 29.18 H new ATOM 0 HD13 LEU A 305 12.689 65.547 -7.776 1.00 29.18 H new ATOM 0 HD21 LEU A 305 10.040 66.410 -8.799 1.00 26.86 H new ATOM 0 HD22 LEU A 305 10.897 65.319 -9.562 1.00 26.86 H new ATOM 0 HD23 LEU A 305 9.410 64.994 -9.124 1.00 26.86 H new ATOM 3402 N GLY A 306 9.814 60.238 -7.208 1.00 27.44 N ANISOU 3402 N GLY A 306 3495 2481 4451 96 291 1521 N ATOM 3403 CA GLY A 306 10.199 58.843 -7.167 1.00 27.21 C ANISOU 3403 CA GLY A 306 3584 2448 4307 22 291 1460 C ATOM 3404 C GLY A 306 11.132 58.492 -6.030 1.00 25.25 C ANISOU 3404 C GLY A 306 3408 2142 4045 190 310 1278 C ATOM 3405 O GLY A 306 11.617 57.372 -5.955 1.00 25.10 O ANISOU 3405 O GLY A 306 3499 2094 3944 165 307 1211 O ATOM 0 H GLY A 306 9.206 60.447 -6.637 1.00 27.44 H new ATOM 0 HA2 GLY A 306 9.399 58.299 -7.096 1.00 27.21 H new ATOM 0 HA3 GLY A 306 10.626 58.611 -8.006 1.00 27.21 H new ATOM 3409 N VAL A 307 11.398 59.443 -5.140 1.00 25.29 N ANISOU 3409 N VAL A 307 3370 2117 4121 359 325 1203 N ATOM 3410 CA VAL A 307 12.266 59.148 -3.999 1.00 25.06 C ANISOU 3410 CA VAL A 307 3405 2046 4070 492 332 1051 C ATOM 3411 C VAL A 307 11.520 58.303 -2.986 1.00 25.59 C ANISOU 3411 C VAL A 307 3496 2171 4057 549 348 1102 C ATOM 3412 O VAL A 307 10.437 58.671 -2.566 1.00 28.53 O ANISOU 3412 O VAL A 307 3799 2617 4424 600 376 1213 O ATOM 3413 CB VAL A 307 12.774 60.436 -3.326 1.00 25.27 C ANISOU 3413 CB VAL A 307 3421 2014 4166 617 329 961 C ATOM 3414 CG1 VAL A 307 13.580 60.101 -2.086 1.00 25.20 C ANISOU 3414 CG1 VAL A 307 3476 1981 4118 722 326 836 C ATOM 3415 CG2 VAL A 307 13.619 61.268 -4.285 1.00 26.40 C ANISOU 3415 CG2 VAL A 307 3548 2111 4370 530 287 919 C ATOM 0 H VAL A 307 11.096 60.247 -5.174 1.00 25.29 H new ATOM 0 HA VAL A 307 13.035 58.659 -4.331 1.00 25.06 H new ATOM 0 HB VAL A 307 11.999 60.961 -3.071 1.00 25.27 H new ATOM 0 HG11 VAL A 307 13.894 60.920 -1.672 1.00 25.20 H new ATOM 0 HG12 VAL A 307 13.022 59.616 -1.458 1.00 25.20 H new ATOM 0 HG13 VAL A 307 14.341 59.552 -2.333 1.00 25.20 H new ATOM 0 HG21 VAL A 307 13.924 62.071 -3.834 1.00 26.40 H new ATOM 0 HG22 VAL A 307 14.386 60.749 -4.575 1.00 26.40 H new ATOM 0 HG23 VAL A 307 13.085 61.514 -5.057 1.00 26.40 H new ATOM 3425 N THR A 308 12.100 57.177 -2.575 1.00 25.08 N ANISOU 3425 N THR A 308 3524 2083 3923 548 329 1031 N ATOM 3426 CA THR A 308 11.459 56.298 -1.596 1.00 25.39 C ANISOU 3426 CA THR A 308 3601 2176 3870 572 320 1084 C ATOM 3427 C THR A 308 12.290 56.175 -0.322 1.00 25.32 C ANISOU 3427 C THR A 308 3635 2130 3857 702 313 952 C ATOM 3428 O THR A 308 11.867 55.545 0.646 1.00 29.14 O ANISOU 3428 O THR A 308 4147 2660 4264 725 299 981 O ATOM 3429 CB THR A 308 11.206 54.895 -2.155 1.00 28.55 C ANISOU 3429 CB THR A 308 4116 2569 4162 425 277 1153 C ATOM 3430 OG1 THR A 308 12.437 54.339 -2.629 1.00 31.78 O ANISOU 3430 OG1 THR A 308 4630 2868 4575 433 267 1023 O ATOM 3431 CG2 THR A 308 10.219 54.960 -3.304 1.00 29.06 C ANISOU 3431 CG2 THR A 308 4146 2694 4200 252 270 1321 C ATOM 0 H THR A 308 12.867 56.903 -2.851 1.00 25.08 H new ATOM 0 HA THR A 308 10.606 56.711 -1.388 1.00 25.39 H new ATOM 0 HB THR A 308 10.841 54.339 -1.449 1.00 28.55 H new ATOM 0 HG1 THR A 308 12.298 53.569 -2.934 1.00 31.78 H new ATOM 0 HG21 THR A 308 10.066 54.067 -3.650 1.00 29.06 H new ATOM 0 HG22 THR A 308 9.380 55.333 -2.990 1.00 29.06 H new ATOM 0 HG23 THR A 308 10.578 55.522 -4.008 1.00 29.06 H new ATOM 3439 N GLY A 309 13.445 56.821 -0.308 1.00 26.35 N ANISOU 3439 N GLY A 309 3761 2195 4057 763 312 827 N ATOM 3440 CA GLY A 309 14.239 56.881 0.897 1.00 25.58 C ANISOU 3440 CA GLY A 309 3690 2076 3952 860 295 727 C ATOM 3441 C GLY A 309 15.409 57.807 0.779 1.00 28.60 C ANISOU 3441 C GLY A 309 4052 2415 4398 883 280 632 C ATOM 3442 O GLY A 309 15.783 58.246 -0.318 1.00 25.98 O ANISOU 3442 O GLY A 309 3684 2073 4116 823 279 631 O ATOM 0 H GLY A 309 13.783 57.229 -0.985 1.00 26.35 H new ATOM 0 HA2 GLY A 309 13.678 57.169 1.634 1.00 25.58 H new ATOM 0 HA3 GLY A 309 14.558 55.991 1.113 1.00 25.58 H new ATOM 3446 N ALA A 310 15.982 58.126 1.928 1.00 25.46 N ANISOU 3446 N ALA A 310 3682 2007 3985 943 258 566 N ATOM 3447 CA ALA A 310 17.092 59.045 2.009 1.00 25.71 C ANISOU 3447 CA ALA A 310 3710 2013 4046 932 220 499 C ATOM 3448 C ALA A 310 17.952 58.727 3.225 1.00 27.96 C ANISOU 3448 C ALA A 310 4028 2312 4285 960 173 452 C ATOM 3449 O ALA A 310 17.459 58.196 4.230 1.00 30.64 O ANISOU 3449 O ALA A 310 4410 2659 4571 1000 179 457 O ATOM 3450 CB ALA A 310 16.610 60.465 2.065 1.00 27.74 C ANISOU 3450 CB ALA A 310 3999 2216 4323 940 233 492 C ATOM 0 H ALA A 310 15.732 57.810 2.688 1.00 25.46 H new ATOM 0 HA ALA A 310 17.631 58.942 1.209 1.00 25.71 H new ATOM 0 HB1 ALA A 310 17.371 61.064 2.119 1.00 27.74 H new ATOM 0 HB2 ALA A 310 16.098 60.665 1.266 1.00 27.74 H new ATOM 0 HB3 ALA A 310 16.048 60.586 2.847 1.00 27.74 H new ATOM 3456 N MET A 311 19.236 59.046 3.106 1.00 26.43 N ANISOU 3456 N MET A 311 3798 2141 4103 919 119 428 N ATOM 3457 CA MET A 311 20.199 58.813 4.184 1.00 27.63 C ANISOU 3457 CA MET A 311 3958 2329 4212 919 57 415 C ATOM 3458 C MET A 311 21.337 59.845 4.161 1.00 35.41 C ANISOU 3458 C MET A 311 4924 3346 5186 825 -15 413 C ATOM 3459 O MET A 311 21.856 60.187 3.105 1.00 29.85 O ANISOU 3459 O MET A 311 4141 2685 4514 776 -25 432 O ATOM 3460 CB MET A 311 20.776 57.397 4.075 1.00 32.87 C ANISOU 3460 CB MET A 311 4562 3045 4883 978 50 442 C ATOM 3461 CG MET A 311 21.685 57.022 5.212 1.00 33.00 C ANISOU 3461 CG MET A 311 4567 3109 4864 985 -20 459 C ATOM 3462 SD MET A 311 22.447 55.400 4.968 1.00 36.29 S ANISOU 3462 SD MET A 311 4920 3567 5303 1101 -26 500 S ATOM 3463 CE MET A 311 23.419 55.653 3.496 1.00 38.95 C ANISOU 3463 CE MET A 311 5125 3990 5684 1120 12 509 C ATOM 0 H MET A 311 19.576 59.403 2.401 1.00 26.43 H new ATOM 0 HA MET A 311 19.728 58.908 5.027 1.00 27.63 H new ATOM 0 HB2 MET A 311 20.045 56.761 4.034 1.00 32.87 H new ATOM 0 HB3 MET A 311 21.266 57.320 3.241 1.00 32.87 H new ATOM 0 HG2 MET A 311 22.379 57.693 5.304 1.00 33.00 H new ATOM 0 HG3 MET A 311 21.180 57.020 6.040 1.00 33.00 H new ATOM 0 HE1 MET A 311 23.081 55.088 2.784 1.00 38.95 H new ATOM 0 HE2 MET A 311 23.361 56.583 3.225 1.00 38.95 H new ATOM 0 HE3 MET A 311 24.345 55.427 3.676 1.00 38.95 H new ATOM 3473 N ALA A 312 21.733 60.329 5.339 1.00 32.63 N ANISOU 3473 N ALA A 312 4650 2982 4766 774 -76 402 N ATOM 3474 CA ALA A 312 22.962 61.128 5.495 1.00 32.72 C ANISOU 3474 CA ALA A 312 4652 3049 4731 643 -178 433 C ATOM 3475 C ALA A 312 24.118 60.266 6.028 1.00 39.39 C ANISOU 3475 C ALA A 312 5380 4030 5556 637 -239 503 C ATOM 3476 O ALA A 312 23.866 59.287 6.711 1.00 36.21 O ANISOU 3476 O ALA A 312 4979 3624 5155 720 -219 503 O ATOM 3477 CB ALA A 312 22.692 62.294 6.428 1.00 39.96 C ANISOU 3477 CB ALA A 312 5770 3852 5559 562 -220 389 C ATOM 0 H ALA A 312 21.301 60.206 6.072 1.00 32.63 H new ATOM 0 HA ALA A 312 23.226 61.468 4.626 1.00 32.72 H new ATOM 0 HB1 ALA A 312 23.500 62.820 6.531 1.00 39.96 H new ATOM 0 HB2 ALA A 312 21.990 62.850 6.056 1.00 39.96 H new ATOM 0 HB3 ALA A 312 22.413 61.958 7.294 1.00 39.96 H new ATOM 3483 N GLN A 313 25.379 60.604 5.736 1.00 38.42 N ANISOU 3483 N GLN A 313 5146 4042 5411 537 -319 581 N ATOM 3484 CA GLN A 313 26.504 59.800 6.224 1.00 47.31 C ANISOU 3484 CA GLN A 313 6126 5326 6523 552 -374 679 C ATOM 3485 C GLN A 313 27.023 60.173 7.604 1.00 51.52 C ANISOU 3485 C GLN A 313 6737 5881 6956 410 -488 732 C ATOM 3486 O GLN A 313 27.760 59.404 8.223 1.00 56.87 O ANISOU 3486 O GLN A 313 7308 6675 7627 431 -536 824 O ATOM 3487 CB GLN A 313 27.681 59.870 5.257 1.00 52.69 C ANISOU 3487 CB GLN A 313 6600 6207 7215 523 -399 774 C ATOM 3488 CG GLN A 313 27.389 59.310 3.890 1.00 59.36 C ANISOU 3488 CG GLN A 313 7354 7061 8139 662 -284 732 C ATOM 3489 CD GLN A 313 26.609 57.998 3.940 1.00 57.44 C ANISOU 3489 CD GLN A 313 7159 6711 7956 858 -188 671 C ATOM 3490 OE1 GLN A 313 25.557 57.858 3.311 1.00 52.06 O ANISOU 3490 OE1 GLN A 313 6565 5905 7311 903 -109 594 O ATOM 3491 NE2 GLN A 313 27.125 57.031 4.701 1.00 42.64 N ANISOU 3491 NE2 GLN A 313 5233 4887 6083 956 -210 726 N ATOM 0 H GLN A 313 25.602 61.287 5.263 1.00 38.42 H new ATOM 0 HA GLN A 313 26.135 58.905 6.287 1.00 47.31 H new ATOM 0 HB2 GLN A 313 27.956 60.795 5.165 1.00 52.69 H new ATOM 0 HB3 GLN A 313 28.431 59.388 5.640 1.00 52.69 H new ATOM 0 HG2 GLN A 313 26.884 59.962 3.379 1.00 59.36 H new ATOM 0 HG3 GLN A 313 28.225 59.166 3.419 1.00 59.36 H new ATOM 0 HE21 GLN A 313 27.861 57.164 5.125 1.00 42.64 H new ATOM 0 HE22 GLN A 313 26.722 56.274 4.767 1.00 42.64 H new ATOM 3500 N THR A 314 26.664 61.347 8.087 1.00 44.64 N ANISOU 3500 N THR A 314 6068 4894 6000 264 -535 683 N ATOM 3501 CA THR A 314 27.168 61.797 9.366 1.00 51.61 C ANISOU 3501 CA THR A 314 7071 5783 6756 90 -648 730 C ATOM 3502 C THR A 314 26.695 60.886 10.495 1.00 47.29 C ANISOU 3502 C THR A 314 6571 5196 6201 170 -620 704 C ATOM 3503 O THR A 314 25.498 60.661 10.654 1.00 43.52 O ANISOU 3503 O THR A 314 6201 4586 5748 290 -519 594 O ATOM 3504 CB THR A 314 26.723 63.234 9.661 1.00 54.29 C ANISOU 3504 CB THR A 314 7692 5949 6987 -57 -687 652 C ATOM 3505 OG1 THR A 314 26.955 64.045 8.507 1.00 52.61 O ANISOU 3505 OG1 THR A 314 7451 5744 6794 -121 -712 667 O ATOM 3506 CG2 THR A 314 27.495 63.799 10.844 1.00 55.71 C ANISOU 3506 CG2 THR A 314 8017 6149 7000 -298 -832 723 C ATOM 0 H THR A 314 26.132 61.896 7.692 1.00 44.64 H new ATOM 0 HA THR A 314 28.136 61.767 9.317 1.00 51.61 H new ATOM 0 HB THR A 314 25.778 63.233 9.880 1.00 54.29 H new ATOM 0 HG1 THR A 314 26.700 64.830 8.660 1.00 52.61 H new ATOM 0 HG21 THR A 314 27.202 64.707 11.018 1.00 55.71 H new ATOM 0 HG22 THR A 314 27.332 63.252 11.628 1.00 55.71 H new ATOM 0 HG23 THR A 314 28.444 63.799 10.642 1.00 55.71 H new ATOM 3514 N GLU A 315 27.641 60.357 11.264 1.00 46.93 N ANISOU 3514 N GLU A 315 6428 5287 6116 93 -717 828 N ATOM 3515 CA GLU A 315 27.303 59.587 12.453 1.00 50.43 C ANISOU 3515 CA GLU A 315 6930 5701 6530 115 -725 823 C ATOM 3516 C GLU A 315 27.068 60.554 13.602 1.00 50.61 C ANISOU 3516 C GLU A 315 7219 5621 6390 -84 -782 774 C ATOM 3517 O GLU A 315 27.999 61.161 14.124 1.00 54.52 O ANISOU 3517 O GLU A 315 7757 6187 6772 -310 -914 874 O ATOM 3518 CB GLU A 315 28.402 58.576 12.799 1.00 50.27 C ANISOU 3518 CB GLU A 315 6694 5865 6543 126 -811 991 C ATOM 3519 CG GLU A 315 28.369 57.294 11.955 1.00 46.59 C ANISOU 3519 CG GLU A 315 6039 5439 6224 386 -727 1004 C ATOM 3520 CD GLU A 315 27.710 56.113 12.673 1.00 64.25 C ANISOU 3520 CD GLU A 315 8325 7598 8489 498 -709 979 C ATOM 3521 OE1 GLU A 315 28.095 55.827 13.828 1.00 74.99 O ANISOU 3521 OE1 GLU A 315 9697 9006 9791 394 -809 1064 O ATOM 3522 OE2 GLU A 315 26.813 55.463 12.083 1.00 55.55 O ANISOU 3522 OE2 GLU A 315 7256 6395 7456 663 -609 889 O ATOM 0 H GLU A 315 28.484 60.433 11.114 1.00 46.93 H new ATOM 0 HA GLU A 315 26.497 59.074 12.285 1.00 50.43 H new ATOM 0 HB2 GLU A 315 29.266 59.002 12.687 1.00 50.27 H new ATOM 0 HB3 GLU A 315 28.323 58.336 13.736 1.00 50.27 H new ATOM 0 HG2 GLU A 315 27.891 57.470 11.129 1.00 46.59 H new ATOM 0 HG3 GLU A 315 29.276 57.051 11.711 1.00 46.59 H new ATOM 3529 N LEU A 316 25.806 60.698 13.986 1.00 42.09 N ANISOU 3529 N LEU A 316 6325 4383 5283 -3 -679 628 N ATOM 3530 CA LEU A 316 25.434 61.626 15.040 1.00 40.61 C ANISOU 3530 CA LEU A 316 6428 4074 4927 -145 -694 549 C ATOM 3531 C LEU A 316 26.054 61.275 16.380 1.00 43.88 C ANISOU 3531 C LEU A 316 6885 4563 5224 -326 -807 635 C ATOM 3532 O LEU A 316 26.283 60.107 16.698 1.00 42.48 O ANISOU 3532 O LEU A 316 6533 4498 5111 -276 -835 719 O ATOM 3533 CB LEU A 316 23.917 61.667 15.178 1.00 41.80 C ANISOU 3533 CB LEU A 316 6715 4090 5078 30 -535 394 C ATOM 3534 CG LEU A 316 23.168 62.089 13.913 1.00 40.64 C ANISOU 3534 CG LEU A 316 6540 3863 5039 196 -424 323 C ATOM 3535 CD1 LEU A 316 21.667 61.954 14.149 1.00 47.93 C ANISOU 3535 CD1 LEU A 316 7540 4712 5957 374 -270 218 C ATOM 3536 CD2 LEU A 316 23.549 63.496 13.506 1.00 47.83 C ANISOU 3536 CD2 LEU A 316 7617 4668 5887 82 -475 299 C ATOM 0 H LEU A 316 25.147 60.263 13.645 1.00 42.09 H new ATOM 0 HA LEU A 316 25.776 62.497 14.784 1.00 40.61 H new ATOM 0 HB2 LEU A 316 23.605 60.788 15.445 1.00 41.80 H new ATOM 0 HB3 LEU A 316 23.687 62.279 15.894 1.00 41.80 H new ATOM 0 HG LEU A 316 23.418 61.507 13.179 1.00 40.64 H new ATOM 0 HD11 LEU A 316 21.188 62.221 13.349 1.00 47.93 H new ATOM 0 HD12 LEU A 316 21.454 61.032 14.360 1.00 47.93 H new ATOM 0 HD13 LEU A 316 21.403 62.524 14.888 1.00 47.93 H new ATOM 0 HD21 LEU A 316 23.064 63.743 12.703 1.00 47.83 H new ATOM 0 HD22 LEU A 316 23.325 64.112 14.221 1.00 47.83 H new ATOM 0 HD23 LEU A 316 24.502 63.536 13.332 1.00 47.83 H new ATOM 3548 N SER A 317 26.323 62.303 17.174 1.00 42.57 N ANISOU 3548 N SER A 317 6980 4322 4875 -550 -881 617 N ATOM 3549 CA SER A 317 26.799 62.106 18.533 1.00 47.03 C ANISOU 3549 CA SER A 317 7638 4940 5293 -763 -988 689 C ATOM 3550 C SER A 317 25.679 61.580 19.418 1.00 52.57 C ANISOU 3550 C SER A 317 8446 5577 5951 -660 -878 571 C ATOM 3551 O SER A 317 24.505 61.711 19.076 1.00 41.86 O ANISOU 3551 O SER A 317 7158 4116 4633 -454 -718 424 O ATOM 3552 CB SER A 317 27.321 63.415 19.113 1.00 49.29 C ANISOU 3552 CB SER A 317 8235 5135 5359 -1057 -1097 692 C ATOM 3553 OG SER A 317 26.242 64.279 19.419 1.00 51.76 O ANISOU 3553 OG SER A 317 8888 5219 5561 -989 -972 487 O ATOM 0 H SER A 317 26.236 63.127 16.942 1.00 42.57 H new ATOM 0 HA SER A 317 27.520 61.458 18.506 1.00 47.03 H new ATOM 0 HB2 SER A 317 27.839 63.238 19.914 1.00 49.29 H new ATOM 0 HB3 SER A 317 27.917 63.843 18.478 1.00 49.29 H new ATOM 0 HG SER A 317 26.491 65.077 19.340 1.00 51.76 H new ATOM 3559 N PRO A 318 26.035 60.999 20.571 1.00 52.18 N ANISOU 3559 N PRO A 318 8402 5612 5812 -817 -968 653 N ATOM 3560 CA PRO A 318 25.001 60.607 21.530 1.00 46.73 C ANISOU 3560 CA PRO A 318 7837 4881 5037 -769 -876 546 C ATOM 3561 C PRO A 318 24.100 61.778 21.952 1.00 56.13 C ANISOU 3561 C PRO A 318 9380 5892 6053 -761 -749 352 C ATOM 3562 O PRO A 318 22.889 61.585 22.072 1.00 47.29 O ANISOU 3562 O PRO A 318 8297 4739 4932 -569 -590 229 O ATOM 3563 CB PRO A 318 25.814 60.076 22.713 1.00 60.31 C ANISOU 3563 CB PRO A 318 9542 6718 6655 -1024 -1038 691 C ATOM 3564 CG PRO A 318 27.049 59.538 22.083 1.00 57.22 C ANISOU 3564 CG PRO A 318 8858 6476 6406 -1053 -1177 899 C ATOM 3565 CD PRO A 318 27.359 60.474 20.949 1.00 55.18 C ANISOU 3565 CD PRO A 318 8605 6167 6192 -1013 -1155 874 C ATOM 0 HA PRO A 318 24.383 59.959 21.158 1.00 46.73 H new ATOM 0 HB2 PRO A 318 26.017 60.779 23.350 1.00 60.31 H new ATOM 0 HB3 PRO A 318 25.331 59.387 23.196 1.00 60.31 H new ATOM 0 HG2 PRO A 318 27.780 59.505 22.719 1.00 57.22 H new ATOM 0 HG3 PRO A 318 26.912 58.633 21.762 1.00 57.22 H new ATOM 0 HD2 PRO A 318 27.960 61.184 21.225 1.00 55.18 H new ATOM 0 HD3 PRO A 318 27.785 60.012 20.210 1.00 55.18 H new ATOM 3573 N VAL A 319 24.662 62.968 22.158 1.00 57.33 N ANISOU 3573 N VAL A 319 9797 5935 6052 -958 -818 333 N ATOM 3574 CA VAL A 319 23.845 64.103 22.589 1.00 54.68 C ANISOU 3574 CA VAL A 319 9849 5393 5535 -927 -694 141 C ATOM 3575 C VAL A 319 22.879 64.545 21.487 1.00 54.17 C ANISOU 3575 C VAL A 319 9766 5216 5599 -615 -524 17 C ATOM 3576 O VAL A 319 21.739 64.922 21.764 1.00 53.15 O ANISOU 3576 O VAL A 319 9808 4987 5399 -429 -348 -137 O ATOM 3577 CB VAL A 319 24.710 65.312 23.031 1.00 60.11 C ANISOU 3577 CB VAL A 319 10885 5951 6004 -1237 -831 155 C ATOM 3578 CG1 VAL A 319 25.447 64.988 24.318 1.00 62.26 C ANISOU 3578 CG1 VAL A 319 11240 6319 6098 -1566 -980 264 C ATOM 3579 CG2 VAL A 319 25.686 65.722 21.946 1.00 60.97 C ANISOU 3579 CG2 VAL A 319 10869 6086 6211 -1329 -969 283 C ATOM 0 H VAL A 319 25.499 63.138 22.056 1.00 57.33 H new ATOM 0 HA VAL A 319 23.336 63.796 23.355 1.00 54.68 H new ATOM 0 HB VAL A 319 24.116 66.062 23.190 1.00 60.11 H new ATOM 0 HG11 VAL A 319 25.984 65.751 24.584 1.00 62.26 H new ATOM 0 HG12 VAL A 319 24.805 64.785 25.016 1.00 62.26 H new ATOM 0 HG13 VAL A 319 26.023 64.221 24.177 1.00 62.26 H new ATOM 0 HG21 VAL A 319 26.211 66.478 22.252 1.00 60.97 H new ATOM 0 HG22 VAL A 319 26.277 64.979 21.744 1.00 60.97 H new ATOM 0 HG23 VAL A 319 25.196 65.971 21.147 1.00 60.97 H new ATOM 3589 N GLN A 320 23.329 64.490 20.239 1.00 53.46 N ANISOU 3589 N GLN A 320 9457 5165 5693 -554 -573 98 N ATOM 3590 CA GLN A 320 22.456 64.778 19.110 1.00 54.15 C ANISOU 3590 CA GLN A 320 9480 5173 5921 -280 -432 13 C ATOM 3591 C GLN A 320 21.312 63.778 19.025 1.00 52.78 C ANISOU 3591 C GLN A 320 9102 5095 5859 -30 -279 -20 C ATOM 3592 O GLN A 320 20.158 64.144 18.802 1.00 50.90 O ANISOU 3592 O GLN A 320 8932 4782 5626 188 -114 -126 O ATOM 3593 CB GLN A 320 23.246 64.756 17.813 1.00 52.02 C ANISOU 3593 CB GLN A 320 8985 4963 5816 -299 -526 124 C ATOM 3594 CG GLN A 320 24.109 65.972 17.606 1.00 54.97 C ANISOU 3594 CG GLN A 320 9574 5230 6082 -517 -658 150 C ATOM 3595 CD GLN A 320 24.913 65.878 16.331 1.00 56.79 C ANISOU 3595 CD GLN A 320 9542 5572 6463 -546 -749 275 C ATOM 3596 OE1 GLN A 320 25.744 64.981 16.170 1.00 54.82 O ANISOU 3596 OE1 GLN A 320 9003 5530 6297 -605 -833 422 O ATOM 3597 NE2 GLN A 320 24.654 66.791 15.404 1.00 58.40 N ANISOU 3597 NE2 GLN A 320 9843 5647 6701 -489 -725 222 N ATOM 0 H GLN A 320 24.137 64.288 20.025 1.00 53.46 H new ATOM 0 HA GLN A 320 22.082 65.662 19.247 1.00 54.15 H new ATOM 0 HB2 GLN A 320 23.808 63.965 17.800 1.00 52.02 H new ATOM 0 HB3 GLN A 320 22.628 64.678 17.069 1.00 52.02 H new ATOM 0 HG2 GLN A 320 23.550 66.764 17.578 1.00 54.97 H new ATOM 0 HG3 GLN A 320 24.710 66.075 18.361 1.00 54.97 H new ATOM 0 HE21 GLN A 320 24.067 67.401 15.554 1.00 58.40 H new ATOM 0 HE22 GLN A 320 25.073 66.772 14.653 1.00 58.40 H new ATOM 3606 N ILE A 321 21.643 62.506 19.197 1.00 48.84 N ANISOU 3606 N ILE A 321 8352 4767 5440 -66 -346 90 N ATOM 3607 CA ILE A 321 20.638 61.458 19.154 1.00 44.84 C ANISOU 3607 CA ILE A 321 7667 4358 5013 116 -241 86 C ATOM 3608 C ILE A 321 19.638 61.646 20.291 1.00 47.10 C ANISOU 3608 C ILE A 321 8140 4634 5123 152 -122 -19 C ATOM 3609 O ILE A 321 18.433 61.549 20.087 1.00 46.50 O ANISOU 3609 O ILE A 321 8021 4582 5064 355 32 -73 O ATOM 3610 CB ILE A 321 21.295 60.067 19.223 1.00 39.79 C ANISOU 3610 CB ILE A 321 6779 3870 4469 49 -363 229 C ATOM 3611 CG1 ILE A 321 22.087 59.820 17.938 1.00 40.03 C ANISOU 3611 CG1 ILE A 321 6603 3929 4679 93 -427 318 C ATOM 3612 CG2 ILE A 321 20.241 58.976 19.413 1.00 41.63 C ANISOU 3612 CG2 ILE A 321 6894 4193 4730 177 -287 232 C ATOM 3613 CD1 ILE A 321 22.965 58.599 17.968 1.00 48.99 C ANISOU 3613 CD1 ILE A 321 7522 5190 5902 49 -551 464 C ATOM 0 H ILE A 321 22.445 62.229 19.340 1.00 48.84 H new ATOM 0 HA ILE A 321 20.162 61.518 18.311 1.00 44.84 H new ATOM 0 HB ILE A 321 21.894 60.039 19.985 1.00 39.79 H new ATOM 0 HG12 ILE A 321 21.464 59.738 17.199 1.00 40.03 H new ATOM 0 HG13 ILE A 321 22.639 60.597 17.758 1.00 40.03 H new ATOM 0 HG21 ILE A 321 20.675 58.110 19.454 1.00 41.63 H new ATOM 0 HG22 ILE A 321 19.757 59.134 20.239 1.00 41.63 H new ATOM 0 HG23 ILE A 321 19.621 58.991 18.667 1.00 41.63 H new ATOM 0 HD11 ILE A 321 23.430 58.514 17.121 1.00 48.99 H new ATOM 0 HD12 ILE A 321 23.613 58.683 18.685 1.00 48.99 H new ATOM 0 HD13 ILE A 321 22.419 57.811 18.117 1.00 48.99 H new ATOM 3625 N LYS A 322 20.140 61.950 21.484 1.00 47.26 N ANISOU 3625 N LYS A 322 8366 4633 4958 -55 -190 -36 N ATOM 3626 CA LYS A 322 19.269 62.198 22.627 1.00 49.66 C ANISOU 3626 CA LYS A 322 8876 4932 5062 -36 -68 -147 C ATOM 3627 C LYS A 322 18.320 63.367 22.361 1.00 53.46 C ANISOU 3627 C LYS A 322 9572 5263 5478 183 123 -301 C ATOM 3628 O LYS A 322 17.148 63.322 22.743 1.00 49.96 O ANISOU 3628 O LYS A 322 9144 4876 4960 365 297 -375 O ATOM 3629 CB LYS A 322 20.100 62.471 23.883 1.00 50.33 C ANISOU 3629 CB LYS A 322 9192 4992 4938 -334 -188 -140 C ATOM 3630 CG LYS A 322 19.363 62.186 25.185 1.00 58.27 C ANISOU 3630 CG LYS A 322 10317 6076 5747 -368 -100 -208 C ATOM 3631 CD LYS A 322 20.165 62.612 26.418 1.00 67.30 C ANISOU 3631 CD LYS A 322 11746 7171 6655 -691 -214 -212 C ATOM 3632 CE LYS A 322 21.514 61.896 26.517 1.00 66.08 C ANISOU 3632 CE LYS A 322 11414 7117 6577 -969 -467 -10 C ATOM 3633 NZ LYS A 322 21.395 60.409 26.524 1.00 70.48 N ANISOU 3633 NZ LYS A 322 11629 7869 7281 -932 -525 119 N ATOM 0 H LYS A 322 20.981 62.017 21.652 1.00 47.26 H new ATOM 0 HA LYS A 322 18.734 61.402 22.768 1.00 49.66 H new ATOM 0 HB2 LYS A 322 20.904 61.930 23.852 1.00 50.33 H new ATOM 0 HB3 LYS A 322 20.382 63.399 23.878 1.00 50.33 H new ATOM 0 HG2 LYS A 322 18.512 62.651 25.180 1.00 58.27 H new ATOM 0 HG3 LYS A 322 19.168 61.238 25.242 1.00 58.27 H new ATOM 0 HD2 LYS A 322 20.312 63.570 26.389 1.00 67.30 H new ATOM 0 HD3 LYS A 322 19.646 62.429 27.217 1.00 67.30 H new ATOM 0 HE2 LYS A 322 22.072 62.166 25.771 1.00 66.08 H new ATOM 0 HE3 LYS A 322 21.966 62.182 27.326 1.00 66.08 H new ATOM 0 HZ1 LYS A 322 22.195 60.048 26.670 1.00 70.48 H new ATOM 0 HZ2 LYS A 322 20.835 60.159 27.169 1.00 70.48 H new ATOM 0 HZ3 LYS A 322 21.084 60.132 25.737 1.00 70.48 H new ATOM 3647 N GLN A 323 18.824 64.409 21.705 1.00 54.10 N ANISOU 3647 N GLN A 323 9809 5165 5581 170 86 -335 N ATOM 3648 CA GLN A 323 18.002 65.568 21.383 1.00 58.50 C ANISOU 3648 CA GLN A 323 10590 5545 6090 390 248 -470 C ATOM 3649 C GLN A 323 16.903 65.201 20.392 1.00 56.75 C ANISOU 3649 C GLN A 323 10100 5410 6051 690 392 -449 C ATOM 3650 O GLN A 323 15.773 65.677 20.511 1.00 52.95 O ANISOU 3650 O GLN A 323 9706 4902 5512 934 584 -536 O ATOM 3651 CB GLN A 323 18.861 66.704 20.815 1.00 60.94 C ANISOU 3651 CB GLN A 323 11123 5641 6389 273 135 -484 C ATOM 3652 CG GLN A 323 18.069 67.945 20.394 1.00 66.72 C ANISOU 3652 CG GLN A 323 12114 6151 7087 510 281 -614 C ATOM 3653 CD GLN A 323 17.335 68.618 21.555 1.00 73.61 C ANISOU 3653 CD GLN A 323 13357 6900 7711 616 445 -777 C ATOM 3654 OE1 GLN A 323 16.124 68.452 21.724 1.00 74.75 O ANISOU 3654 OE1 GLN A 323 13427 7124 7853 902 656 -835 O ATOM 3655 NE2 GLN A 323 18.068 69.390 22.351 1.00 73.15 N ANISOU 3655 NE2 GLN A 323 13708 6661 7427 379 350 -842 N ATOM 0 H GLN A 323 19.640 64.463 21.438 1.00 54.10 H new ATOM 0 HA GLN A 323 17.587 65.872 22.205 1.00 58.50 H new ATOM 0 HB2 GLN A 323 19.517 66.963 21.481 1.00 60.94 H new ATOM 0 HB3 GLN A 323 19.352 66.371 20.047 1.00 60.94 H new ATOM 0 HG2 GLN A 323 18.675 68.585 19.988 1.00 66.72 H new ATOM 0 HG3 GLN A 323 17.424 67.694 19.714 1.00 66.72 H new ATOM 0 HE21 GLN A 323 18.910 69.483 22.203 1.00 73.15 H new ATOM 0 HE22 GLN A 323 17.700 69.796 23.014 1.00 73.15 H new ATOM 3664 N LEU A 324 17.228 64.357 19.415 1.00 52.55 N ANISOU 3664 N LEU A 324 9248 4991 5728 674 303 -324 N ATOM 3665 CA LEU A 324 16.250 63.974 18.404 1.00 50.52 C ANISOU 3665 CA LEU A 324 8746 4816 5633 906 412 -282 C ATOM 3666 C LEU A 324 15.147 63.126 19.014 1.00 54.40 C ANISOU 3666 C LEU A 324 9102 5500 6068 1016 531 -262 C ATOM 3667 O LEU A 324 13.989 63.225 18.616 1.00 52.00 O ANISOU 3667 O LEU A 324 8706 5257 5794 1238 683 -257 O ATOM 3668 CB LEU A 324 16.910 63.205 17.260 1.00 49.91 C ANISOU 3668 CB LEU A 324 8397 4806 5761 840 287 -160 C ATOM 3669 CG LEU A 324 17.815 63.994 16.315 1.00 54.52 C ANISOU 3669 CG LEU A 324 9030 5256 6428 766 189 -150 C ATOM 3670 CD1 LEU A 324 18.620 63.022 15.468 1.00 54.07 C ANISOU 3670 CD1 LEU A 324 8701 5312 6532 682 69 -30 C ATOM 3671 CD2 LEU A 324 17.009 64.936 15.434 1.00 49.63 C ANISOU 3671 CD2 LEU A 324 8469 4518 5870 962 302 -199 C ATOM 0 H LEU A 324 18.004 63.998 19.321 1.00 52.55 H new ATOM 0 HA LEU A 324 15.865 64.791 18.050 1.00 50.52 H new ATOM 0 HB2 LEU A 324 17.433 62.485 17.645 1.00 49.91 H new ATOM 0 HB3 LEU A 324 16.209 62.794 16.731 1.00 49.91 H new ATOM 0 HG LEU A 324 18.418 64.540 16.843 1.00 54.52 H new ATOM 0 HD11 LEU A 324 19.197 63.518 14.866 1.00 54.07 H new ATOM 0 HD12 LEU A 324 19.162 62.461 16.045 1.00 54.07 H new ATOM 0 HD13 LEU A 324 18.016 62.466 14.952 1.00 54.07 H new ATOM 0 HD21 LEU A 324 17.608 65.422 14.846 1.00 49.63 H new ATOM 0 HD22 LEU A 324 16.380 64.423 14.902 1.00 49.63 H new ATOM 0 HD23 LEU A 324 16.523 65.564 15.991 1.00 49.63 H new ATOM 3683 N ILE A 325 15.514 62.286 19.977 1.00 50.11 N ANISOU 3683 N ILE A 325 8532 5070 5436 845 449 -227 N ATOM 3684 CA ILE A 325 14.545 61.436 20.649 1.00 46.51 C ANISOU 3684 CA ILE A 325 7955 4817 4900 896 531 -194 C ATOM 3685 C ILE A 325 13.658 62.253 21.589 1.00 48.01 C ANISOU 3685 C ILE A 325 8355 5005 4880 1029 721 -315 C ATOM 3686 O ILE A 325 12.467 61.975 21.719 1.00 45.80 O ANISOU 3686 O ILE A 325 7951 4897 4553 1195 868 -291 O ATOM 3687 CB ILE A 325 15.247 60.317 21.428 1.00 43.82 C ANISOU 3687 CB ILE A 325 7543 4586 4522 658 369 -114 C ATOM 3688 CG1 ILE A 325 15.950 59.372 20.452 1.00 42.96 C ANISOU 3688 CG1 ILE A 325 7208 4496 4619 597 216 12 C ATOM 3689 CG2 ILE A 325 14.243 59.551 22.283 1.00 48.07 C ANISOU 3689 CG2 ILE A 325 8000 5334 4931 671 441 -84 C ATOM 3690 CD1 ILE A 325 16.889 58.391 21.122 1.00 47.62 C ANISOU 3690 CD1 ILE A 325 7748 5148 5200 380 34 100 C ATOM 0 H ILE A 325 16.323 62.195 20.255 1.00 50.11 H new ATOM 0 HA ILE A 325 13.984 61.034 19.968 1.00 46.51 H new ATOM 0 HB ILE A 325 15.909 60.711 22.018 1.00 43.82 H new ATOM 0 HG12 ILE A 325 15.280 58.878 19.954 1.00 42.96 H new ATOM 0 HG13 ILE A 325 16.450 59.898 19.809 1.00 42.96 H new ATOM 0 HG21 ILE A 325 14.701 58.848 22.769 1.00 48.07 H new ATOM 0 HG22 ILE A 325 13.824 60.158 22.913 1.00 48.07 H new ATOM 0 HG23 ILE A 325 13.564 59.159 21.712 1.00 48.07 H new ATOM 0 HD11 ILE A 325 17.299 57.825 20.450 1.00 47.62 H new ATOM 0 HD12 ILE A 325 17.579 58.878 21.599 1.00 47.62 H new ATOM 0 HD13 ILE A 325 16.391 57.841 21.747 1.00 47.62 H new ATOM 3702 N GLN A 326 14.233 63.270 22.227 1.00 50.30 N ANISOU 3702 N GLN A 326 8972 5110 5031 957 721 -438 N ATOM 3703 CA GLN A 326 13.472 64.124 23.138 1.00 49.78 C ANISOU 3703 CA GLN A 326 9170 5001 4742 1101 915 -579 C ATOM 3704 C GLN A 326 12.534 65.059 22.375 1.00 55.08 C ANISOU 3704 C GLN A 326 9879 5583 5466 1438 1105 -633 C ATOM 3705 O GLN A 326 11.506 65.482 22.907 1.00 51.67 O ANISOU 3705 O GLN A 326 9530 5208 4893 1669 1318 -706 O ATOM 3706 CB GLN A 326 14.417 64.938 24.031 1.00 52.63 C ANISOU 3706 CB GLN A 326 9928 5156 4913 892 840 -693 C ATOM 3707 CG GLN A 326 15.076 64.101 25.131 1.00 57.44 C ANISOU 3707 CG GLN A 326 10532 5889 5402 581 699 -643 C ATOM 3708 CD GLN A 326 15.968 64.918 26.041 1.00 58.33 C ANISOU 3708 CD GLN A 326 11050 5812 5300 337 619 -734 C ATOM 3709 OE1 GLN A 326 16.478 65.961 25.648 1.00 60.21 O ANISOU 3709 OE1 GLN A 326 11542 5811 5524 321 583 -796 O ATOM 3710 NE2 GLN A 326 16.160 64.443 27.264 1.00 68.70 N ANISOU 3710 NE2 GLN A 326 12439 7233 6429 118 574 -731 N ATOM 0 H GLN A 326 15.062 63.483 22.147 1.00 50.30 H new ATOM 0 HA GLN A 326 12.930 63.546 23.697 1.00 49.78 H new ATOM 0 HB2 GLN A 326 15.107 65.339 23.480 1.00 52.63 H new ATOM 0 HB3 GLN A 326 13.921 65.665 24.439 1.00 52.63 H new ATOM 0 HG2 GLN A 326 14.386 63.673 25.662 1.00 57.44 H new ATOM 0 HG3 GLN A 326 15.600 63.394 24.723 1.00 57.44 H new ATOM 0 HE21 GLN A 326 15.785 63.707 27.503 1.00 68.70 H new ATOM 0 HE22 GLN A 326 16.660 64.871 27.818 1.00 68.70 H new ATOM 3719 N ASN A 327 12.887 65.370 21.130 1.00 51.15 N ANISOU 3719 N ASN A 327 9306 4960 5168 1474 1029 -587 N ATOM 3720 CA ASN A 327 12.087 66.259 20.298 1.00 55.68 C ANISOU 3720 CA ASN A 327 9904 5434 5819 1773 1176 -613 C ATOM 3721 C ASN A 327 12.010 65.715 18.874 1.00 50.47 C ANISOU 3721 C ASN A 327 8909 4852 5414 1797 1103 -467 C ATOM 3722 O ASN A 327 12.621 66.264 17.960 1.00 49.99 O ANISOU 3722 O ASN A 327 8898 4617 5477 1757 1008 -463 O ATOM 3723 CB ASN A 327 12.677 67.673 20.311 1.00 56.63 C ANISOU 3723 CB ASN A 327 10438 5217 5861 1774 1158 -748 C ATOM 3724 CG ASN A 327 11.704 68.716 19.805 1.00 60.62 C ANISOU 3724 CG ASN A 327 11053 5595 6386 2131 1345 -802 C ATOM 3725 OD1 ASN A 327 10.651 68.386 19.259 1.00 63.11 O ANISOU 3725 OD1 ASN A 327 11080 6092 6808 2367 1475 -710 O ATOM 3726 ND2 ASN A 327 12.053 69.987 19.979 1.00 69.38 N ANISOU 3726 ND2 ASN A 327 12589 6387 7383 2164 1349 -936 N ATOM 0 H ASN A 327 13.596 65.071 20.746 1.00 51.15 H new ATOM 0 HA ASN A 327 11.187 66.304 20.658 1.00 55.68 H new ATOM 0 HB2 ASN A 327 12.946 67.899 21.215 1.00 56.63 H new ATOM 0 HB3 ASN A 327 13.478 67.690 19.764 1.00 56.63 H new ATOM 0 HD21 ASN A 327 11.535 70.617 19.706 1.00 69.38 H new ATOM 0 HD22 ASN A 327 12.797 70.180 20.365 1.00 69.38 H new ATOM 3733 N PRO A 328 11.245 64.631 18.684 1.00 48.34 N ANISOU 3733 N PRO A 328 8314 4850 5205 1841 1141 -341 N ATOM 3734 CA PRO A 328 11.197 63.891 17.412 1.00 48.83 C ANISOU 3734 CA PRO A 328 8072 5002 5478 1811 1056 -193 C ATOM 3735 C PRO A 328 10.640 64.724 16.250 1.00 44.42 C ANISOU 3735 C PRO A 328 7478 4351 5051 2019 1136 -166 C ATOM 3736 O PRO A 328 10.886 64.419 15.076 1.00 45.90 O ANISOU 3736 O PRO A 328 7497 4530 5411 1958 1043 -74 O ATOM 3737 CB PRO A 328 10.283 62.700 17.740 1.00 45.09 C ANISOU 3737 CB PRO A 328 7341 4830 4960 1817 1102 -72 C ATOM 3738 CG PRO A 328 9.425 63.178 18.868 1.00 52.89 C ANISOU 3738 CG PRO A 328 8444 5909 5742 1981 1291 -146 C ATOM 3739 CD PRO A 328 10.315 64.075 19.683 1.00 52.11 C ANISOU 3739 CD PRO A 328 8710 5568 5522 1911 1270 -324 C ATOM 0 HA PRO A 328 12.081 63.633 17.106 1.00 48.83 H new ATOM 0 HB2 PRO A 328 9.747 62.446 16.973 1.00 45.09 H new ATOM 0 HB3 PRO A 328 10.799 61.920 17.996 1.00 45.09 H new ATOM 0 HG2 PRO A 328 8.649 63.658 18.540 1.00 52.89 H new ATOM 0 HG3 PRO A 328 9.096 62.435 19.398 1.00 52.89 H new ATOM 0 HD2 PRO A 328 9.809 64.773 20.128 1.00 52.11 H new ATOM 0 HD3 PRO A 328 10.785 63.581 20.373 1.00 52.11 H new ATOM 3747 N LEU A 329 9.912 65.786 16.577 1.00 50.40 N ANISOU 3747 N LEU A 329 8403 5027 5718 2268 1310 -244 N ATOM 3748 CA LEU A 329 9.353 66.668 15.553 1.00 53.68 C ANISOU 3748 CA LEU A 329 8805 5338 6254 2487 1386 -210 C ATOM 3749 C LEU A 329 10.313 67.780 15.146 1.00 58.05 C ANISOU 3749 C LEU A 329 9652 5559 6845 2425 1284 -316 C ATOM 3750 O LEU A 329 10.195 68.421 14.095 1.00 68.86 O ANISOU 3750 O LEU A 329 11008 6809 8347 2512 1269 -275 O ATOM 3751 CB LEU A 329 8.059 67.280 16.053 1.00 61.97 C ANISOU 3751 CB LEU A 329 9886 6465 7194 2830 1630 -224 C ATOM 3752 CG LEU A 329 6.803 66.452 15.952 1.00 64.37 C ANISOU 3752 CG LEU A 329 9827 7128 7504 2955 1747 -47 C ATOM 3753 CD1 LEU A 329 6.842 65.127 16.665 1.00 64.98 C ANISOU 3753 CD1 LEU A 329 9740 7460 7488 2742 1685 10 C ATOM 3754 CD2 LEU A 329 5.640 67.261 16.425 1.00 70.12 C ANISOU 3754 CD2 LEU A 329 10601 7922 8120 3332 2002 -61 C ATOM 0 H LEU A 329 9.729 66.015 17.385 1.00 50.40 H new ATOM 0 HA LEU A 329 9.190 66.122 14.768 1.00 53.68 H new ATOM 0 HB2 LEU A 329 8.183 67.520 16.985 1.00 61.97 H new ATOM 0 HB3 LEU A 329 7.912 68.105 15.565 1.00 61.97 H new ATOM 0 HG LEU A 329 6.715 66.222 15.014 1.00 64.37 H new ATOM 0 HD11 LEU A 329 5.995 64.669 16.544 1.00 64.98 H new ATOM 0 HD12 LEU A 329 7.558 64.584 16.300 1.00 64.98 H new ATOM 0 HD13 LEU A 329 6.998 65.273 17.611 1.00 64.98 H new ATOM 0 HD21 LEU A 329 4.830 66.731 16.361 1.00 70.12 H new ATOM 0 HD22 LEU A 329 5.782 67.524 17.348 1.00 70.12 H new ATOM 0 HD23 LEU A 329 5.551 68.054 15.873 1.00 70.12 H new TER 3766 LEU A 329 HETATM 3767 O HOH B 201 15.557 62.363 11.432 1.00 43.60 O HETATM 3768 O HOH B 202 21.265 29.208 -3.181 1.00 49.57 O HETATM 3769 O HOH B 203 6.769 46.653 17.442 1.00 32.57 O HETATM 3770 O HOH B 204 15.481 57.184 14.558 1.00 41.07 O HETATM 3771 O HOH B 205 17.594 41.905 28.528 1.00 54.41 O HETATM 3772 O HOH B 206 9.755 57.579 10.176 1.00 51.48 O HETATM 3773 O HOH B 207 10.538 50.522 26.552 1.00 54.76 O HETATM 3774 O HOH B 208 6.109 46.326 14.416 1.00 28.44 O HETATM 3775 O HOH B 209 26.550 29.234 12.995 1.00 33.62 O HETATM 3776 O HOH B 210 15.413 35.871 24.253 1.00 35.70 O HETATM 3777 O HOH B 211 8.588 43.100 23.701 1.00 40.20 O HETATM 3778 O HOH B 212 22.489 63.806 9.845 1.00 38.46 O HETATM 3779 O HOH B 213 17.748 35.004 25.485 1.00 48.36 O HETATM 3780 O HOH B 214 13.853 55.965 21.538 1.00 39.91 O HETATM 3781 O HOH B 215 28.952 44.794 19.201 1.00 41.39 O HETATM 3782 O HOH B 216 10.986 56.180 7.357 1.00 30.19 O HETATM 3783 O HOH B 217 15.016 40.644 28.581 1.00 56.84 O HETATM 3784 O HOH B 218 7.042 51.097 18.008 1.00 47.80 O HETATM 3785 O HOH B 219 13.049 24.989 20.356 1.00 32.40 O HETATM 3786 O HOH B 220 15.280 42.875 3.610 1.00 34.24 O HETATM 3787 O HOH B 221 17.043 65.897 11.432 1.00 41.38 O HETATM 3788 O HOH B 222 18.292 50.100 23.366 1.00 63.11 O HETATM 3789 O HOH B 223 11.643 33.804 5.299 1.00 34.93 O HETATM 3790 O HOH B 224 15.449 19.055 13.638 1.00 34.84 O HETATM 3791 O HOH B 225 9.077 41.642 19.705 1.00 26.48 O HETATM 3792 O HOH B 226 29.688 40.532 13.846 1.00 47.00 O HETATM 3793 O HOH B 227 2.519 33.878 12.889 1.00 46.18 O HETATM 3794 O HOH B 228 5.533 41.974 11.011 1.00 35.55 O HETATM 3795 O HOH B 229 26.505 40.181 3.445 1.00 42.62 O HETATM 3796 O HOH B 230 13.774 37.240 25.960 1.00 60.55 O HETATM 3797 O HOH B 231 5.688 23.262 15.412 1.00 39.24 O HETATM 3798 O HOH B 232 17.255 32.538 6.343 1.00 30.66 O HETATM 3799 O HOH B 233 5.872 38.315 15.893 1.00 27.15 O HETATM 3800 O HOH B 234 7.001 52.160 9.085 1.00 40.25 O HETATM 3801 O HOH B 235 18.548 28.834 5.221 1.00 43.25 O HETATM 3802 O HOH B 236 5.863 20.386 15.538 1.00 56.32 O HETATM 3803 O HOH B 237 15.162 53.923 2.447 1.00 30.79 O HETATM 3804 O HOH B 238 23.435 32.675 21.301 1.00 48.88 O HETATM 3805 O HOH B 239 3.692 38.973 3.811 1.00 35.47 O HETATM 3806 O HOH B 240 24.123 42.565 2.515 1.00 38.11 O HETATM 3807 O HOH B 241 6.552 20.825 12.540 1.00 49.47 O HETATM 3808 O HOH B 242 9.029 18.246 13.816 1.00 52.67 O HETATM 3809 O HOH B 243 4.633 29.891 16.069 1.00 31.22 O HETATM 3810 O HOH B 244 7.733 33.568 4.302 1.00 45.55 O HETATM 3811 O HOH B 245 15.488 38.428 27.339 1.00 44.99 O HETATM 3812 O HOH B 246 21.276 32.333 23.404 1.00 47.03 O HETATM 3813 O HOH B 247 10.937 26.542 19.179 1.00 32.21 O HETATM 3814 O HOH B 248 4.433 42.414 13.331 1.00 45.57 O HETATM 3815 O HOH B 249 16.726 24.165 7.757 1.00 57.84 O HETATM 3816 O HOH B 250 13.172 21.954 17.837 1.00 27.11 O HETATM 3817 O HOH B 251 10.123 42.902 0.971 1.00 46.49 O HETATM 3818 O HOH B 252 8.660 48.434 21.318 1.00 34.91 O HETATM 3819 O HOH B 253 10.560 27.175 4.150 1.00 37.55 O HETATM 3820 O HOH B 254 20.843 33.015 -4.702 1.00 43.00 O HETATM 3821 O HOH B 255 15.762 49.046 24.406 1.00 46.93 O HETATM 3822 O HOH B 256 5.633 48.208 10.329 1.00 36.29 O HETATM 3823 O HOH B 257 19.289 66.894 11.104 1.00 38.50 O HETATM 3824 O HOH B 258 10.449 39.769 1.261 1.00 35.39 O HETATM 3825 O HOH B 259 25.833 44.593 25.057 1.00 50.61 O HETATM 3826 O HOH B 260 5.366 54.530 16.247 1.00 59.04 O HETATM 3827 O HOH B 261 3.502 37.024 14.806 1.00 37.34 O HETATM 3828 O HOH B 262 20.707 43.732 3.559 1.00 37.61 O HETATM 3829 O HOH B 263 17.020 47.101 2.289 1.00 34.22 O HETATM 3830 O HOH B 264 22.510 28.919 9.347 1.00 33.52 O HETATM 3831 O HOH B 265 12.703 57.703 9.705 1.00 40.37 O HETATM 3832 O HOH B 266 11.592 37.557 26.951 1.00 49.89 O HETATM 3833 O HOH B 267 18.200 43.524 3.176 1.00 34.93 O HETATM 3834 O HOH B 268 26.941 33.965 9.423 1.00 42.84 O HETATM 3835 O HOH B 269 23.124 45.438 2.502 1.00 42.67 O HETATM 3836 O HOH B 270 9.722 24.349 18.013 1.00 26.27 O HETATM 3837 O HOH B 271 20.761 35.161 4.082 1.00 37.94 O HETATM 3838 O HOH B 272 30.566 46.477 15.881 1.00 41.15 O HETATM 3839 O HOH B 273 7.414 55.136 8.716 1.00 54.21 O HETATM 3840 O HOH B 274 3.724 36.549 19.730 1.00 43.71 O HETATM 3841 O HOH B 275 5.654 51.761 11.741 1.00 38.76 O HETATM 3842 O HOH B 276 5.316 27.891 9.660 1.00 48.04 O HETATM 3843 O HOH B 277 26.404 56.463 23.796 1.00 53.36 O HETATM 3844 O HOH B 278 10.526 39.999 27.378 1.00 60.15 O HETATM 3845 O HOH B 279 10.312 56.314 19.958 1.00 48.76 O HETATM 3846 O HOH B 280 16.867 25.079 5.277 1.00 58.96 O HETATM 3847 O HOH B 281 4.942 39.262 18.233 1.00 41.83 O HETATM 3848 O HOH B 282 17.865 58.563 24.830 1.00 59.61 O HETATM 3849 O HOH B 283 7.787 46.884 26.632 1.00 56.87 O HETATM 3850 O HOH B 284 19.335 39.712 26.408 1.00 58.42 O HETATM 3851 O HOH B 285 1.364 39.198 5.542 1.00 61.44 O HETATM 3852 O HOH B 286 21.098 36.543 0.000 0.50 55.64 O HETATM 3853 O HOH B 287 0.667 40.361 7.706 1.00 57.44 O HETATM 3854 O HOH B 288 24.418 42.293 0.000 0.50 49.33 O HETATM 3855 O HOH B 289 15.131 25.862 3.194 1.00 59.04 O HETATM 3856 O HOH B 290 19.067 32.560 26.041 1.00 57.06 O HETATM 3857 O HOH B 291 3.990 45.043 13.661 1.00 51.31 O HETATM 3858 O HOH B 292 15.221 14.524 10.192 1.00 40.36 O HETATM 3859 O HOH B 293 5.073 54.570 12.953 1.00 58.26 O HETATM 3860 O HOH B 294 6.508 41.100 20.119 1.00 34.91 O HETATM 3861 O HOH B 295 7.127 48.822 19.199 1.00 50.42 O HETATM 3862 O HOH B 296 4.476 43.990 9.522 1.00 44.66 O HETATM 3863 O HOH B 297 19.197 23.343 7.895 1.00 50.27 O HETATM 3864 O HOH B 298 5.146 43.399 20.462 1.00 43.49 O HETATM 3865 O HOH B 299 7.226 25.181 7.001 1.00 48.67 O HETATM 3866 O HOH B 300 4.597 49.472 20.294 1.00 51.62 O HETATM 3867 O HOH A 401 12.495 53.945 -14.401 1.00 49.34 O HETATM 3868 O HOH A 402 3.765 72.007 0.710 1.00 55.11 O HETATM 3869 O HOH A 403 27.647 53.687 -10.780 1.00 50.64 O HETATM 3870 O HOH A 404 19.098 73.114 -14.255 1.00 28.84 O HETATM 3871 O HOH A 405 13.626 65.160 15.911 1.00 82.22 O HETATM 3872 O HOH A 406 5.000 61.522 2.779 1.00 50.50 O HETATM 3873 O HOH A 407 11.603 61.991 -11.194 1.00 45.43 O HETATM 3874 O HOH A 408 16.108 63.867 4.676 1.00 44.45 O HETATM 3875 O HOH A 409 25.471 66.720 12.468 1.00 48.40 O HETATM 3876 O HOH A 410 9.354 55.128 1.198 1.00 39.49 O HETATM 3877 O HOH A 411 24.632 70.092 9.018 1.00 36.31 O HETATM 3878 O HOH A 412 13.582 46.846 -8.550 1.00 47.31 O HETATM 3879 O HOH A 413 25.397 59.904 1.670 1.00 47.49 O HETATM 3880 O HOH A 414 23.116 61.320 9.761 1.00 33.15 O HETATM 3881 O HOH A 415 12.405 51.968 -3.994 1.00 40.93 O HETATM 3882 O HOH A 416 18.234 71.854 -18.577 1.00 30.14 O HETATM 3883 O HOH A 417 25.046 69.392 0.728 1.00 23.99 O HETATM 3884 O HOH A 418 31.366 71.102 -6.491 1.00 53.64 O HETATM 3885 O HOH A 419 4.038 66.504 -4.816 1.00 56.78 O HETATM 3886 O HOH A 420 30.321 72.359 4.182 1.00 35.66 O HETATM 3887 O HOH A 421 11.166 79.970 -4.045 1.00 37.25 O HETATM 3888 O HOH A 422 8.165 57.827 -4.381 1.00 38.67 O HETATM 3889 O HOH A 423 9.691 69.174 -10.917 1.00 33.35 O HETATM 3890 O HOH A 424 21.103 77.075 3.494 1.00 31.99 O HETATM 3891 O HOH A 425 20.621 80.373 -0.201 1.00 29.03 O HETATM 3892 O HOH A 426 24.764 77.304 -10.184 1.00 41.97 O HETATM 3893 O HOH A 427 15.894 72.134 9.370 1.00 41.39 O HETATM 3894 O HOH A 428 23.474 84.399 -0.387 1.00 36.14 O HETATM 3895 O HOH A 429 14.235 67.970 11.337 1.00 49.68 O HETATM 3896 O HOH A 430 4.128 68.853 -0.119 1.00 36.93 O HETATM 3897 O HOH A 431 21.937 77.964 -8.679 1.00 38.43 O HETATM 3898 O HOH A 432 18.714 83.324 -2.357 1.00 27.23 O HETATM 3899 O HOH A 433 8.515 66.673 19.269 1.00 43.15 O HETATM 3900 O HOH A 434 25.346 77.728 -5.622 1.00 30.50 O HETATM 3901 O HOH A 435 10.057 66.536 -12.630 1.00 44.88 O HETATM 3902 O HOH A 436 24.922 69.811 -11.104 1.00 38.73 O HETATM 3903 O HOH A 437 10.387 69.538 -8.239 1.00 30.36 O HETATM 3904 O HOH A 438 5.221 63.569 4.018 1.00 34.66 O HETATM 3905 O HOH A 439 7.864 71.608 9.121 1.00 42.75 O HETATM 3906 O HOH A 440 10.885 59.999 20.618 1.00 38.00 O HETATM 3907 O HOH A 441 10.940 50.476 -7.696 1.00 63.39 O HETATM 3908 O HOH A 442 18.665 50.611 -11.762 1.00 43.27 O HETATM 3909 O HOH A 443 11.327 65.403 25.683 1.00 33.54 O HETATM 3910 O HOH A 444 24.328 66.147 -13.214 1.00 45.75 O HETATM 3911 O HOH A 445 17.923 72.510 7.825 1.00 38.50 O HETATM 3912 O HOH A 446 27.594 66.700 19.931 1.00 57.73 O HETATM 3913 O HOH A 447 3.816 62.468 -2.599 1.00 44.91 O HETATM 3914 O HOH A 448 29.547 68.460 -9.781 1.00 56.10 O HETATM 3915 O HOH A 449 32.153 73.185 1.601 1.00 40.69 O HETATM 3916 O HOH A 450 28.670 58.633 17.164 1.00 54.68 O HETATM 3917 O HOH A 451 32.273 64.656 -2.257 1.00 47.85 O HETATM 3918 O HOH A 452 10.594 76.237 -6.219 1.00 35.20 O HETATM 3919 O HOH A 453 27.774 72.544 -10.368 1.00 56.50 O HETATM 3920 O HOH A 454 12.997 52.907 0.762 1.00 28.73 O HETATM 3921 O HOH A 455 7.283 67.339 9.233 1.00 43.49 O HETATM 3922 O HOH A 456 30.973 58.629 -7.502 1.00 56.84 O HETATM 3923 O HOH A 457 16.127 78.209 -2.994 1.00 23.14 O HETATM 3924 O HOH A 458 16.182 43.514 -8.998 1.00 48.86 O HETATM 3925 O HOH A 459 20.550 56.360 -20.031 1.00 51.51 O HETATM 3926 O HOH A 460 18.661 50.727 -16.174 1.00 36.10 O HETATM 3927 O HOH A 461 24.527 55.073 0.782 1.00 51.35 O HETATM 3928 O HOH A 462 25.924 67.459 -11.050 1.00 33.60 O HETATM 3929 O HOH A 463 24.882 56.150 -5.693 1.00 52.02 O HETATM 3930 O HOH A 464 32.798 61.872 2.222 1.00 60.80 O HETATM 3931 O HOH A 465 7.937 56.673 -0.368 1.00 49.29 O HETATM 3932 O HOH A 466 19.627 65.141 -19.104 1.00 43.63 O HETATM 3933 O HOH A 467 27.603 74.832 5.678 1.00 42.42 O HETATM 3934 O HOH A 468 12.379 64.655 -11.915 1.00 44.08 O HETATM 3935 O HOH A 469 11.337 72.305 10.533 1.00 36.94 O HETATM 3936 O HOH A 470 32.244 71.560 -3.393 1.00 45.99 O HETATM 3937 O HOH A 471 28.488 86.808 3.112 1.00 58.14 O HETATM 3938 O HOH A 472 28.918 63.861 3.833 1.00 34.91 O HETATM 3939 O HOH A 473 28.024 73.895 -7.610 1.00 33.07 O HETATM 3940 O HOH A 474 32.491 61.502 -7.905 1.00 62.62 O HETATM 3941 O HOH A 475 21.334 72.813 -20.545 1.00 30.57 O HETATM 3942 O HOH A 476 30.852 65.263 11.068 1.00 53.60 O HETATM 3943 O HOH A 477 4.759 72.089 -1.916 1.00 56.28 O HETATM 3944 O HOH A 478 26.651 61.538 -12.993 1.00 54.24 O HETATM 3945 O HOH A 479 13.401 63.457 -13.935 1.00 44.63 O HETATM 3946 O HOH A 480 16.516 71.144 -16.486 1.00 31.07 O HETATM 3947 O HOH A 481 27.823 76.647 -7.044 1.00 48.29 O HETATM 3948 O HOH A 482 32.674 58.718 -5.431 1.00 61.54 O HETATM 3949 O HOH A 483 28.112 63.385 22.608 1.00 61.23 O HETATM 3950 O HOH A 484 11.980 51.194 -0.781 1.00 45.01 O HETATM 3951 O HOH A 485 29.317 55.199 -11.326 1.00 59.78 O HETATM 3952 O HOH A 486 2.507 67.131 3.141 1.00 61.71 O HETATM 3953 O HOH A 487 28.038 59.186 0.825 1.00 44.46 O HETATM 3954 O HOH A 488 12.846 48.284 -0.341 1.00 52.93 O HETATM 3955 O HOH A 489 21.465 50.758 -16.940 1.00 52.04 O HETATM 3956 O HOH A 490 31.800 74.287 -2.329 1.00 49.84 O HETATM 3957 O HOH A 491 9.415 62.794 -14.809 1.00 65.18 O HETATM 3958 O HOH A 492 19.194 72.240 10.431 1.00 47.48 O HETATM 3959 O HOH A 493 6.633 56.691 -2.547 1.00 55.75 O HETATM 3960 O HOH A 494 29.912 59.085 -1.829 1.00 66.15 O HETATM 3961 O HOH A 495 8.659 64.286 -12.054 1.00 53.29 O HETATM 3962 O HOH A 496 22.466 54.922 -19.066 1.00 55.49 O HETATM 3963 O HOH A 497 32.708 59.716 -0.112 1.00 66.78 O HETATM 3964 O HOH A 498 7.979 43.372 -10.626 1.00 54.91 O CONECT 286 1403 CONECT 1403 286 END