USER MOD reduce.3.24.130724 H: found=0, std=0, add=1916, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1964 hydrogens (74 hets) HEADER HYDROLASE 20-OCT-19 6T70 TITLE STRUCTURE OF THE BOTTROMYCIN EPIMERASE BOTH IN COMPLEX WITH TITLE 2 BOTTROMYCIN A2 DERIVATIVE COMPND MOL_ID: 1; COMPND 2 MOLECULE: BOTH; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES SP. BC16019; SOURCE 3 ORGANISM_TAXID: 1109705; SOURCE 4 GENE: BOTH; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 7 EXPRESSION_SYSTEM_VARIANT: ROSETTA 2 KEYWDS BOTTROMYCIN, RIPP, EPIMERASE, ABH, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR J.KOEHNKE,A.SIKANDAR REVDAT 1 15-JUL-20 6T70 0 JRNL AUTH A.SIKANDAR,L.FRANZ,S.ADAM,J.SANTOS-ABERTURAS,L.HORBAL, JRNL AUTH 2 A.LUZHETSKYY,A.W.TRUMAN,O.V.KALININA,J.KOEHNKE JRNL TITL THE BOTTROMYCIN EPIMERASE BOTH DEFINES A GROUP OF ATYPICAL JRNL TITL 2 ALPHA / BETA-HYDROLASE-FOLD ENZYMES. JRNL REF NAT.CHEM.BIOL. 2020 JRNL REFN ESSN 1552-4469 JRNL PMID 32601484 JRNL DOI 10.1038/S41589-020-0569-Y REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH P.V.AFONINE,R.W.GROSSE-KUNSTLEVE,N.ECHOLS,J.J.HEADD, REMARK 1 AUTH 2 N.W.MORIARTY,M.MUSTYAKIMOV,T.C.TERWILLIGER,A.URZHUMTSEV, REMARK 1 AUTH 3 P.H.ZWART,P.D.ADAMS REMARK 1 TITL TOWARDS AUTOMATED CRYSTALLOGRAPHIC STRUCTURE REFINEMENT WITH REMARK 1 TITL 2 PHENIX.REFINE. REMARK 1 REF ACTA CRYSTALLOGR. D BIOL. V. 68 352 2012 REMARK 1 REF 2 CRYSTALLOGR. REMARK 1 REFN ESSN 1399-0047 REMARK 1 PMID 22505256 REMARK 1 DOI 10.1107/S0907444912001308 REMARK 2 REMARK 2 RESOLUTION. 1.58 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.13_2998 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.58 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 44.22 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.7 REMARK 3 NUMBER OF REFLECTIONS : 32377 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.168 REMARK 3 R VALUE (WORKING SET) : 0.166 REMARK 3 FREE R VALUE : 0.200 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.090 REMARK 3 FREE R VALUE TEST SET COUNT : 1648 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 44.2200 - 3.6200 0.99 2695 152 0.1568 0.1934 REMARK 3 2 3.6200 - 2.8700 0.99 2595 137 0.1540 0.1667 REMARK 3 3 2.8700 - 2.5100 1.00 2561 153 0.1518 0.1836 REMARK 3 4 2.5100 - 2.2800 1.00 2554 131 0.1562 0.2000 REMARK 3 5 2.2800 - 2.1200 1.00 2578 135 0.1579 0.2160 REMARK 3 6 2.1200 - 1.9900 1.00 2540 133 0.1611 0.1842 REMARK 3 7 1.9900 - 1.8900 1.00 2547 123 0.1749 0.2257 REMARK 3 8 1.8900 - 1.8100 1.00 2564 142 0.1909 0.2171 REMARK 3 9 1.8100 - 1.7400 1.00 2534 129 0.2042 0.2409 REMARK 3 10 1.7400 - 1.6800 1.00 2544 126 0.2194 0.2758 REMARK 3 11 1.6800 - 1.6300 1.00 2495 148 0.2373 0.2565 REMARK 3 12 1.6300 - 1.5800 1.00 2522 139 0.2392 0.3021 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.151 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 21.026 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 18.46 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 29.65 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 : 0.012 2057 REMARK 3 ANGLE : 1.254 2791 REMARK 3 CHIRALITY : 0.066 294 REMARK 3 PLANARITY : 0.008 375 REMARK 3 DIHEDRAL : 14.659 1175 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 7 REMARK 3 TLS GROUP : 1 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 10 THROUGH 83 ) REMARK 3 ORIGIN FOR THE GROUP (A): -25.9014 -8.1231 -11.3881 REMARK 3 T TENSOR REMARK 3 T11: 0.1111 T22: 0.1366 REMARK 3 T33: 0.1076 T12: 0.0099 REMARK 3 T13: -0.0036 T23: -0.0075 REMARK 3 L TENSOR REMARK 3 L11: 1.1900 L22: 3.4708 REMARK 3 L33: 1.0571 L12: 0.2724 REMARK 3 L13: -0.3025 L23: -0.1929 REMARK 3 S TENSOR REMARK 3 S11: -0.0089 S12: -0.0499 S13: -0.0281 REMARK 3 S21: 0.0988 S22: -0.0122 S23: 0.1044 REMARK 3 S31: 0.0567 S32: -0.0382 S33: -0.0025 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 84 THROUGH 102 ) REMARK 3 ORIGIN FOR THE GROUP (A): -18.1178 -5.2138 -5.0242 REMARK 3 T TENSOR REMARK 3 T11: 0.1379 T22: 0.1123 REMARK 3 T33: 0.0979 T12: 0.0224 REMARK 3 T13: -0.0158 T23: -0.0467 REMARK 3 L TENSOR REMARK 3 L11: 7.2975 L22: 4.4844 REMARK 3 L33: 6.8413 L12: -0.8861 REMARK 3 L13: -1.2539 L23: -0.6561 REMARK 3 S TENSOR REMARK 3 S11: -0.0729 S12: -0.3716 S13: -0.0002 REMARK 3 S21: 0.2610 S22: -0.0960 S23: 0.0369 REMARK 3 S31: 0.1364 S32: 0.3152 S33: 0.0928 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 103 THROUGH 167 ) REMARK 3 ORIGIN FOR THE GROUP (A): -15.6091 -6.4975 -21.8593 REMARK 3 T TENSOR REMARK 3 T11: 0.1466 T22: 0.1476 REMARK 3 T33: 0.1416 T12: 0.0042 REMARK 3 T13: 0.0071 T23: -0.0187 REMARK 3 L TENSOR REMARK 3 L11: 1.7726 L22: 1.3108 REMARK 3 L33: 0.1059 L12: -0.5135 REMARK 3 L13: 0.1913 L23: -0.1481 REMARK 3 S TENSOR REMARK 3 S11: 0.0005 S12: 0.1884 S13: 0.0620 REMARK 3 S21: -0.1087 S22: -0.0340 S23: -0.1228 REMARK 3 S31: -0.0143 S32: 0.0752 S33: 0.0311 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 168 THROUGH 182 ) REMARK 3 ORIGIN FOR THE GROUP (A): -27.7942 -9.5753 -27.5513 REMARK 3 T TENSOR REMARK 3 T11: 0.1284 T22: 0.1468 REMARK 3 T33: 0.1488 T12: -0.0165 REMARK 3 T13: -0.0171 T23: -0.0035 REMARK 3 L TENSOR REMARK 3 L11: 4.1111 L22: 5.9558 REMARK 3 L33: 9.5429 L12: -4.7845 REMARK 3 L13: -4.9217 L23: 6.9820 REMARK 3 S TENSOR REMARK 3 S11: -0.0633 S12: 0.1983 S13: -0.1977 REMARK 3 S21: -0.1290 S22: -0.1040 S23: 0.1451 REMARK 3 S31: 0.2515 S32: -0.1865 S33: 0.1760 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 183 THROUGH 208 ) REMARK 3 ORIGIN FOR THE GROUP (A): -10.3066 -3.6917 -16.2385 REMARK 3 T TENSOR REMARK 3 T11: 0.1581 T22: 0.1413 REMARK 3 T33: 0.1347 T12: -0.0041 REMARK 3 T13: 0.0044 T23: -0.0554 REMARK 3 L TENSOR REMARK 3 L11: 8.0395 L22: 8.4218 REMARK 3 L33: 6.1305 L12: -7.1994 REMARK 3 L13: 6.2517 L23: -6.4175 REMARK 3 S TENSOR REMARK 3 S11: -0.1569 S12: -0.0430 S13: 0.3928 REMARK 3 S21: 0.1254 S22: -0.0162 S23: -0.5405 REMARK 3 S31: -0.0895 S32: 0.1096 S33: 0.1487 REMARK 3 TLS GROUP : 6 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 209 THROUGH 242 ) REMARK 3 ORIGIN FOR THE GROUP (A): -7.3467 -19.6350 -21.9236 REMARK 3 T TENSOR REMARK 3 T11: 0.1291 T22: 0.0938 REMARK 3 T33: 0.1489 T12: 0.0493 REMARK 3 T13: 0.0240 T23: 0.0013 REMARK 3 L TENSOR REMARK 3 L11: 7.1690 L22: 3.4555 REMARK 3 L33: 6.2621 L12: 3.0117 REMARK 3 L13: 3.2525 L23: 2.6325 REMARK 3 S TENSOR REMARK 3 S11: -0.1065 S12: 0.1549 S13: -0.0634 REMARK 3 S21: -0.0937 S22: 0.1300 S23: -0.2266 REMARK 3 S31: 0.0370 S32: 0.1398 S33: -0.0313 REMARK 3 TLS GROUP : 7 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 243 THROUGH 262 ) REMARK 3 ORIGIN FOR THE GROUP (A): -19.2569 -23.2017 -19.6032 REMARK 3 T TENSOR REMARK 3 T11: 0.1854 T22: 0.0900 REMARK 3 T33: 0.1447 T12: 0.0079 REMARK 3 T13: 0.0242 T23: -0.0451 REMARK 3 L TENSOR REMARK 3 L11: 4.2576 L22: 7.4512 REMARK 3 L33: 3.7576 L12: 1.7303 REMARK 3 L13: -2.1124 L23: -5.1162 REMARK 3 S TENSOR REMARK 3 S11: -0.1683 S12: -0.0125 S13: -0.2077 REMARK 3 S21: -0.2764 S22: 0.0674 S23: -0.0693 REMARK 3 S31: 0.1906 S32: -0.0399 S33: 0.0550 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 6T70 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 21-OCT-19. REMARK 100 THE DEPOSITION ID IS D_1292104928. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 02-MAR-18 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SLS REMARK 200 BEAMLINE : X06DA REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000031 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 2M-F REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : SCALA REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 32388 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.580 REMARK 200 RESOLUTION RANGE LOW (A) : 44.220 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : 4.300 REMARK 200 R MERGE (I) : 0.06000 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 13.5000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.58 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.61 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.9 REMARK 200 DATA REDUNDANCY IN SHELL : 4.40 REMARK 200 R MERGE FOR SHELL (I) : 0.71200 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.000 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: 6T6H REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 42.42 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.14 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: MES, AMMONIUM SULFATE, VAPOR REMARK 280 DIFFUSION, HANGING DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: I 2 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z REMARK 290 3555 -X,Y,-Z REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z+1/2 REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 33.27200 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 39.71500 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 44.22200 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 33.27200 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 39.71500 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 44.22200 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 33.27200 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 39.71500 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 44.22200 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 33.27200 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 39.71500 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 44.22200 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: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 560 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 10480 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -42.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: 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 ZN ZN A 304 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 463 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 490 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 551 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 559 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 575 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 583 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 HIS A -16 REMARK 465 HIS A -15 REMARK 465 HIS A -14 REMARK 465 HIS A -13 REMARK 465 HIS A -12 REMARK 465 HIS A -11 REMARK 465 SER A -10 REMARK 465 SER A -9 REMARK 465 GLY A -8 REMARK 465 LEU A -7 REMARK 465 VAL A -6 REMARK 465 PRO A -5 REMARK 465 ARG A -4 REMARK 465 GLY A -3 REMARK 465 SER A -2 REMARK 465 HIS A -1 REMARK 465 MET A 0 REMARK 465 VAL A 1 REMARK 465 ARG A 2 REMARK 465 ASP A 3 REMARK 465 GLY A 4 REMARK 465 ASN A 5 REMARK 465 GLY A 6 REMARK 465 THR A 7 REMARK 465 SER A 8 REMARK 465 ARG A 9 REMARK 465 GLU A 263 REMARK 465 GLY A 264 REMARK 465 GLY A 265 REMARK 465 HIS A 266 REMARK 465 GLY A 267 REMARK 465 THR A 268 REMARK 465 GLY A 269 REMARK 465 ASP A 270 REMARK 465 ALA A 271 REMARK 465 PRO A 272 REMARK 465 ALA A 273 REMARK 465 GLU A 274 REMARK 465 ALA A 275 REMARK 465 ARG A 276 REMARK 465 THR A 277 REMARK 465 THR A 278 REMARK 465 GLY A 279 REMARK 465 ASP A 280 REMARK 465 ALA A 281 REMARK 465 PRO A 282 REMARK 465 ALA A 283 REMARK 465 GLU A 284 REMARK 465 ALA A 285 REMARK 465 ARG A 286 REMARK 465 ALA A 287 REMARK 465 SER A 288 REMARK 465 GLY A 289 REMARK 465 THR A 290 REMARK 465 GLY A 291 REMARK 465 VAL A 292 REMARK 465 VAL A 293 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 HE ARG A 102 O HOH A 402 1.44 REMARK 500 HH11 ARG A 100 O HOH A 401 1.50 REMARK 500 HH21 ARG A 10 O HOH A 403 1.51 REMARK 500 NH1 ARG A 100 O HOH A 401 1.91 REMARK 500 NE ARG A 102 O HOH A 402 2.00 REMARK 500 O HOH A 403 O HOH A 505 2.10 REMARK 500 O HOH A 539 O HOH A 582 2.11 REMARK 500 NH2 ARG A 10 O HOH A 403 2.13 REMARK 500 NH2 ARG A 102 O HOH A 402 2.14 REMARK 500 OE1 GLU A 146 O HOH A 404 2.15 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 HE ARG A 199 HE ARG A 199 2555 1.31 REMARK 500 O HOH A 566 O HOH A 591 8544 1.90 REMARK 500 O HOH A 584 O HOH A 599 2455 2.08 REMARK 500 O HOH A 585 O HOH A 601 8444 2.13 REMARK 500 O HOH A 485 O HOH A 485 4555 2.17 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 A 42 37.87 -99.95 REMARK 500 VAL A 76 -70.99 -124.90 REMARK 500 PHE A 109 -126.15 59.46 REMARK 500 HIS A 195 59.41 -119.87 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 304 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 158 ND1 REMARK 620 2 HOH A 451 O 108.1 REMARK 620 3 HOH A 583 O 122.6 62.7 REMARK 620 4 HIS A 158 ND1 0.0 108.1 122.6 REMARK 620 5 HOH A 583 O 122.6 62.7 0.0 122.6 REMARK 620 6 HOH A 451 O 100.5 125.4 62.7 100.5 62.7 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 301 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue GOL A 302 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 A 303 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 304 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue GOL A 305 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MQZ A 306 DBREF 6T70 A 2 293 UNP K4MHV9 K4MHV9_9ACTN 2 293 SEQADV 6T70 HIS A -16 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 HIS A -15 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 HIS A -14 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 HIS A -13 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 HIS A -12 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 HIS A -11 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 SER A -10 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 SER A -9 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 GLY A -8 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 LEU A -7 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 VAL A -6 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 PRO A -5 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 ARG A -4 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 GLY A -3 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 SER A -2 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 HIS A -1 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 MET A 0 UNP K4MHV9 EXPRESSION TAG SEQADV 6T70 VAL A 1 UNP K4MHV9 EXPRESSION TAG SEQRES 1 A 310 HIS HIS HIS HIS HIS HIS SER SER GLY LEU VAL PRO ARG SEQRES 2 A 310 GLY SER HIS MET VAL ARG ASP GLY ASN GLY THR SER ARG SEQRES 3 A 310 ARG ASP VAL PHE GLU VAL PHE SER ARG ASP GLY THR PRO SEQRES 4 A 310 ILE ARG GLY PHE SER ARG PRO GLY PRO GLY GLU THR VAL SEQRES 5 A 310 VAL LEU VAL HIS GLY VAL ALA MET ASP ARG ARG ILE TRP SEQRES 6 A 310 ALA GLU SER GLY PHE LEU ASP ALA LEU PRO ASP ALA HIS SEQRES 7 A 310 VAL LEU ALA LEU ASP LEU ARG GLY ARG GLY GLU SER GLY SEQRES 8 A 310 ARG VAL GLY THR ALA GLU GLY HIS ALA LEU ARG ARG TYR SEQRES 9 A 310 VAL GLU ASP VAL ARG ALA VAL LEU ASP ARG PHE GLY ARG SEQRES 10 A 310 ALA ARG TYR SER LEU PHE GLY THR PHE PHE GLY GLY ARG SEQRES 11 A 310 ILE ALA LEU GLN VAL ALA ALA VAL ASP THR ARG VAL ALA SEQRES 12 A 310 ARG ALA PHE SER PHE CYS ALA HIS ALA GLU GLN VAL GLU SEQRES 13 A 310 ILE PRO GLU ASP ALA VAL GLU GLU GLU ALA VAL ALA VAL SEQRES 14 A 310 GLU GLY PRO GLY GLY HIS ALA TYR LEU ARG ASP HIS PHE SEQRES 15 A 310 THR GLY ARG GLY ALA PRO PRO TRP MET VAL GLU ALA CYS SEQRES 16 A 310 ALA ARG VAL ASP PRO GLY GLU LEU GLY ALA ALA THR ARG SEQRES 17 A 310 GLY LEU LEU HIS GLY SER ASP ARG ARG THR GLU ARG GLY SEQRES 18 A 310 HIS PRO ASP GLN GLU LEU VAL LEU ILE THR ALA ASP GLY SEQRES 19 A 310 ASP ALA ASP LEU ALA PRO PHE HIS ALA GLY GLU ARG ARG SEQRES 20 A 310 LEU GLY ALA HIS LEU TRP LEU VAL ASP ALA PRO THR ARG SEQRES 21 A 310 ILE LYS ALA ALA GLY ARG LEU ALA GLU VAL GLY ARG ARG SEQRES 22 A 310 VAL ALA GLY VAL LEU ALA GLU GLY GLY HIS GLY THR GLY SEQRES 23 A 310 ASP ALA PRO ALA GLU ALA ARG THR THR GLY ASP ALA PRO SEQRES 24 A 310 ALA GLU ALA ARG ALA SER GLY THR GLY VAL VAL HET CL A 301 1 HET GOL A 302 12 HET SO4 A 303 5 HET ZN A 304 1 HET GOL A 305 12 HET MQZ A 306 122 HETNAM CL CHLORIDE ION HETNAM GOL GLYCEROL HETNAM SO4 SULFATE ION HETNAM ZN ZINC ION HETNAM MQZ BOTTROMYCIN A2 DERIVATIVE HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 2 CL CL 1- FORMUL 3 GOL 2(C3 H8 O3) FORMUL 4 SO4 O4 S 2- FORMUL 5 ZN ZN 2+ FORMUL 7 MQZ C42 H62 N8 O8 S2 FORMUL 8 HOH *201(H2 O) HELIX 1 AA1 ARG A 46 SER A 51 1 6 HELIX 2 AA2 PHE A 53 LEU A 57 5 5 HELIX 3 AA3 ALA A 79 HIS A 82 5 4 HELIX 4 AA4 ALA A 83 GLY A 99 1 17 HELIX 5 AA5 PHE A 109 ASP A 122 1 14 HELIX 6 AA6 PRO A 141 GLY A 154 1 14 HELIX 7 AA7 GLY A 156 ARG A 168 1 13 HELIX 8 AA8 PRO A 171 CYS A 178 1 8 HELIX 9 AA9 ALA A 179 VAL A 181 5 3 HELIX 10 AB1 ASP A 182 LEU A 193 1 12 HELIX 11 AB2 LEU A 221 GLY A 232 1 12 HELIX 12 AB3 THR A 242 ALA A 247 1 6 HELIX 13 AB4 ARG A 249 ALA A 262 1 14 SHEET 1 AA1 8 ASP A 11 PHE A 16 0 SHEET 2 AA1 8 PRO A 22 ARG A 28 -1 O SER A 27 N ASP A 11 SHEET 3 AA1 8 HIS A 61 LEU A 65 -1 O VAL A 62 N ARG A 28 SHEET 4 AA1 8 THR A 34 VAL A 38 1 N VAL A 35 O LEU A 63 SHEET 5 AA1 8 TYR A 103 THR A 108 1 O SER A 104 N VAL A 36 SHEET 6 AA1 8 VAL A 125 PHE A 131 1 O PHE A 131 N GLY A 107 SHEET 7 AA1 8 GLU A 209 ALA A 215 1 O VAL A 211 N SER A 130 SHEET 8 AA1 8 HIS A 234 VAL A 238 1 O TRP A 236 N LEU A 212 LINK ND1 HIS A 158 ZN ZN A 304 1555 1555 2.00 LINK ZN ZN A 304 O HOH A 451 1555 1555 2.43 LINK ZN ZN A 304 O HOH A 583 1555 1555 2.11 LINK ND1 HIS A 158 ZN ZN A 304 1555 2455 2.00 LINK ZN ZN A 304 O HOH A 583 1555 2455 2.11 LINK ZN ZN A 304 O HOH A 451 1555 2455 2.43 SITE *** AC1 4 GLY A 40 VAL A 41 PHE A 109 PHE A 110 SITE *** AC2 4 ARG A 100 ALA A 101 ARG A 102 HOH A 427 SITE *** AC3 9 ARG A 46 ARG A 180 ASP A 182 PRO A 183 SITE *** AC3 9 GLY A 184 HOH A 411 HOH A 439 HOH A 459 SITE *** AC3 9 HOH A 497 SITE *** AC4 3 HIS A 158 HOH A 451 HOH A 583 SITE *** AC5 3 ARG A 18 ARG A 86 HOH A 538 SITE *** AC6 15 PHE A 109 PHE A 110 ARG A 113 PRO A 141 SITE *** AC6 15 GLU A 148 HIS A 164 PHE A 165 ARG A 168 SITE *** AC6 15 THR A 190 LEU A 193 SER A 197 ILE A 244 SITE *** AC6 15 HOH A 409 HOH A 499 HOH A 542 CRYST1 66.544 79.430 88.444 90.00 90.00 90.00 I 2 2 2 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.015028 0.000000 0.000000 0.00000 SCALE2 0.000000 0.012590 0.000000 0.00000 SCALE3 0.000000 0.000000 0.011307 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 NoAdj-H: A 158 HIS HD1 : A 158 HIS ND1 : A 304 ZNZN :(H bumps) USER MOD Set 1.1: A 82 HIS : no HD1:sc= 1.49 K(o=4.1,f=-6.3!) USER MOD Set 1.2: A 87 TYR OH : rot 36:sc= 2.59 USER MOD Set 2.1: A 27 SER OG : rot -170:sc= 0.731 USER MOD Set 2.2: A 61 HIS : no HD1:sc= 0.379 K(o=1.1,f=-6.2!) USER MOD Single : A 17 SER OG : rot 146:sc= 2.06 USER MOD Single : A 21 THR OG1 : rot 84:sc= 1.8 USER MOD Single : A 34 THR OG1 : rot -150:sc= 0 USER MOD Single : A 39 HIS : no HE2:sc= 1.44 K(o=1.4,f=-7.7!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot -87:sc= 0.484 USER MOD Single : A 73 SER OG : rot 162:sc= 1.91 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.141 USER MOD Single : A 103 TYR OH : rot -144:sc= 1.65 USER MOD Single : A 104 SER OG : rot 110:sc= 0.318 USER MOD Single : A 108 THR OG1 : rot 36:sc= 0.397 USER MOD Single : A 117 GLN : amide:sc= 2.22 K(o=2.2,f=1.5) USER MOD Single : A 123 THR OG1 : rot -109:sc= 0.0378 USER MOD Single : A 130 SER OG : rot -115:sc= 0.89 USER MOD Single : A 132 CYS SG : rot 111:sc= 0.492 USER MOD Single : A 134 HIS : no HD1:sc= 0.222 K(o=0.22,f=-7.9!) USER MOD Single : A 137 GLN : amide:sc= -0.318 X(o=-0.32,f=0) USER MOD Single : A 160 TYR OH : rot -173:sc= 0.123 USER MOD Single : A 164 HIS : no HD1:sc= -1.14 K(o=-1.1,f=-1.9) USER MOD Single : A 166 THR OG1 : rot 80:sc= 0.497 USER MOD Single : A 174 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 178 CYS SG : rot 93:sc= 0.0181 USER MOD Single : A 190 THR OG1 : rot 83:sc= 0.871 USER MOD Single : A 195 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 197 SER OG : rot -91:sc= 0.607 USER MOD Single : A 201 THR OG1 : rot 114:sc= 0.732 USER MOD Single : A 205 HIS A: no HD1:sc= -2.19 K(o=-2.2,f=-3.6!) USER MOD Single : A 205 HIS B: no HD1:sc= -1.14 K(o=-1.1,f=-6.3!) USER MOD Single : A 208 GLN : amide:sc= 1.38 K(o=1.4,f=-3!) USER MOD Single : A 214 THR OG1 : rot -161:sc= 1.34 USER MOD Single : A 225 HIS : no HE2:sc= 1.98 K(o=2,f=-4.5!) USER MOD Single : A 234 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 242 THR OG1 : rot -174:sc= 1.28 USER MOD Single : A 245 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 302 GOL O1 : rot 180:sc= 0 USER MOD Single : A 302 GOL O2 : rot -33:sc= 0.0175 USER MOD Single : A 302 GOL O3 : rot -130:sc= 0.415 USER MOD Single : A 305 GOL O1 : rot 180:sc= -0.104 USER MOD Single : A 305 GOL O2 : rot 180:sc= 0 USER MOD Single : A 305 GOL O3 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 10 -36.173 -15.799 -5.793 1.00 41.76 N ANISOU 1 N ARG A 10 5016 5037 5813 -264 864 57 N ATOM 2 CA ARG A 10 -35.192 -14.712 -5.920 1.00 41.92 C ANISOU 2 CA ARG A 10 5098 5131 5701 -199 770 38 C ATOM 3 C ARG A 10 -35.613 -13.452 -5.170 1.00 38.82 C ANISOU 3 C ARG A 10 4701 4745 5305 -169 880 23 C ATOM 4 O ARG A 10 -36.777 -13.102 -5.137 1.00 43.49 O ANISOU 4 O ARG A 10 5167 5302 6056 -184 976 12 O ATOM 5 CB ARG A 10 -34.969 -14.358 -7.391 1.00 47.74 C ANISOU 5 CB ARG A 10 5740 5915 6486 -186 591 3 C ATOM 6 CG ARG A 10 -33.965 -15.242 -8.097 1.00 56.84 C ANISOU 6 CG ARG A 10 6961 7076 7561 -187 475 4 C ATOM 7 CD ARG A 10 -34.188 -15.280 -9.607 1.00 62.44 C ANISOU 7 CD ARG A 10 7582 7796 8345 -205 335 -32 C ATOM 8 NE ARG A 10 -34.507 -13.972 -10.154 1.00 66.08 N ANISOU 8 NE ARG A 10 7962 8302 8845 -176 274 -54 N ATOM 9 CZ ARG A 10 -34.541 -13.688 -11.452 1.00 67.50 C ANISOU 9 CZ ARG A 10 8099 8501 9047 -179 136 -78 C ATOM 10 NH1 ARG A 10 -34.267 -14.630 -12.347 1.00 71.41 N ANISOU 10 NH1 ARG A 10 8634 8978 9521 -213 53 -97 N ATOM 11 NH2 ARG A 10 -34.847 -12.457 -11.854 1.00 57.55 N ANISOU 11 NH2 ARG A 10 6774 7271 7822 -148 85 -84 N ATOM 0 HA ARG A 10 -34.369 -15.040 -5.524 1.00 41.92 H new ATOM 0 HB2 ARG A 10 -35.817 -14.412 -7.858 1.00 47.74 H new ATOM 0 HB3 ARG A 10 -34.671 -13.437 -7.450 1.00 47.74 H new ATOM 0 HG2 ARG A 10 -33.068 -14.921 -7.912 1.00 56.84 H new ATOM 0 HG3 ARG A 10 -34.023 -16.142 -7.741 1.00 56.84 H new ATOM 0 HD2 ARG A 10 -33.391 -15.623 -10.040 1.00 62.44 H new ATOM 0 HD3 ARG A 10 -34.909 -15.897 -9.809 1.00 62.44 H new ATOM 0 HE ARG A 10 -34.686 -13.339 -9.600 1.00 66.08 H new ATOM 0 HH11 ARG A 10 -34.067 -15.425 -12.087 1.00 71.41 H new ATOM 0 HH12 ARG A 10 -34.289 -14.445 -13.187 1.00 71.41 H new ATOM 0 HH21 ARG A 10 -35.022 -11.846 -11.274 1.00 57.55 H new ATOM 0 HH22 ARG A 10 -34.869 -12.272 -12.694 1.00 57.55 H new ATOM 24 N ASP A 11 -34.637 -12.772 -4.576 1.00 30.50 N ANISOU 24 N ASP A 11 3783 3727 4079 -128 862 21 N ATOM 25 CA ASP A 11 -34.844 -11.491 -3.920 1.00 28.64 C ANISOU 25 CA ASP A 11 3574 3494 3813 -97 950 -6 C ATOM 26 C ASP A 11 -34.069 -10.422 -4.681 1.00 23.86 C ANISOU 26 C ASP A 11 2945 2951 3172 -53 800 -37 C ATOM 27 O ASP A 11 -33.051 -10.700 -5.298 1.00 24.32 O ANISOU 27 O ASP A 11 3031 3050 3160 -43 655 -30 O ATOM 28 CB ASP A 11 -34.394 -11.535 -2.467 1.00 36.79 C ANISOU 28 CB ASP A 11 4815 4501 4661 -100 1061 12 C ATOM 29 CG ASP A 11 -35.381 -10.843 -1.533 1.00 54.93 C ANISOU 29 CG ASP A 11 7135 6744 6993 -103 1279 -9 C ATOM 30 OD1 ASP A 11 -35.743 -11.450 -0.501 1.00 61.62 O ANISOU 30 OD1 ASP A 11 8101 7533 7779 -134 1444 19 O ATOM 31 OD2 ASP A 11 -35.801 -9.697 -1.837 1.00 62.96 O ANISOU 31 OD2 ASP A 11 8056 7765 8101 -72 1298 -53 O ATOM 0 H ASP A 11 -33.823 -13.049 -4.544 1.00 30.50 H new ATOM 0 HA ASP A 11 -35.791 -11.282 -3.924 1.00 28.64 H new ATOM 0 HB2 ASP A 11 -34.286 -12.459 -2.192 1.00 36.79 H new ATOM 0 HB3 ASP A 11 -33.525 -11.111 -2.387 1.00 36.79 H new ATOM 36 N VAL A 12 -34.549 -9.197 -4.642 1.00 21.73 N ANISOU 36 N VAL A 12 2621 2676 2960 -24 848 -70 N ATOM 37 CA VAL A 12 -33.821 -8.103 -5.277 1.00 23.39 C ANISOU 37 CA VAL A 12 2822 2931 3133 15 724 -95 C ATOM 38 C VAL A 12 -33.069 -7.315 -4.216 1.00 21.07 C ANISOU 38 C VAL A 12 2690 2638 2679 30 767 -117 C ATOM 39 O VAL A 12 -33.426 -7.280 -3.043 1.00 23.23 O ANISOU 39 O VAL A 12 3067 2868 2891 18 916 -124 O ATOM 40 CB VAL A 12 -34.738 -7.176 -6.100 1.00 27.59 C ANISOU 40 CB VAL A 12 3189 3452 3841 41 712 -112 C ATOM 41 CG1 VAL A 12 -35.467 -7.966 -7.168 1.00 31.74 C ANISOU 41 CG1 VAL A 12 3567 3976 4516 16 634 -92 C ATOM 42 CG2 VAL A 12 -35.682 -6.499 -5.196 1.00 27.90 C ANISOU 42 CG2 VAL A 12 3212 3433 3957 55 898 -131 C ATOM 0 H VAL A 12 -35.286 -8.972 -4.259 1.00 21.73 H new ATOM 0 HA VAL A 12 -33.192 -8.491 -5.906 1.00 23.39 H new ATOM 0 HB VAL A 12 -34.203 -6.504 -6.550 1.00 27.59 H new ATOM 0 HG11 VAL A 12 -36.039 -7.371 -7.677 1.00 31.74 H new ATOM 0 HG12 VAL A 12 -34.821 -8.380 -7.762 1.00 31.74 H new ATOM 0 HG13 VAL A 12 -36.008 -8.654 -6.749 1.00 31.74 H new ATOM 0 HG21 VAL A 12 -36.261 -5.915 -5.711 1.00 27.90 H new ATOM 0 HG22 VAL A 12 -36.220 -7.161 -4.734 1.00 27.90 H new ATOM 0 HG23 VAL A 12 -35.188 -5.974 -4.546 1.00 27.90 H new ATOM 52 N PHE A 13 -32.015 -6.643 -4.646 1.00 18.46 N ANISOU 52 N PHE A 13 2388 2348 2276 51 636 -130 N ATOM 53 CA PHE A 13 -31.177 -5.873 -3.749 1.00 18.24 C ANISOU 53 CA PHE A 13 2507 2320 2102 55 635 -156 C ATOM 54 C PHE A 13 -30.721 -4.610 -4.457 1.00 18.14 C ANISOU 54 C PHE A 13 2444 2325 2122 82 550 -186 C ATOM 55 O PHE A 13 -30.689 -4.524 -5.680 1.00 17.43 O ANISOU 55 O PHE A 13 2238 2261 2124 98 460 -174 O ATOM 56 CB PHE A 13 -29.951 -6.678 -3.267 1.00 19.54 C ANISOU 56 CB PHE A 13 2798 2510 2117 36 537 -126 C ATOM 57 CG PHE A 13 -28.922 -6.932 -4.295 1.00 18.82 C ANISOU 57 CG PHE A 13 2641 2464 2044 48 376 -108 C ATOM 58 CD1 PHE A 13 -27.998 -5.967 -4.661 1.00 20.02 C ANISOU 58 CD1 PHE A 13 2788 2640 2179 61 280 -130 C ATOM 59 CD2 PHE A 13 -28.829 -8.191 -4.904 1.00 18.63 C ANISOU 59 CD2 PHE A 13 2567 2450 2060 42 334 -69 C ATOM 60 CE1 PHE A 13 -27.049 -6.221 -5.600 1.00 19.45 C ANISOU 60 CE1 PHE A 13 2656 2599 2134 70 164 -112 C ATOM 61 CE2 PHE A 13 -27.861 -8.417 -5.847 1.00 17.51 C ANISOU 61 CE2 PHE A 13 2378 2339 1937 55 214 -58 C ATOM 62 CZ PHE A 13 -26.988 -7.464 -6.198 1.00 18.48 C ANISOU 62 CZ PHE A 13 2490 2485 2047 70 138 -77 C ATOM 0 H PHE A 13 -31.765 -6.621 -5.469 1.00 18.46 H new ATOM 0 HA PHE A 13 -31.701 -5.649 -2.964 1.00 18.24 H new ATOM 0 HB2 PHE A 13 -29.540 -6.202 -2.529 1.00 19.54 H new ATOM 0 HB3 PHE A 13 -30.258 -7.530 -2.920 1.00 19.54 H new ATOM 0 HD1 PHE A 13 -28.028 -5.130 -4.257 1.00 20.02 H new ATOM 0 HD2 PHE A 13 -29.421 -8.869 -4.669 1.00 18.63 H new ATOM 0 HE1 PHE A 13 -26.442 -5.559 -5.839 1.00 19.45 H new ATOM 0 HE2 PHE A 13 -27.809 -9.252 -6.253 1.00 17.51 H new ATOM 0 HZ PHE A 13 -26.342 -7.639 -6.843 1.00 18.48 H new ATOM 72 N GLU A 14 -30.337 -3.640 -3.639 1.00 18.79 N ANISOU 72 N GLU A 14 2638 2385 2115 83 581 -226 N ATOM 73 CA GLU A 14 -29.713 -2.403 -4.101 1.00 19.88 C ANISOU 73 CA GLU A 14 2761 2528 2263 99 504 -257 C ATOM 74 C GLU A 14 -28.536 -2.139 -3.211 1.00 16.63 C ANISOU 74 C GLU A 14 2506 2120 1694 71 438 -279 C ATOM 75 O GLU A 14 -28.620 -2.295 -1.987 1.00 19.31 O ANISOU 75 O GLU A 14 2995 2430 1912 48 508 -296 O ATOM 76 CB GLU A 14 -30.767 -1.262 -4.024 1.00 24.87 C ANISOU 76 CB GLU A 14 3349 3101 2998 129 630 -295 C ATOM 77 CG GLU A 14 -30.244 0.107 -3.913 1.00 27.74 C ANISOU 77 CG GLU A 14 3766 3436 3336 138 610 -341 C ATOM 78 CD GLU A 14 -31.394 1.111 -3.934 1.00 25.27 C ANISOU 78 CD GLU A 14 3390 3054 3159 180 745 -370 C ATOM 79 OE1 GLU A 14 -31.887 1.377 -5.042 1.00 22.88 O ANISOU 79 OE1 GLU A 14 2935 2753 3006 216 702 -338 O ATOM 80 OE2 GLU A 14 -31.801 1.569 -2.856 1.00 24.62 O ANISOU 80 OE2 GLU A 14 3415 2908 3031 177 892 -420 O ATOM 0 H GLU A 14 -30.432 -3.680 -2.785 1.00 18.79 H new ATOM 0 HA GLU A 14 -29.407 -2.463 -5.019 1.00 19.88 H new ATOM 0 HB2 GLU A 14 -31.325 -1.310 -4.816 1.00 24.87 H new ATOM 0 HB3 GLU A 14 -31.342 -1.430 -3.261 1.00 24.87 H new ATOM 0 HG2 GLU A 14 -29.737 0.202 -3.091 1.00 27.74 H new ATOM 0 HG3 GLU A 14 -29.634 0.288 -4.645 1.00 27.74 H new ATOM 87 N VAL A 15 -27.401 -1.740 -3.841 1.00 15.35 N ANISOU 87 N VAL A 15 2313 1988 1533 68 297 -276 N ATOM 88 CA VAL A 15 -26.238 -1.256 -3.117 1.00 16.63 C ANISOU 88 CA VAL A 15 2589 2144 1584 37 206 -302 C ATOM 89 C VAL A 15 -25.775 0.018 -3.810 1.00 17.19 C ANISOU 89 C VAL A 15 2602 2203 1727 42 159 -332 C ATOM 90 O VAL A 15 -26.270 0.372 -4.875 1.00 19.40 O ANISOU 90 O VAL A 15 2764 2484 2124 74 185 -319 O ATOM 91 CB VAL A 15 -25.073 -2.282 -3.087 1.00 16.60 C ANISOU 91 CB VAL A 15 2596 2183 1530 20 67 -254 C ATOM 92 CG1 VAL A 15 -25.499 -3.518 -2.333 1.00 17.64 C ANISOU 92 CG1 VAL A 15 2808 2314 1583 14 113 -218 C ATOM 93 CG2 VAL A 15 -24.588 -2.660 -4.471 1.00 17.76 C ANISOU 93 CG2 VAL A 15 2591 2367 1792 41 -2 -216 C ATOM 0 H VAL A 15 -27.303 -1.749 -4.695 1.00 15.35 H new ATOM 0 HA VAL A 15 -26.489 -1.101 -2.193 1.00 16.63 H new ATOM 0 HB VAL A 15 -24.329 -1.856 -2.634 1.00 16.60 H new ATOM 0 HG11 VAL A 15 -24.768 -4.156 -2.317 1.00 17.64 H new ATOM 0 HG12 VAL A 15 -25.737 -3.277 -1.424 1.00 17.64 H new ATOM 0 HG13 VAL A 15 -26.266 -3.917 -2.773 1.00 17.64 H new ATOM 0 HG21 VAL A 15 -23.863 -3.300 -4.396 1.00 17.76 H new ATOM 0 HG22 VAL A 15 -25.318 -3.055 -4.973 1.00 17.76 H new ATOM 0 HG23 VAL A 15 -24.272 -1.867 -4.931 1.00 17.76 H new ATOM 103 N PHE A 16 -24.819 0.711 -3.189 1.00 16.55 N ANISOU 103 N PHE A 16 2611 2103 1574 5 81 -368 N ATOM 104 CA PHE A 16 -24.282 1.932 -3.782 1.00 15.46 C ANISOU 104 CA PHE A 16 2424 1940 1508 0 39 -396 C ATOM 105 C PHE A 16 -22.783 1.786 -4.013 1.00 16.37 C ANISOU 105 C PHE A 16 2506 2083 1632 -34 -117 -375 C ATOM 106 O PHE A 16 -22.055 1.363 -3.122 1.00 16.99 O ANISOU 106 O PHE A 16 2668 2167 1619 -70 -211 -377 O ATOM 107 CB PHE A 16 -24.591 3.138 -2.900 1.00 18.33 C ANISOU 107 CB PHE A 16 2913 2232 1820 -20 107 -473 C ATOM 108 CG PHE A 16 -26.039 3.483 -2.960 1.00 19.45 C ANISOU 108 CG PHE A 16 3036 2334 2022 27 278 -489 C ATOM 109 CD1 PHE A 16 -26.984 2.771 -2.234 1.00 20.32 C ANISOU 109 CD1 PHE A 16 3205 2437 2079 38 397 -489 C ATOM 110 CD2 PHE A 16 -26.466 4.431 -3.848 1.00 19.60 C ANISOU 110 CD2 PHE A 16 2956 2317 2173 64 319 -490 C ATOM 111 CE1 PHE A 16 -28.319 3.066 -2.333 1.00 20.97 C ANISOU 111 CE1 PHE A 16 3235 2475 2258 83 559 -499 C ATOM 112 CE2 PHE A 16 -27.825 4.729 -3.947 1.00 19.77 C ANISOU 112 CE2 PHE A 16 2930 2294 2286 115 463 -495 C ATOM 113 CZ PHE A 16 -28.730 4.038 -3.206 1.00 21.05 C ANISOU 113 CZ PHE A 16 3132 2450 2415 124 582 -500 C ATOM 0 H PHE A 16 -24.473 0.493 -2.433 1.00 16.55 H new ATOM 0 HA PHE A 16 -24.708 2.078 -4.641 1.00 15.46 H new ATOM 0 HB2 PHE A 16 -24.338 2.946 -1.983 1.00 18.33 H new ATOM 0 HB3 PHE A 16 -24.061 3.898 -3.188 1.00 18.33 H new ATOM 0 HD1 PHE A 16 -26.707 2.084 -1.672 1.00 20.32 H new ATOM 0 HD2 PHE A 16 -25.851 4.876 -4.385 1.00 19.60 H new ATOM 0 HE1 PHE A 16 -28.940 2.610 -1.812 1.00 20.97 H new ATOM 0 HE2 PHE A 16 -28.112 5.402 -4.521 1.00 19.77 H new ATOM 0 HZ PHE A 16 -29.637 4.227 -3.292 1.00 21.05 H new ATOM 123 N SER A 17 -22.365 2.149 -5.213 1.00 16.43 N ANISOU 123 N SER A 17 2392 2098 1754 -21 -140 -351 N ATOM 124 CA SER A 17 -20.955 2.141 -5.547 1.00 16.51 C ANISOU 124 CA SER A 17 2341 2119 1813 -51 -257 -332 C ATOM 125 C SER A 17 -20.275 3.316 -4.879 1.00 16.54 C ANISOU 125 C SER A 17 2410 2071 1804 -105 -316 -390 C ATOM 126 O SER A 17 -20.914 4.250 -4.374 1.00 16.44 O ANISOU 126 O SER A 17 2487 2008 1752 -113 -252 -447 O ATOM 127 CB SER A 17 -20.793 2.176 -7.064 1.00 17.26 C ANISOU 127 CB SER A 17 2308 2226 2022 -23 -228 -290 C ATOM 128 OG SER A 17 -19.487 1.744 -7.411 1.00 17.37 O ANISOU 128 OG SER A 17 2249 2255 2097 -42 -310 -259 O ATOM 0 H SER A 17 -22.884 2.404 -5.850 1.00 16.43 H new ATOM 0 HA SER A 17 -20.534 1.330 -5.222 1.00 16.51 H new ATOM 0 HB2 SER A 17 -21.455 1.604 -7.483 1.00 17.26 H new ATOM 0 HB3 SER A 17 -20.945 3.075 -7.394 1.00 17.26 H new ATOM 0 HG SER A 17 -19.513 1.331 -8.142 1.00 17.37 H new ATOM 134 N ARG A 18 -18.933 3.321 -4.914 1.00 15.02 N ANISOU 134 N ARG A 18 2161 1878 1667 -146 -439 -378 N ATOM 135 CA ARG A 18 -18.169 4.387 -4.289 1.00 17.20 C ANISOU 135 CA ARG A 18 2488 2101 1948 -213 -524 -434 C ATOM 136 C ARG A 18 -18.581 5.763 -4.770 1.00 17.18 C ANISOU 136 C ARG A 18 2488 2036 2002 -217 -432 -476 C ATOM 137 O ARG A 18 -18.634 6.718 -3.960 1.00 18.63 O ANISOU 137 O ARG A 18 2786 2158 2133 -261 -443 -548 O ATOM 138 CB ARG A 18 -16.670 4.162 -4.563 1.00 17.89 C ANISOU 138 CB ARG A 18 2453 2193 2151 -250 -659 -401 C ATOM 139 CG ARG A 18 -15.764 5.243 -4.094 1.00 20.75 C ANISOU 139 CG ARG A 18 2828 2495 2562 -330 -763 -453 C ATOM 140 CD ARG A 18 -14.341 4.980 -4.473 1.00 23.02 C ANISOU 140 CD ARG A 18 2955 2783 3010 -361 -878 -411 C ATOM 141 NE ARG A 18 -13.435 6.076 -4.121 1.00 23.77 N ANISOU 141 NE ARG A 18 3035 2810 3188 -449 -983 -461 N ATOM 142 CZ ARG A 18 -12.895 6.258 -2.931 1.00 27.26 C ANISOU 142 CZ ARG A 18 3564 3227 3569 -520 -1162 -505 C ATOM 143 NH1 ARG A 18 -13.157 5.430 -1.941 1.00 28.25 N ANISOU 143 NH1 ARG A 18 3813 3387 3534 -509 -1253 -500 N ATOM 144 NH2 ARG A 18 -12.061 7.284 -2.730 1.00 30.72 N ANISOU 144 NH2 ARG A 18 3972 3595 4106 -608 -1260 -554 N ATOM 0 H ARG A 18 -18.457 2.715 -5.295 1.00 15.02 H new ATOM 0 HA ARG A 18 -18.349 4.358 -3.336 1.00 17.20 H new ATOM 0 HB2 ARG A 18 -16.401 3.331 -4.141 1.00 17.89 H new ATOM 0 HB3 ARG A 18 -16.545 4.049 -5.518 1.00 17.89 H new ATOM 0 HG2 ARG A 18 -16.048 6.090 -4.472 1.00 20.75 H new ATOM 0 HG3 ARG A 18 -15.832 5.326 -3.130 1.00 20.75 H new ATOM 0 HD2 ARG A 18 -14.041 4.168 -4.035 1.00 23.02 H new ATOM 0 HD3 ARG A 18 -14.291 4.822 -5.429 1.00 23.02 H new ATOM 0 HE ARG A 18 -13.240 6.644 -4.737 1.00 23.77 H new ATOM 0 HH11 ARG A 18 -13.685 4.763 -2.067 1.00 28.25 H new ATOM 0 HH12 ARG A 18 -12.800 5.557 -1.169 1.00 28.25 H new ATOM 0 HH21 ARG A 18 -11.878 7.822 -3.375 1.00 30.72 H new ATOM 0 HH22 ARG A 18 -11.707 7.405 -1.956 1.00 30.72 H new ATOM 158 N ASP A 19 -18.895 5.905 -6.072 1.00 16.00 N ANISOU 158 N ASP A 19 2236 1893 1951 -172 -341 -431 N ATOM 159 CA ASP A 19 -19.222 7.219 -6.608 1.00 17.44 C ANISOU 159 CA ASP A 19 2420 2008 2199 -171 -264 -454 C ATOM 160 C ASP A 19 -20.715 7.549 -6.502 1.00 17.56 C ANISOU 160 C ASP A 19 2501 1999 2171 -115 -144 -473 C ATOM 161 O ASP A 19 -21.173 8.553 -7.088 1.00 19.17 O ANISOU 161 O ASP A 19 2695 2144 2444 -93 -72 -474 O ATOM 162 CB ASP A 19 -18.769 7.345 -8.064 1.00 18.57 C ANISOU 162 CB ASP A 19 2442 2151 2461 -155 -231 -390 C ATOM 163 CG ASP A 19 -19.601 6.544 -9.037 1.00 18.64 C ANISOU 163 CG ASP A 19 2407 2212 2462 -85 -162 -329 C ATOM 164 OD1 ASP A 19 -20.535 5.786 -8.629 1.00 17.71 O ANISOU 164 OD1 ASP A 19 2324 2135 2270 -47 -141 -330 O ATOM 165 OD2 ASP A 19 -19.333 6.696 -10.269 1.00 20.77 O ANISOU 165 OD2 ASP A 19 2616 2475 2802 -72 -125 -278 O ATOM 0 H ASP A 19 -18.921 5.262 -6.642 1.00 16.00 H new ATOM 0 HA ASP A 19 -18.741 7.861 -6.062 1.00 17.44 H new ATOM 0 HB2 ASP A 19 -18.797 8.280 -8.322 1.00 18.57 H new ATOM 0 HB3 ASP A 19 -17.844 7.059 -8.131 1.00 18.57 H new ATOM 170 N GLY A 20 -21.445 6.792 -5.712 1.00 15.64 N ANISOU 170 N GLY A 20 2325 1789 1830 -94 -118 -486 N ATOM 171 CA GLY A 20 -22.861 7.068 -5.492 1.00 15.63 C ANISOU 171 CA GLY A 20 2369 1756 1813 -44 10 -507 C ATOM 172 C GLY A 20 -23.813 6.401 -6.445 1.00 16.50 C ANISOU 172 C GLY A 20 2379 1908 1980 24 70 -442 C ATOM 173 O GLY A 20 -25.027 6.535 -6.267 1.00 18.05 O ANISOU 173 O GLY A 20 2584 2078 2195 68 171 -452 O ATOM 0 H GLY A 20 -21.144 6.107 -5.288 1.00 15.64 H new ATOM 0 HA2 GLY A 20 -23.090 6.796 -4.589 1.00 15.63 H new ATOM 0 HA3 GLY A 20 -22.998 8.027 -5.543 1.00 15.63 H new ATOM 177 N THR A 21 -23.322 5.721 -7.444 1.00 14.89 N ANISOU 177 N THR A 21 2083 1761 1816 30 13 -379 N ATOM 178 CA THR A 21 -24.198 5.083 -8.420 1.00 16.55 C ANISOU 178 CA THR A 21 2212 2005 2069 83 47 -322 C ATOM 179 C THR A 21 -24.931 3.932 -7.747 1.00 15.97 C ANISOU 179 C THR A 21 2157 1973 1939 96 77 -323 C ATOM 180 O THR A 21 -24.282 3.061 -7.172 1.00 15.29 O ANISOU 180 O THR A 21 2104 1925 1780 67 26 -322 O ATOM 181 CB THR A 21 -23.394 4.587 -9.618 1.00 16.15 C ANISOU 181 CB THR A 21 2092 1994 2050 79 -11 -266 C ATOM 182 OG1 THR A 21 -22.705 5.666 -10.235 1.00 16.80 O ANISOU 182 OG1 THR A 21 2164 2029 2189 62 -18 -260 O ATOM 183 CG2 THR A 21 -24.328 3.988 -10.644 1.00 15.82 C ANISOU 183 CG2 THR A 21 1995 1979 2035 124 7 -215 C ATOM 0 H THR A 21 -22.481 5.609 -7.587 1.00 14.89 H new ATOM 0 HA THR A 21 -24.845 5.728 -8.747 1.00 16.55 H new ATOM 0 HB THR A 21 -22.759 3.925 -9.303 1.00 16.15 H new ATOM 0 HG1 THR A 21 -21.983 5.806 -9.830 1.00 16.80 H new ATOM 0 HG21 THR A 21 -23.815 3.673 -11.405 1.00 15.82 H new ATOM 0 HG22 THR A 21 -24.809 3.244 -10.249 1.00 15.82 H new ATOM 0 HG23 THR A 21 -24.961 4.662 -10.938 1.00 15.82 H new ATOM 191 N PRO A 22 -26.261 3.872 -7.820 1.00 14.43 N ANISOU 191 N PRO A 22 1931 1763 1787 138 157 -316 N ATOM 192 CA PRO A 22 -26.974 2.689 -7.301 1.00 14.87 C ANISOU 192 CA PRO A 22 1988 1852 1809 143 198 -308 C ATOM 193 C PRO A 22 -26.816 1.497 -8.220 1.00 14.38 C ANISOU 193 C PRO A 22 1854 1851 1758 146 134 -253 C ATOM 194 O PRO A 22 -26.953 1.621 -9.441 1.00 14.19 O ANISOU 194 O PRO A 22 1761 1834 1798 166 98 -217 O ATOM 195 CB PRO A 22 -28.434 3.134 -7.249 1.00 16.58 C ANISOU 195 CB PRO A 22 2162 2022 2118 187 308 -315 C ATOM 196 CG PRO A 22 -28.544 4.207 -8.307 1.00 18.12 C ANISOU 196 CG PRO A 22 2291 2179 2413 220 278 -293 C ATOM 197 CD PRO A 22 -27.200 4.905 -8.336 1.00 16.44 C ANISOU 197 CD PRO A 22 2141 1959 2147 184 216 -312 C ATOM 0 HA PRO A 22 -26.631 2.404 -6.439 1.00 14.87 H new ATOM 0 HB2 PRO A 22 -29.035 2.395 -7.433 1.00 16.58 H new ATOM 0 HB3 PRO A 22 -28.667 3.478 -6.372 1.00 16.58 H new ATOM 0 HG2 PRO A 22 -28.754 3.821 -9.172 1.00 18.12 H new ATOM 0 HG3 PRO A 22 -29.255 4.832 -8.095 1.00 18.12 H new ATOM 0 HD2 PRO A 22 -26.963 5.187 -9.233 1.00 16.44 H new ATOM 0 HD3 PRO A 22 -27.198 5.699 -7.779 1.00 16.44 H new ATOM 205 N ILE A 23 -26.522 0.343 -7.629 1.00 15.54 N ANISOU 205 N ILE A 23 2037 2034 1834 124 120 -246 N ATOM 206 CA ILE A 23 -26.292 -0.904 -8.345 1.00 14.50 C ANISOU 206 CA ILE A 23 1856 1947 1706 123 69 -203 C ATOM 207 C ILE A 23 -27.382 -1.882 -7.891 1.00 15.16 C ANISOU 207 C ILE A 23 1934 2033 1793 126 135 -194 C ATOM 208 O ILE A 23 -27.532 -2.149 -6.692 1.00 16.72 O ANISOU 208 O ILE A 23 2211 2218 1925 112 190 -211 O ATOM 209 CB ILE A 23 -24.904 -1.451 -8.066 1.00 14.51 C ANISOU 209 CB ILE A 23 1893 1973 1648 98 -7 -194 C ATOM 210 CG1 ILE A 23 -23.819 -0.489 -8.569 1.00 16.68 C ANISOU 210 CG1 ILE A 23 2150 2236 1951 88 -60 -201 C ATOM 211 CG2 ILE A 23 -24.720 -2.864 -8.673 1.00 14.34 C ANISOU 211 CG2 ILE A 23 1833 1983 1634 103 -34 -154 C ATOM 212 CD1 ILE A 23 -23.914 -0.160 -10.042 1.00 16.87 C ANISOU 212 CD1 ILE A 23 2109 2260 2043 107 -57 -175 C ATOM 0 H ILE A 23 -26.449 0.263 -6.776 1.00 15.54 H new ATOM 0 HA ILE A 23 -26.337 -0.764 -9.304 1.00 14.50 H new ATOM 0 HB ILE A 23 -24.809 -1.531 -7.104 1.00 14.51 H new ATOM 0 HG12 ILE A 23 -23.871 0.335 -8.060 1.00 16.68 H new ATOM 0 HG13 ILE A 23 -22.949 -0.878 -8.391 1.00 16.68 H new ATOM 0 HG21 ILE A 23 -23.826 -3.186 -8.479 1.00 14.34 H new ATOM 0 HG22 ILE A 23 -25.372 -3.470 -8.287 1.00 14.34 H new ATOM 0 HG23 ILE A 23 -24.847 -2.823 -9.634 1.00 14.34 H new ATOM 0 HD11 ILE A 23 -23.199 0.449 -10.284 1.00 16.87 H new ATOM 0 HD12 ILE A 23 -23.833 -0.975 -10.562 1.00 16.87 H new ATOM 0 HD13 ILE A 23 -24.770 0.257 -10.226 1.00 16.87 H new ATOM 224 N ARG A 24 -28.146 -2.382 -8.840 1.00 15.12 N ANISOU 224 N ARG A 24 1845 2037 1863 140 130 -168 N ATOM 225 CA ARG A 24 -29.309 -3.201 -8.534 1.00 15.98 C ANISOU 225 CA ARG A 24 1918 2136 2016 136 196 -160 C ATOM 226 C ARG A 24 -29.041 -4.624 -9.044 1.00 15.08 C ANISOU 226 C ARG A 24 1794 2050 1886 118 145 -132 C ATOM 227 O ARG A 24 -28.320 -4.822 -10.010 1.00 17.03 O ANISOU 227 O ARG A 24 2031 2318 2123 118 68 -119 O ATOM 228 CB ARG A 24 -30.595 -2.658 -9.199 1.00 19.26 C ANISOU 228 CB ARG A 24 2228 2524 2565 161 218 -154 C ATOM 229 CG ARG A 24 -31.364 -1.583 -8.414 1.00 22.05 C ANISOU 229 CG ARG A 24 2575 2825 2977 186 327 -182 C ATOM 230 CD ARG A 24 -30.495 -0.382 -8.161 1.00 20.74 C ANISOU 230 CD ARG A 24 2486 2645 2750 195 316 -211 C ATOM 231 NE ARG A 24 -31.250 0.799 -7.617 1.00 18.38 N ANISOU 231 NE ARG A 24 2181 2280 2524 226 421 -243 N ATOM 232 CZ ARG A 24 -31.605 1.844 -8.332 1.00 19.40 C ANISOU 232 CZ ARG A 24 2244 2372 2755 265 401 -233 C ATOM 233 NH1 ARG A 24 -32.142 2.899 -7.699 1.00 20.32 N ANISOU 233 NH1 ARG A 24 2373 2416 2932 295 511 -269 N ATOM 234 NH2 ARG A 24 -31.349 1.893 -9.624 1.00 19.50 N ANISOU 234 NH2 ARG A 24 2203 2411 2797 273 279 -189 N ATOM 0 H ARG A 24 -28.010 -2.259 -9.680 1.00 15.12 H new ATOM 0 HA ARG A 24 -29.449 -3.188 -7.574 1.00 15.98 H new ATOM 0 HB2 ARG A 24 -30.359 -2.292 -10.066 1.00 19.26 H new ATOM 0 HB3 ARG A 24 -31.193 -3.404 -9.360 1.00 19.26 H new ATOM 0 HG2 ARG A 24 -32.154 -1.317 -8.910 1.00 22.05 H new ATOM 0 HG3 ARG A 24 -31.670 -1.950 -7.570 1.00 22.05 H new ATOM 0 HD2 ARG A 24 -29.794 -0.625 -7.536 1.00 20.74 H new ATOM 0 HD3 ARG A 24 -30.060 -0.126 -8.989 1.00 20.74 H new ATOM 0 HE ARG A 24 -31.464 0.791 -6.784 1.00 18.38 H new ATOM 0 HH11 ARG A 24 -32.247 2.881 -6.846 1.00 20.32 H new ATOM 0 HH12 ARG A 24 -32.381 3.593 -8.147 1.00 20.32 H new ATOM 0 HH21 ARG A 24 -30.946 1.237 -10.008 1.00 19.50 H new ATOM 0 HH22 ARG A 24 -31.585 2.581 -10.083 1.00 19.50 H new ATOM 248 N GLY A 25 -29.619 -5.592 -8.377 1.00 13.32 N ANISOU 248 N GLY A 25 1583 1817 1664 100 206 -124 N ATOM 249 CA GLY A 25 -29.384 -6.974 -8.770 1.00 14.84 C ANISOU 249 CA GLY A 25 1773 2019 1845 80 169 -100 C ATOM 250 C GLY A 25 -30.388 -7.887 -8.123 1.00 15.84 C ANISOU 250 C GLY A 25 1891 2117 2010 57 256 -89 C ATOM 251 O GLY A 25 -31.302 -7.454 -7.475 1.00 15.96 O ANISOU 251 O GLY A 25 1888 2105 2071 57 354 -100 O ATOM 0 H GLY A 25 -30.143 -5.484 -7.704 1.00 13.32 H new ATOM 0 HA2 GLY A 25 -29.441 -7.055 -9.735 1.00 14.84 H new ATOM 0 HA3 GLY A 25 -28.487 -7.240 -8.515 1.00 14.84 H new ATOM 255 N PHE A 26 -30.185 -9.203 -8.338 1.00 17.69 N ANISOU 255 N PHE A 26 2139 2348 2236 36 233 -68 N ATOM 256 CA PHE A 26 -30.978 -10.188 -7.633 1.00 17.90 C ANISOU 256 CA PHE A 26 2174 2337 2290 6 324 -50 C ATOM 257 C PHE A 26 -30.077 -11.186 -6.903 1.00 15.89 C ANISOU 257 C PHE A 26 2031 2072 1933 0 322 -18 C ATOM 258 O PHE A 26 -28.897 -11.369 -7.250 1.00 14.87 O ANISOU 258 O PHE A 26 1935 1963 1751 19 232 -9 O ATOM 259 CB PHE A 26 -31.972 -10.968 -8.583 1.00 18.32 C ANISOU 259 CB PHE A 26 2121 2368 2472 -26 306 -51 C ATOM 260 CG PHE A 26 -31.313 -11.887 -9.591 1.00 18.91 C ANISOU 260 CG PHE A 26 2210 2447 2527 -37 208 -50 C ATOM 261 CD1 PHE A 26 -30.836 -13.141 -9.220 1.00 20.93 C ANISOU 261 CD1 PHE A 26 2534 2676 2744 -52 228 -27 C ATOM 262 CD2 PHE A 26 -31.255 -11.543 -10.937 1.00 19.07 C ANISOU 262 CD2 PHE A 26 2186 2487 2573 -33 107 -70 C ATOM 263 CE1 PHE A 26 -30.267 -13.994 -10.158 1.00 22.56 C ANISOU 263 CE1 PHE A 26 2756 2870 2944 -58 160 -34 C ATOM 264 CE2 PHE A 26 -30.693 -12.393 -11.875 1.00 20.53 C ANISOU 264 CE2 PHE A 26 2406 2664 2731 -46 42 -79 C ATOM 265 CZ PHE A 26 -30.205 -13.637 -11.487 1.00 21.44 C ANISOU 265 CZ PHE A 26 2581 2747 2818 -58 76 -65 C ATOM 0 H PHE A 26 -29.601 -9.526 -8.880 1.00 17.69 H new ATOM 0 HA PHE A 26 -31.513 -9.698 -6.989 1.00 17.90 H new ATOM 0 HB2 PHE A 26 -32.576 -11.493 -8.035 1.00 18.32 H new ATOM 0 HB3 PHE A 26 -32.513 -10.321 -9.062 1.00 18.32 H new ATOM 0 HD1 PHE A 26 -30.899 -13.412 -8.332 1.00 20.93 H new ATOM 0 HD2 PHE A 26 -31.601 -10.725 -11.213 1.00 19.07 H new ATOM 0 HE1 PHE A 26 -29.924 -14.815 -9.886 1.00 22.56 H new ATOM 0 HE2 PHE A 26 -30.642 -12.132 -12.766 1.00 20.53 H new ATOM 0 HZ PHE A 26 -29.842 -14.219 -12.116 1.00 21.44 H new ATOM 275 N SER A 27 -30.653 -11.771 -5.864 1.00 16.38 N ANISOU 275 N SER A 27 2151 2095 1978 -23 429 5 N ATOM 276 CA SER A 27 -30.014 -12.824 -5.069 1.00 17.16 C ANISOU 276 CA SER A 27 2367 2168 1985 -30 434 51 C ATOM 277 C SER A 27 -30.863 -14.073 -5.178 1.00 17.97 C ANISOU 277 C SER A 27 2438 2219 2171 -68 505 74 C ATOM 278 O SER A 27 -32.042 -14.047 -4.827 1.00 20.75 O ANISOU 278 O SER A 27 2750 2537 2595 -99 626 69 O ATOM 279 CB SER A 27 -29.868 -12.371 -3.625 1.00 18.59 C ANISOU 279 CB SER A 27 2690 2336 2036 -29 501 65 C ATOM 280 OG SER A 27 -29.551 -13.451 -2.780 1.00 21.53 O ANISOU 280 OG SER A 27 3186 2670 2324 -41 521 123 O ATOM 0 H SER A 27 -31.443 -11.567 -5.591 1.00 16.38 H new ATOM 0 HA SER A 27 -29.123 -13.013 -5.401 1.00 17.16 H new ATOM 0 HB2 SER A 27 -29.174 -11.696 -3.564 1.00 18.59 H new ATOM 0 HB3 SER A 27 -30.694 -11.957 -3.329 1.00 18.59 H new ATOM 0 HG SER A 27 -29.609 -13.206 -1.979 1.00 21.53 H new ATOM 286 N ARG A 28 -30.248 -15.178 -5.645 1.00 17.23 N ANISOU 286 N ARG A 28 2358 2106 2081 -69 439 98 N ATOM 287 CA ARG A 28 -30.923 -16.474 -5.713 1.00 20.08 C ANISOU 287 CA ARG A 28 2709 2404 2518 -111 500 121 C ATOM 288 C ARG A 28 -30.350 -17.316 -4.588 1.00 20.39 C ANISOU 288 C ARG A 28 2894 2398 2455 -105 535 188 C ATOM 289 O ARG A 28 -29.224 -17.808 -4.711 1.00 20.09 O ANISOU 289 O ARG A 28 2906 2358 2370 -70 442 216 O ATOM 290 CB ARG A 28 -30.689 -17.144 -7.070 1.00 22.37 C ANISOU 290 CB ARG A 28 2931 2687 2883 -118 409 95 C ATOM 291 CG ARG A 28 -31.691 -18.237 -7.427 1.00 27.22 C ANISOU 291 CG ARG A 28 3496 3234 3613 -179 458 91 C ATOM 292 CD ARG A 28 -31.509 -19.524 -6.607 1.00 32.95 C ANISOU 292 CD ARG A 28 4322 3883 4314 -194 528 150 C ATOM 293 NE ARG A 28 -30.161 -20.084 -6.715 1.00 38.29 N ANISOU 293 NE ARG A 28 5080 4550 4919 -145 452 177 N ATOM 294 CZ ARG A 28 -29.719 -20.804 -7.739 1.00 42.32 C ANISOU 294 CZ ARG A 28 5572 5030 5476 -142 392 151 C ATOM 295 NH1 ARG A 28 -30.506 -21.044 -8.774 1.00 44.14 N ANISOU 295 NH1 ARG A 28 5727 5244 5801 -193 377 94 N ATOM 296 NH2 ARG A 28 -28.480 -21.282 -7.732 1.00 41.81 N ANISOU 296 NH2 ARG A 28 5570 4946 5370 -87 344 182 N ATOM 0 H ARG A 28 -29.436 -15.189 -5.927 1.00 17.23 H new ATOM 0 HA ARG A 28 -31.883 -16.371 -5.618 1.00 20.08 H new ATOM 0 HB2 ARG A 28 -30.713 -16.463 -7.761 1.00 22.37 H new ATOM 0 HB3 ARG A 28 -29.797 -17.525 -7.078 1.00 22.37 H new ATOM 0 HG2 ARG A 28 -32.590 -17.899 -7.291 1.00 27.22 H new ATOM 0 HG3 ARG A 28 -31.607 -18.448 -8.370 1.00 27.22 H new ATOM 0 HD2 ARG A 28 -31.703 -19.338 -5.675 1.00 32.95 H new ATOM 0 HD3 ARG A 28 -32.153 -20.185 -6.904 1.00 32.95 H new ATOM 0 HE ARG A 28 -29.615 -19.936 -6.067 1.00 38.29 H new ATOM 0 HH11 ARG A 28 -31.308 -20.733 -8.786 1.00 44.14 H new ATOM 0 HH12 ARG A 28 -30.216 -21.511 -9.436 1.00 44.14 H new ATOM 0 HH21 ARG A 28 -27.962 -21.125 -7.063 1.00 41.81 H new ATOM 0 HH22 ARG A 28 -28.195 -21.748 -8.396 1.00 41.81 H new ATOM 310 N PRO A 29 -31.061 -17.499 -3.484 1.00 25.43 N ANISOU 310 N PRO A 29 3609 2992 3059 -135 669 221 N ATOM 311 CA PRO A 29 -30.473 -18.181 -2.331 1.00 25.95 C ANISOU 311 CA PRO A 29 3850 3014 2994 -127 689 296 C ATOM 312 C PRO A 29 -30.097 -19.613 -2.639 1.00 23.32 C ANISOU 312 C PRO A 29 3535 2619 2705 -129 654 344 C ATOM 313 O PRO A 29 -30.691 -20.268 -3.494 1.00 24.59 O ANISOU 313 O PRO A 29 3595 2747 3000 -162 676 318 O ATOM 314 CB PRO A 29 -31.581 -18.126 -1.264 1.00 32.64 C ANISOU 314 CB PRO A 29 4772 3814 3817 -171 882 315 C ATOM 315 CG PRO A 29 -32.496 -17.040 -1.702 1.00 37.27 C ANISOU 315 CG PRO A 29 5220 4436 4506 -182 944 243 C ATOM 316 CD PRO A 29 -32.441 -17.039 -3.211 1.00 32.54 C ANISOU 316 CD PRO A 29 4445 3875 4043 -175 817 196 C ATOM 0 HA PRO A 29 -29.646 -17.760 -2.048 1.00 25.95 H new ATOM 0 HB2 PRO A 29 -32.049 -18.973 -1.202 1.00 32.64 H new ATOM 0 HB3 PRO A 29 -31.212 -17.940 -0.386 1.00 32.64 H new ATOM 0 HG2 PRO A 29 -33.400 -17.198 -1.387 1.00 37.27 H new ATOM 0 HG3 PRO A 29 -32.216 -16.183 -1.343 1.00 37.27 H new ATOM 0 HD2 PRO A 29 -33.103 -17.634 -3.596 1.00 32.54 H new ATOM 0 HD3 PRO A 29 -32.606 -16.156 -3.577 1.00 32.54 H new ATOM 324 N GLY A 30 -29.093 -20.098 -1.917 1.00 22.27 N ANISOU 324 N GLY A 30 3538 2462 2461 -93 590 414 N ATOM 325 CA GLY A 30 -28.686 -21.486 -1.989 1.00 21.63 C ANISOU 325 CA GLY A 30 3500 2302 2415 -85 569 475 C ATOM 326 C GLY A 30 -27.773 -21.807 -0.830 1.00 24.08 C ANISOU 326 C GLY A 30 3986 2582 2580 -47 507 571 C ATOM 327 O GLY A 30 -27.193 -20.905 -0.202 1.00 25.72 O ANISOU 327 O GLY A 30 4264 2843 2664 -22 432 576 O ATOM 0 H GLY A 30 -28.629 -19.624 -1.370 1.00 22.27 H new ATOM 0 HA2 GLY A 30 -29.466 -22.063 -1.968 1.00 21.63 H new ATOM 0 HA3 GLY A 30 -28.230 -21.656 -2.828 1.00 21.63 H new ATOM 331 N PRO A 31 -27.632 -23.098 -0.521 1.00 28.15 N ANISOU 331 N PRO A 31 4583 3002 3109 -45 526 651 N ATOM 332 CA PRO A 31 -26.792 -23.500 0.617 1.00 28.78 C ANISOU 332 CA PRO A 31 4845 3039 3049 -7 449 761 C ATOM 333 C PRO A 31 -25.310 -23.570 0.290 1.00 27.85 C ANISOU 333 C PRO A 31 4686 2938 2958 73 250 789 C ATOM 334 O PRO A 31 -24.501 -23.807 1.199 1.00 29.14 O ANISOU 334 O PRO A 31 4982 3070 3019 112 141 883 O ATOM 335 CB PRO A 31 -27.339 -24.891 0.959 1.00 30.01 C ANISOU 335 CB PRO A 31 5089 3073 3240 -37 563 838 C ATOM 336 CG PRO A 31 -27.786 -25.432 -0.358 1.00 29.83 C ANISOU 336 CG PRO A 31 4891 3027 3414 -60 607 766 C ATOM 337 CD PRO A 31 -28.326 -24.240 -1.140 1.00 29.92 C ANISOU 337 CD PRO A 31 4750 3144 3474 -85 619 647 C ATOM 0 HA PRO A 31 -26.837 -22.857 1.342 1.00 28.78 H new ATOM 0 HB2 PRO A 31 -26.658 -25.452 1.362 1.00 30.01 H new ATOM 0 HB3 PRO A 31 -28.074 -24.839 1.590 1.00 30.01 H new ATOM 0 HG2 PRO A 31 -27.049 -25.852 -0.829 1.00 29.83 H new ATOM 0 HG3 PRO A 31 -28.470 -26.109 -0.241 1.00 29.83 H new ATOM 0 HD2 PRO A 31 -28.127 -24.311 -2.087 1.00 29.92 H new ATOM 0 HD3 PRO A 31 -29.289 -24.163 -1.058 1.00 29.92 H new ATOM 345 N GLY A 32 -24.933 -23.370 -0.959 1.00 25.92 N ANISOU 345 N GLY A 32 4267 2733 2850 99 202 714 N ATOM 346 CA GLY A 32 -23.594 -23.651 -1.419 1.00 26.34 C ANISOU 346 CA GLY A 32 4254 2774 2980 174 59 739 C ATOM 347 C GLY A 32 -22.717 -22.428 -1.421 1.00 26.80 C ANISOU 347 C GLY A 32 4257 2925 3002 206 -72 708 C ATOM 348 O GLY A 32 -22.908 -21.503 -0.625 1.00 27.64 O ANISOU 348 O GLY A 32 4444 3086 2973 180 -93 703 O ATOM 0 H GLY A 32 -25.456 -23.063 -1.569 1.00 25.92 H new ATOM 0 HA2 GLY A 32 -23.196 -24.330 -0.852 1.00 26.34 H new ATOM 0 HA3 GLY A 32 -23.634 -24.018 -2.316 1.00 26.34 H new ATOM 352 N GLU A 33 -21.750 -22.419 -2.335 1.00 26.08 N ANISOU 352 N GLU A 33 4030 2841 3038 260 -149 683 N ATOM 353 CA GLU A 33 -20.842 -21.293 -2.483 1.00 26.91 C ANISOU 353 CA GLU A 33 4055 3023 3148 286 -266 652 C ATOM 354 C GLU A 33 -21.595 -20.063 -2.961 1.00 22.53 C ANISOU 354 C GLU A 33 3449 2558 2554 235 -199 549 C ATOM 355 O GLU A 33 -22.618 -20.172 -3.640 1.00 21.97 O ANISOU 355 O GLU A 33 3343 2490 2514 195 -77 490 O ATOM 356 CB GLU A 33 -19.748 -21.641 -3.493 1.00 32.41 C ANISOU 356 CB GLU A 33 4606 3692 4018 351 -312 644 C ATOM 357 CG GLU A 33 -18.832 -22.770 -3.046 1.00 36.94 C ANISOU 357 CG GLU A 33 5200 4166 4668 420 -395 751 C ATOM 358 CD GLU A 33 -17.947 -22.326 -1.915 1.00 40.13 C ANISOU 358 CD GLU A 33 5653 4586 5007 446 -582 833 C ATOM 359 OE1 GLU A 33 -18.369 -22.454 -0.756 1.00 42.04 O ANISOU 359 OE1 GLU A 33 6065 4817 5092 419 -617 898 O ATOM 360 OE2 GLU A 33 -16.837 -21.815 -2.192 1.00 39.64 O ANISOU 360 OE2 GLU A 33 5466 4546 5050 488 -693 830 O ATOM 0 H GLU A 33 -21.605 -23.065 -2.884 1.00 26.08 H new ATOM 0 HA GLU A 33 -20.442 -21.103 -1.620 1.00 26.91 H new ATOM 0 HB2 GLU A 33 -20.163 -21.887 -4.334 1.00 32.41 H new ATOM 0 HB3 GLU A 33 -19.213 -20.850 -3.662 1.00 32.41 H new ATOM 0 HG2 GLU A 33 -19.364 -23.531 -2.766 1.00 36.94 H new ATOM 0 HG3 GLU A 33 -18.287 -23.064 -3.792 1.00 36.94 H new ATOM 367 N THR A 34 -21.085 -18.870 -2.592 1.00 20.22 N ANISOU 367 N THR A 34 3150 2332 2200 234 -292 529 N ATOM 368 CA THR A 34 -21.638 -17.622 -3.083 1.00 19.35 C ANISOU 368 CA THR A 34 2983 2298 2071 198 -241 437 C ATOM 369 C THR A 34 -20.911 -17.220 -4.349 1.00 19.12 C ANISOU 369 C THR A 34 2798 2295 2171 227 -267 386 C ATOM 370 O THR A 34 -19.674 -17.008 -4.332 1.00 20.33 O ANISOU 370 O THR A 34 2894 2449 2381 266 -379 411 O ATOM 371 CB THR A 34 -21.556 -16.523 -2.026 1.00 23.28 C ANISOU 371 CB THR A 34 3576 2838 2430 174 -305 433 C ATOM 372 OG1 THR A 34 -22.039 -17.042 -0.780 1.00 26.04 O ANISOU 372 OG1 THR A 34 4104 3146 2642 152 -280 495 O ATOM 373 CG2 THR A 34 -22.364 -15.306 -2.449 1.00 25.50 C ANISOU 373 CG2 THR A 34 3814 3179 2696 137 -221 342 C ATOM 0 H THR A 34 -20.418 -18.777 -2.057 1.00 20.22 H new ATOM 0 HA THR A 34 -22.578 -17.750 -3.283 1.00 19.35 H new ATOM 0 HB THR A 34 -20.633 -16.241 -1.925 1.00 23.28 H new ATOM 0 HG1 THR A 34 -22.381 -16.420 -0.331 1.00 26.04 H new ATOM 0 HG21 THR A 34 -22.299 -14.621 -1.766 1.00 25.50 H new ATOM 0 HG22 THR A 34 -22.016 -14.961 -3.286 1.00 25.50 H new ATOM 0 HG23 THR A 34 -23.293 -15.559 -2.566 1.00 25.50 H new ATOM 381 N VAL A 35 -21.671 -17.105 -5.443 1.00 18.41 N ANISOU 381 N VAL A 35 2641 2221 2131 205 -167 317 N ATOM 382 CA VAL A 35 -21.156 -16.817 -6.775 1.00 18.86 C ANISOU 382 CA VAL A 35 2584 2293 2289 225 -159 266 C ATOM 383 C VAL A 35 -21.718 -15.492 -7.244 1.00 17.18 C ANISOU 383 C VAL A 35 2336 2148 2044 192 -134 198 C ATOM 384 O VAL A 35 -22.930 -15.274 -7.172 1.00 19.20 O ANISOU 384 O VAL A 35 2620 2420 2256 152 -70 170 O ATOM 385 CB VAL A 35 -21.535 -17.938 -7.770 1.00 23.45 C ANISOU 385 CB VAL A 35 3148 2819 2945 225 -76 246 C ATOM 386 CG1 VAL A 35 -20.904 -17.669 -9.113 1.00 28.91 C ANISOU 386 CG1 VAL A 35 3756 3514 3716 246 -56 195 C ATOM 387 CG2 VAL A 35 -21.121 -19.279 -7.212 1.00 23.48 C ANISOU 387 CG2 VAL A 35 3198 2740 2984 258 -87 319 C ATOM 0 H VAL A 35 -22.526 -17.196 -5.424 1.00 18.41 H new ATOM 0 HA VAL A 35 -20.188 -16.770 -6.736 1.00 18.86 H new ATOM 0 HB VAL A 35 -22.497 -17.954 -7.896 1.00 23.45 H new ATOM 0 HG11 VAL A 35 -21.146 -18.376 -9.732 1.00 28.91 H new ATOM 0 HG12 VAL A 35 -21.220 -16.818 -9.455 1.00 28.91 H new ATOM 0 HG13 VAL A 35 -19.939 -17.640 -9.017 1.00 28.91 H new ATOM 0 HG21 VAL A 35 -21.361 -19.979 -7.839 1.00 23.48 H new ATOM 0 HG22 VAL A 35 -20.162 -19.288 -7.069 1.00 23.48 H new ATOM 0 HG23 VAL A 35 -21.574 -19.433 -6.368 1.00 23.48 H new ATOM 397 N VAL A 36 -20.839 -14.603 -7.741 1.00 15.39 N ANISOU 397 N VAL A 36 2039 1952 1858 209 -179 175 N ATOM 398 CA VAL A 36 -21.198 -13.284 -8.186 1.00 14.80 C ANISOU 398 CA VAL A 36 1934 1930 1761 185 -165 121 C ATOM 399 C VAL A 36 -20.955 -13.204 -9.699 1.00 15.58 C ANISOU 399 C VAL A 36 1964 2024 1930 195 -120 82 C ATOM 400 O VAL A 36 -19.832 -13.433 -10.163 1.00 16.15 O ANISOU 400 O VAL A 36 1986 2072 2080 227 -129 94 O ATOM 401 CB VAL A 36 -20.392 -12.205 -7.457 1.00 18.54 C ANISOU 401 CB VAL A 36 2403 2431 2211 186 -251 127 C ATOM 402 CG1 VAL A 36 -20.810 -10.800 -7.932 1.00 18.92 C ANISOU 402 CG1 VAL A 36 2425 2520 2242 162 -225 71 C ATOM 403 CG2 VAL A 36 -20.545 -12.376 -5.943 1.00 22.28 C ANISOU 403 CG2 VAL A 36 2983 2898 2585 173 -304 166 C ATOM 0 H VAL A 36 -20.000 -14.774 -7.823 1.00 15.39 H new ATOM 0 HA VAL A 36 -22.133 -13.123 -7.985 1.00 14.80 H new ATOM 0 HB VAL A 36 -19.451 -12.305 -7.671 1.00 18.54 H new ATOM 0 HG11 VAL A 36 -20.290 -10.131 -7.460 1.00 18.92 H new ATOM 0 HG12 VAL A 36 -20.651 -10.720 -8.885 1.00 18.92 H new ATOM 0 HG13 VAL A 36 -21.753 -10.664 -7.750 1.00 18.92 H new ATOM 0 HG21 VAL A 36 -20.033 -11.690 -5.486 1.00 22.28 H new ATOM 0 HG22 VAL A 36 -21.481 -12.295 -5.701 1.00 22.28 H new ATOM 0 HG23 VAL A 36 -20.218 -13.251 -5.681 1.00 22.28 H new ATOM 413 N LEU A 37 -22.006 -12.903 -10.457 1.00 15.19 N ANISOU 413 N LEU A 37 1919 1992 1859 166 -71 39 N ATOM 414 CA LEU A 37 -21.990 -12.943 -11.912 1.00 14.47 C ANISOU 414 CA LEU A 37 1809 1890 1797 165 -31 3 C ATOM 415 C LEU A 37 -21.929 -11.532 -12.484 1.00 15.06 C ANISOU 415 C LEU A 37 1859 2004 1860 158 -38 -23 C ATOM 416 O LEU A 37 -22.729 -10.689 -12.088 1.00 15.57 O ANISOU 416 O LEU A 37 1926 2101 1889 139 -54 -32 O ATOM 417 CB LEU A 37 -23.230 -13.695 -12.411 1.00 13.61 C ANISOU 417 CB LEU A 37 1733 1763 1674 132 0 -21 C ATOM 418 CG LEU A 37 -23.459 -15.048 -11.793 1.00 15.24 C ANISOU 418 CG LEU A 37 1972 1922 1898 130 18 6 C ATOM 419 CD1 LEU A 37 -24.712 -15.690 -12.380 1.00 15.31 C ANISOU 419 CD1 LEU A 37 1998 1906 1912 83 42 -26 C ATOM 420 CD2 LEU A 37 -22.265 -15.954 -12.041 1.00 16.21 C ANISOU 420 CD2 LEU A 37 2096 1990 2074 171 34 25 C ATOM 0 H LEU A 37 -22.765 -12.665 -10.130 1.00 15.19 H new ATOM 0 HA LEU A 37 -21.198 -13.414 -12.216 1.00 14.47 H new ATOM 0 HB2 LEU A 37 -24.011 -13.145 -12.245 1.00 13.61 H new ATOM 0 HB3 LEU A 37 -23.158 -13.804 -13.372 1.00 13.61 H new ATOM 0 HG LEU A 37 -23.575 -14.930 -10.837 1.00 15.24 H new ATOM 0 HD11 LEU A 37 -24.850 -16.561 -11.975 1.00 15.31 H new ATOM 0 HD12 LEU A 37 -25.480 -15.125 -12.200 1.00 15.31 H new ATOM 0 HD13 LEU A 37 -24.604 -15.793 -13.338 1.00 15.31 H new ATOM 0 HD21 LEU A 37 -22.427 -16.821 -11.637 1.00 16.21 H new ATOM 0 HD22 LEU A 37 -22.133 -16.062 -12.996 1.00 16.21 H new ATOM 0 HD23 LEU A 37 -21.471 -15.558 -11.648 1.00 16.21 H new ATOM 432 N VAL A 38 -21.030 -11.308 -13.434 1.00 14.36 N ANISOU 432 N VAL A 38 1750 1900 1805 174 -11 -32 N ATOM 433 CA VAL A 38 -20.711 -9.999 -14.010 1.00 13.03 C ANISOU 433 CA VAL A 38 1564 1753 1635 168 -6 -46 C ATOM 434 C VAL A 38 -20.851 -10.071 -15.530 1.00 12.30 C ANISOU 434 C VAL A 38 1517 1639 1518 161 49 -71 C ATOM 435 O VAL A 38 -20.052 -10.696 -16.219 1.00 13.55 O ANISOU 435 O VAL A 38 1687 1755 1707 177 113 -77 O ATOM 436 CB VAL A 38 -19.300 -9.531 -13.629 1.00 15.95 C ANISOU 436 CB VAL A 38 1870 2114 2077 188 -16 -25 C ATOM 437 CG1 VAL A 38 -19.103 -8.075 -14.060 1.00 17.30 C ANISOU 437 CG1 VAL A 38 2025 2301 2247 172 -10 -36 C ATOM 438 CG2 VAL A 38 -19.067 -9.657 -12.144 1.00 18.18 C ANISOU 438 CG2 VAL A 38 2134 2408 2365 192 -95 3 C ATOM 0 H VAL A 38 -20.565 -11.943 -13.780 1.00 14.36 H new ATOM 0 HA VAL A 38 -21.334 -9.350 -13.649 1.00 13.03 H new ATOM 0 HB VAL A 38 -18.659 -10.097 -14.087 1.00 15.95 H new ATOM 0 HG11 VAL A 38 -18.210 -7.783 -13.817 1.00 17.30 H new ATOM 0 HG12 VAL A 38 -19.216 -8.004 -15.021 1.00 17.30 H new ATOM 0 HG13 VAL A 38 -19.758 -7.514 -13.615 1.00 17.30 H new ATOM 0 HG21 VAL A 38 -18.170 -9.356 -11.930 1.00 18.18 H new ATOM 0 HG22 VAL A 38 -19.713 -9.112 -11.668 1.00 18.18 H new ATOM 0 HG23 VAL A 38 -19.168 -10.584 -11.878 1.00 18.18 H new ATOM 448 N HIS A 39 -21.889 -9.411 -16.058 1.00 12.76 N ANISOU 448 N HIS A 39 1610 1719 1519 137 25 -86 N ATOM 449 CA HIS A 39 -22.189 -9.461 -17.493 1.00 12.95 C ANISOU 449 CA HIS A 39 1711 1722 1488 121 47 -107 C ATOM 450 C HIS A 39 -21.255 -8.529 -18.284 1.00 14.45 C ANISOU 450 C HIS A 39 1919 1898 1674 129 103 -100 C ATOM 451 O HIS A 39 -20.465 -7.771 -17.722 1.00 15.96 O ANISOU 451 O HIS A 39 2045 2098 1921 142 115 -82 O ATOM 452 CB HIS A 39 -23.666 -9.115 -17.713 1.00 14.11 C ANISOU 452 CB HIS A 39 1877 1891 1595 95 -27 -114 C ATOM 453 CG HIS A 39 -24.024 -7.691 -17.331 1.00 16.48 C ANISOU 453 CG HIS A 39 2134 2221 1905 101 -63 -96 C ATOM 454 ND1 HIS A 39 -23.667 -6.610 -18.087 1.00 17.31 N ANISOU 454 ND1 HIS A 39 2270 2321 1985 105 -54 -84 N ATOM 455 CD2 HIS A 39 -24.697 -7.199 -16.259 1.00 17.20 C ANISOU 455 CD2 HIS A 39 2166 2337 2032 104 -91 -88 C ATOM 456 CE1 HIS A 39 -24.076 -5.491 -17.488 1.00 17.19 C ANISOU 456 CE1 HIS A 39 2209 2324 2000 113 -84 -71 C ATOM 457 NE2 HIS A 39 -24.712 -5.827 -16.389 1.00 16.92 N ANISOU 457 NE2 HIS A 39 2122 2308 2000 114 -102 -78 N ATOM 0 H HIS A 39 -22.432 -8.927 -15.599 1.00 12.76 H new ATOM 0 HA HIS A 39 -22.031 -10.359 -17.825 1.00 12.95 H new ATOM 0 HB2 HIS A 39 -23.887 -9.256 -18.647 1.00 14.11 H new ATOM 0 HB3 HIS A 39 -24.213 -9.727 -17.197 1.00 14.11 H new ATOM 0 HD1 HIS A 39 -23.243 -6.646 -18.835 1.00 17.31 H new ATOM 0 HD2 HIS A 39 -25.076 -7.694 -15.569 1.00 17.20 H new ATOM 0 HE1 HIS A 39 -23.936 -4.624 -17.795 1.00 17.19 H new ATOM 465 N GLY A 40 -21.354 -8.605 -19.615 1.00 14.20 N ANISOU 465 N GLY A 40 1989 1836 1569 115 139 -116 N ATOM 466 CA GLY A 40 -20.566 -7.803 -20.511 1.00 15.85 C ANISOU 466 CA GLY A 40 2246 2019 1756 116 216 -106 C ATOM 467 C GLY A 40 -21.189 -6.458 -20.849 1.00 17.11 C ANISOU 467 C GLY A 40 2436 2199 1867 104 158 -82 C ATOM 468 O GLY A 40 -22.232 -6.090 -20.321 1.00 15.58 O ANISOU 468 O GLY A 40 2206 2041 1674 100 59 -75 O ATOM 0 H GLY A 40 -21.896 -9.139 -20.016 1.00 14.20 H new ATOM 0 HA2 GLY A 40 -19.693 -7.654 -20.114 1.00 15.85 H new ATOM 0 HA3 GLY A 40 -20.423 -8.298 -21.333 1.00 15.85 H new ATOM 472 N VAL A 41 -20.566 -5.775 -21.807 1.00 18.87 N ANISOU 472 N VAL A 41 2733 2387 2049 98 236 -68 N ATOM 473 CA VAL A 41 -20.866 -4.349 -22.026 1.00 22.33 C ANISOU 473 CA VAL A 41 3188 2830 2467 94 199 -32 C ATOM 474 C VAL A 41 -22.293 -4.166 -22.522 1.00 20.24 C ANISOU 474 C VAL A 41 2996 2579 2114 83 73 -22 C ATOM 475 O VAL A 41 -23.018 -3.256 -22.065 1.00 19.27 O ANISOU 475 O VAL A 41 2819 2476 2025 92 -9 2 O ATOM 476 CB VAL A 41 -19.859 -3.744 -23.029 1.00 29.57 C ANISOU 476 CB VAL A 41 4189 3693 3355 86 329 -11 C ATOM 477 CG1 VAL A 41 -20.296 -2.333 -23.434 1.00 33.82 C ANISOU 477 CG1 VAL A 41 4778 4221 3851 79 286 34 C ATOM 478 CG2 VAL A 41 -18.470 -3.702 -22.438 1.00 32.86 C ANISOU 478 CG2 VAL A 41 4486 4090 3909 95 438 -13 C ATOM 0 H VAL A 41 -19.975 -6.107 -22.336 1.00 18.87 H new ATOM 0 HA VAL A 41 -20.782 -3.882 -21.180 1.00 22.33 H new ATOM 0 HB VAL A 41 -19.841 -4.310 -23.817 1.00 29.57 H new ATOM 0 HG11 VAL A 41 -19.657 -1.964 -24.063 1.00 33.82 H new ATOM 0 HG12 VAL A 41 -21.172 -2.372 -23.849 1.00 33.82 H new ATOM 0 HG13 VAL A 41 -20.337 -1.768 -22.647 1.00 33.82 H new ATOM 0 HG21 VAL A 41 -17.855 -3.319 -23.083 1.00 32.86 H new ATOM 0 HG22 VAL A 41 -18.476 -3.157 -21.635 1.00 32.86 H new ATOM 0 HG23 VAL A 41 -18.186 -4.602 -22.215 1.00 32.86 H new ATOM 488 N ALA A 42 -22.681 -4.944 -23.520 1.00 19.65 N ANISOU 488 N ALA A 42 3049 2482 1932 63 56 -39 N ATOM 489 CA ALA A 42 -23.979 -4.805 -24.188 1.00 18.57 C ANISOU 489 CA ALA A 42 2993 2349 1713 45 -88 -26 C ATOM 490 C ALA A 42 -24.972 -5.837 -23.665 1.00 13.52 C ANISOU 490 C ALA A 42 2288 1736 1112 31 -186 -59 C ATOM 491 O ALA A 42 -25.763 -6.354 -24.426 1.00 16.16 O ANISOU 491 O ALA A 42 2714 2056 1371 0 -282 -72 O ATOM 492 CB ALA A 42 -23.798 -4.939 -25.701 1.00 23.04 C ANISOU 492 CB ALA A 42 3774 2864 2114 18 -63 -24 C ATOM 0 H ALA A 42 -22.195 -5.579 -23.838 1.00 19.65 H new ATOM 0 HA ALA A 42 -24.339 -3.926 -23.993 1.00 18.57 H new ATOM 0 HB1 ALA A 42 -24.658 -4.847 -26.139 1.00 23.04 H new ATOM 0 HB2 ALA A 42 -23.198 -4.246 -26.018 1.00 23.04 H new ATOM 0 HB3 ALA A 42 -23.423 -5.810 -25.906 1.00 23.04 H new ATOM 498 N MET A 43 -24.925 -6.111 -22.378 1.00 16.19 N ANISOU 498 N MET A 43 2480 2106 1566 49 -165 -71 N ATOM 499 CA MET A 43 -25.749 -7.087 -21.725 1.00 17.85 C ANISOU 499 CA MET A 43 2620 2333 1829 35 -223 -96 C ATOM 500 C MET A 43 -26.352 -6.512 -20.448 1.00 16.57 C ANISOU 500 C MET A 43 2313 2207 1776 56 -254 -79 C ATOM 501 O MET A 43 -26.048 -5.405 -20.030 1.00 16.70 O ANISOU 501 O MET A 43 2288 2233 1825 81 -230 -55 O ATOM 502 CB MET A 43 -24.918 -8.322 -21.368 1.00 18.57 C ANISOU 502 CB MET A 43 2711 2409 1937 35 -128 -131 C ATOM 503 CG MET A 43 -24.208 -8.899 -22.529 1.00 19.45 C ANISOU 503 CG MET A 43 2965 2472 1954 22 -56 -157 C ATOM 504 SD MET A 43 -23.421 -10.384 -21.891 1.00 20.87 S ANISOU 504 SD MET A 43 3106 2623 2202 35 46 -191 S ATOM 505 CE MET A 43 -22.364 -10.776 -23.292 1.00 28.46 C ANISOU 505 CE MET A 43 4234 3510 3069 32 184 -223 C ATOM 0 H MET A 43 -24.385 -5.712 -21.840 1.00 16.19 H new ATOM 0 HA MET A 43 -26.463 -7.335 -22.334 1.00 17.85 H new ATOM 0 HB2 MET A 43 -24.271 -8.083 -20.686 1.00 18.57 H new ATOM 0 HB3 MET A 43 -25.500 -8.996 -20.984 1.00 18.57 H new ATOM 0 HG2 MET A 43 -24.823 -9.108 -23.250 1.00 19.45 H new ATOM 0 HG3 MET A 43 -23.553 -8.279 -22.886 1.00 19.45 H new ATOM 0 HE1 MET A 43 -21.856 -11.579 -23.099 1.00 28.46 H new ATOM 0 HE2 MET A 43 -22.911 -10.921 -24.080 1.00 28.46 H new ATOM 0 HE3 MET A 43 -21.754 -10.039 -23.454 1.00 28.46 H new ATOM 515 N ASP A 44 -27.212 -7.300 -19.822 1.00 15.18 N ANISOU 515 N ASP A 44 2070 2040 1657 41 -292 -95 N ATOM 516 CA ASP A 44 -27.648 -7.043 -18.453 1.00 15.04 C ANISOU 516 CA ASP A 44 1935 2046 1735 58 -274 -88 C ATOM 517 C ASP A 44 -27.764 -8.366 -17.721 1.00 16.45 C ANISOU 517 C ASP A 44 2086 2221 1945 40 -241 -109 C ATOM 518 O ASP A 44 -27.392 -9.413 -18.255 1.00 16.01 O ANISOU 518 O ASP A 44 2093 2142 1848 20 -229 -130 O ATOM 519 CB ASP A 44 -28.954 -6.232 -18.417 1.00 15.19 C ANISOU 519 CB ASP A 44 1883 2066 1822 63 -352 -67 C ATOM 520 CG ASP A 44 -30.096 -6.911 -19.125 1.00 18.47 C ANISOU 520 CG ASP A 44 2292 2465 2261 26 -457 -72 C ATOM 521 OD1 ASP A 44 -30.139 -8.163 -19.178 1.00 18.57 O ANISOU 521 OD1 ASP A 44 2327 2466 2261 -9 -453 -101 O ATOM 522 OD2 ASP A 44 -31.002 -6.201 -19.651 1.00 19.31 O ANISOU 522 OD2 ASP A 44 2366 2562 2410 31 -558 -45 O ATOM 0 H ASP A 44 -27.562 -8.001 -20.177 1.00 15.18 H new ATOM 0 HA ASP A 44 -26.989 -6.495 -17.999 1.00 15.04 H new ATOM 0 HB2 ASP A 44 -29.203 -6.073 -17.493 1.00 15.19 H new ATOM 0 HB3 ASP A 44 -28.800 -5.365 -18.823 1.00 15.19 H new ATOM 527 N ARG A 45 -28.269 -8.327 -16.489 1.00 17.37 N ANISOU 527 N ARG A 45 2123 2350 2129 46 -214 -103 N ATOM 528 CA ARG A 45 -28.242 -9.528 -15.642 1.00 13.90 C ANISOU 528 CA ARG A 45 1672 1900 1710 32 -166 -110 C ATOM 529 C ARG A 45 -29.169 -10.614 -16.121 1.00 15.85 C ANISOU 529 C ARG A 45 1916 2119 1989 -12 -205 -127 C ATOM 530 O ARG A 45 -29.080 -11.753 -15.612 1.00 15.85 O ANISOU 530 O ARG A 45 1926 2096 2002 -28 -162 -132 O ATOM 531 CB ARG A 45 -28.614 -9.160 -14.197 1.00 15.73 C ANISOU 531 CB ARG A 45 1849 2143 1985 44 -113 -98 C ATOM 532 CG ARG A 45 -30.086 -8.881 -14.006 1.00 15.11 C ANISOU 532 CG ARG A 45 1690 2055 1995 30 -123 -96 C ATOM 533 CD ARG A 45 -30.302 -8.148 -12.732 1.00 17.99 C ANISOU 533 CD ARG A 45 2028 2424 2384 51 -46 -91 C ATOM 534 NE ARG A 45 -31.653 -8.227 -12.225 1.00 17.64 N ANISOU 534 NE ARG A 45 1902 2356 2446 36 -2 -89 N ATOM 535 CZ ARG A 45 -32.274 -7.296 -11.509 1.00 18.56 C ANISOU 535 CZ ARG A 45 1972 2460 2619 58 63 -90 C ATOM 536 NH1 ARG A 45 -31.672 -6.120 -11.277 1.00 17.49 N ANISOU 536 NH1 ARG A 45 1874 2336 2437 92 73 -96 N ATOM 537 NH2 ARG A 45 -33.469 -7.562 -11.022 1.00 18.84 N ANISOU 537 NH2 ARG A 45 1926 2463 2770 43 131 -88 N ATOM 0 H ARG A 45 -28.625 -7.633 -16.127 1.00 17.37 H new ATOM 0 HA ARG A 45 -27.337 -9.874 -15.689 1.00 13.90 H new ATOM 0 HB2 ARG A 45 -28.350 -9.884 -13.608 1.00 15.73 H new ATOM 0 HB3 ARG A 45 -28.107 -8.378 -13.929 1.00 15.73 H new ATOM 0 HG2 ARG A 45 -30.423 -8.358 -14.750 1.00 15.11 H new ATOM 0 HG3 ARG A 45 -30.582 -9.714 -13.997 1.00 15.11 H new ATOM 0 HD2 ARG A 45 -29.695 -8.499 -12.062 1.00 17.99 H new ATOM 0 HD3 ARG A 45 -30.071 -7.215 -12.864 1.00 17.99 H new ATOM 0 HE ARG A 45 -32.096 -8.942 -12.403 1.00 17.64 H new ATOM 0 HH11 ARG A 45 -30.886 -5.970 -11.592 1.00 17.49 H new ATOM 0 HH12 ARG A 45 -32.072 -5.516 -10.814 1.00 17.49 H new ATOM 0 HH21 ARG A 45 -33.833 -8.327 -11.170 1.00 18.84 H new ATOM 0 HH22 ARG A 45 -33.885 -6.971 -10.556 1.00 18.84 H new ATOM 551 N ARG A 46 -30.049 -10.336 -17.078 1.00 17.81 N ANISOU 551 N ARG A 46 2153 2359 2254 -35 -296 -132 N ATOM 552 CA ARG A 46 -30.954 -11.389 -17.531 1.00 17.70 C ANISOU 552 CA ARG A 46 2131 2312 2283 -90 -355 -153 C ATOM 553 C ARG A 46 -30.232 -12.461 -18.318 1.00 15.91 C ANISOU 553 C ARG A 46 2021 2052 1971 -114 -350 -187 C ATOM 554 O ARG A 46 -30.818 -13.517 -18.532 1.00 16.14 O ANISOU 554 O ARG A 46 2058 2042 2033 -165 -381 -212 O ATOM 555 CB ARG A 46 -32.063 -10.780 -18.366 1.00 25.05 C ANISOU 555 CB ARG A 46 3017 3239 3261 -111 -485 -146 C ATOM 556 CG ARG A 46 -33.112 -10.150 -17.456 1.00 33.64 C ANISOU 556 CG ARG A 46 3954 4333 4494 -97 -468 -120 C ATOM 557 CD ARG A 46 -33.811 -8.998 -18.104 1.00 43.27 C ANISOU 557 CD ARG A 46 5121 5555 5763 -78 -577 -93 C ATOM 558 NE ARG A 46 -34.693 -9.430 -19.172 1.00 51.96 N ANISOU 558 NE ARG A 46 6214 6629 6900 -129 -739 -98 N ATOM 559 CZ ARG A 46 -35.618 -8.647 -19.726 1.00 57.06 C ANISOU 559 CZ ARG A 46 6783 7263 7634 -122 -873 -66 C ATOM 560 NH1 ARG A 46 -35.769 -7.399 -19.291 1.00 53.95 N ANISOU 560 NH1 ARG A 46 6315 6879 7306 -59 -838 -28 N ATOM 561 NH2 ARG A 46 -36.380 -9.111 -20.702 1.00 62.81 N ANISOU 561 NH2 ARG A 46 7514 7964 8387 -177 -1049 -70 N ATOM 0 H ARG A 46 -30.138 -9.574 -17.466 1.00 17.81 H new ATOM 0 HA ARG A 46 -31.331 -11.816 -16.746 1.00 17.70 H new ATOM 0 HB2 ARG A 46 -31.697 -10.109 -18.964 1.00 25.05 H new ATOM 0 HB3 ARG A 46 -32.472 -11.462 -18.921 1.00 25.05 H new ATOM 0 HG2 ARG A 46 -33.765 -10.822 -17.206 1.00 33.64 H new ATOM 0 HG3 ARG A 46 -32.687 -9.849 -16.638 1.00 33.64 H new ATOM 0 HD2 ARG A 46 -34.324 -8.515 -17.437 1.00 43.27 H new ATOM 0 HD3 ARG A 46 -33.153 -8.379 -18.459 1.00 43.27 H new ATOM 0 HE ARG A 46 -34.615 -10.235 -19.463 1.00 51.96 H new ATOM 0 HH11 ARG A 46 -35.271 -7.102 -18.656 1.00 53.95 H new ATOM 0 HH12 ARG A 46 -36.364 -6.889 -19.645 1.00 53.95 H new ATOM 0 HH21 ARG A 46 -36.279 -9.919 -20.980 1.00 62.81 H new ATOM 0 HH22 ARG A 46 -36.977 -8.605 -21.059 1.00 62.81 H new ATOM 575 N ILE A 47 -28.989 -12.235 -18.751 1.00 15.17 N ANISOU 575 N ILE A 47 2016 1962 1784 -82 -302 -190 N ATOM 576 CA ILE A 47 -28.345 -13.257 -19.600 1.00 15.43 C ANISOU 576 CA ILE A 47 2169 1948 1745 -102 -276 -229 C ATOM 577 C ILE A 47 -28.006 -14.504 -18.811 1.00 14.76 C ANISOU 577 C ILE A 47 2072 1828 1708 -102 -197 -236 C ATOM 578 O ILE A 47 -27.814 -15.571 -19.395 1.00 16.20 O ANISOU 578 O ILE A 47 2338 1954 1864 -128 -179 -275 O ATOM 579 CB ILE A 47 -27.087 -12.651 -20.270 1.00 17.08 C ANISOU 579 CB ILE A 47 2464 2159 1866 -64 -215 -227 C ATOM 580 CG1 ILE A 47 -26.034 -12.301 -19.241 1.00 21.35 C ANISOU 580 CG1 ILE A 47 2937 2723 2451 -9 -122 -196 C ATOM 581 CG2 ILE A 47 -27.478 -11.441 -21.104 1.00 19.70 C ANISOU 581 CG2 ILE A 47 2832 2514 2141 -67 -296 -210 C ATOM 582 CD1 ILE A 47 -24.883 -13.254 -19.205 1.00 28.02 C ANISOU 582 CD1 ILE A 47 3819 3524 3302 13 -24 -209 C ATOM 0 H ILE A 47 -28.518 -11.537 -18.579 1.00 15.17 H new ATOM 0 HA ILE A 47 -28.970 -13.528 -20.291 1.00 15.43 H new ATOM 0 HB ILE A 47 -26.697 -13.315 -20.859 1.00 17.08 H new ATOM 0 HG12 ILE A 47 -25.699 -11.409 -19.424 1.00 21.35 H new ATOM 0 HG13 ILE A 47 -26.448 -12.274 -18.364 1.00 21.35 H new ATOM 0 HG21 ILE A 47 -26.687 -11.066 -21.521 1.00 19.70 H new ATOM 0 HG22 ILE A 47 -28.108 -11.711 -21.791 1.00 19.70 H new ATOM 0 HG23 ILE A 47 -27.889 -10.773 -20.533 1.00 19.70 H new ATOM 0 HD11 ILE A 47 -24.250 -12.971 -18.527 1.00 28.02 H new ATOM 0 HD12 ILE A 47 -25.206 -14.144 -18.994 1.00 28.02 H new ATOM 0 HD13 ILE A 47 -24.446 -13.266 -20.071 1.00 28.02 H new ATOM 594 N TRP A 48 -27.954 -14.415 -17.486 1.00 15.22 N ANISOU 594 N TRP A 48 2043 1910 1830 -75 -150 -200 N ATOM 595 CA TRP A 48 -27.518 -15.582 -16.726 1.00 14.70 C ANISOU 595 CA TRP A 48 1983 1803 1798 -68 -80 -192 C ATOM 596 C TRP A 48 -28.588 -16.669 -16.776 1.00 15.36 C ANISOU 596 C TRP A 48 2065 1837 1935 -130 -104 -214 C ATOM 597 O TRP A 48 -28.280 -17.846 -17.015 1.00 16.88 O ANISOU 597 O TRP A 48 2321 1965 2130 -145 -69 -237 O ATOM 598 CB TRP A 48 -27.193 -15.156 -15.289 1.00 15.98 C ANISOU 598 CB TRP A 48 2083 1999 1988 -28 -38 -143 C ATOM 599 CG TRP A 48 -26.105 -14.108 -15.302 1.00 15.69 C ANISOU 599 CG TRP A 48 2044 2002 1914 21 -29 -128 C ATOM 600 CD1 TRP A 48 -26.220 -12.796 -14.963 1.00 15.43 C ANISOU 600 CD1 TRP A 48 1969 2020 1874 35 -50 -114 C ATOM 601 CD2 TRP A 48 -24.742 -14.299 -15.731 1.00 14.47 C ANISOU 601 CD2 TRP A 48 1926 1826 1746 58 13 -130 C ATOM 602 NE1 TRP A 48 -25.028 -12.157 -15.142 1.00 15.23 N ANISOU 602 NE1 TRP A 48 1951 2007 1827 71 -34 -107 N ATOM 603 CE2 TRP A 48 -24.102 -13.054 -15.640 1.00 14.92 C ANISOU 603 CE2 TRP A 48 1952 1925 1792 85 8 -115 C ATOM 604 CE3 TRP A 48 -24.007 -15.393 -16.198 1.00 15.12 C ANISOU 604 CE3 TRP A 48 2056 1846 1842 70 64 -144 C ATOM 605 CZ2 TRP A 48 -22.758 -12.880 -15.960 1.00 15.85 C ANISOU 605 CZ2 TRP A 48 2071 2029 1923 120 52 -109 C ATOM 606 CZ3 TRP A 48 -22.675 -15.223 -16.530 1.00 17.36 C ANISOU 606 CZ3 TRP A 48 2342 2114 2141 115 118 -138 C ATOM 607 CH2 TRP A 48 -22.061 -13.955 -16.389 1.00 17.28 C ANISOU 607 CH2 TRP A 48 2284 2152 2131 137 110 -119 C ATOM 0 H TRP A 48 -28.157 -13.719 -17.023 1.00 15.22 H new ATOM 0 HA TRP A 48 -26.713 -15.955 -17.118 1.00 14.70 H new ATOM 0 HB2 TRP A 48 -27.988 -14.804 -14.859 1.00 15.98 H new ATOM 0 HB3 TRP A 48 -26.907 -15.925 -14.771 1.00 15.98 H new ATOM 0 HD1 TRP A 48 -26.999 -12.393 -14.654 1.00 15.43 H new ATOM 0 HE1 TRP A 48 -24.877 -11.328 -14.972 1.00 15.23 H new ATOM 0 HE3 TRP A 48 -24.410 -16.227 -16.285 1.00 15.12 H new ATOM 0 HZ2 TRP A 48 -22.352 -12.047 -15.881 1.00 15.85 H new ATOM 0 HZ3 TRP A 48 -22.181 -15.944 -16.847 1.00 17.36 H new ATOM 0 HH2 TRP A 48 -21.159 -13.860 -16.596 1.00 17.28 H new ATOM 618 N ALA A 49 -29.849 -16.279 -16.608 1.00 15.98 N ANISOU 618 N ALA A 49 2065 1935 2072 -169 -160 -210 N ATOM 619 CA ALA A 49 -30.911 -17.237 -16.786 1.00 17.56 C ANISOU 619 CA ALA A 49 2246 2082 2345 -241 -195 -234 C ATOM 620 C ALA A 49 -31.108 -17.625 -18.253 1.00 16.83 C ANISOU 620 C ALA A 49 2241 1952 2203 -291 -291 -293 C ATOM 621 O ALA A 49 -31.256 -18.800 -18.557 1.00 18.54 O ANISOU 621 O ALA A 49 2513 2099 2434 -341 -289 -330 O ATOM 622 CB ALA A 49 -32.220 -16.677 -16.205 1.00 18.41 C ANISOU 622 CB ALA A 49 2220 2211 2564 -267 -222 -211 C ATOM 0 H ALA A 49 -30.098 -15.484 -16.396 1.00 15.98 H new ATOM 0 HA ALA A 49 -30.658 -18.044 -16.310 1.00 17.56 H new ATOM 0 HB1 ALA A 49 -32.932 -17.325 -16.327 1.00 18.41 H new ATOM 0 HB2 ALA A 49 -32.104 -16.499 -15.259 1.00 18.41 H new ATOM 0 HB3 ALA A 49 -32.451 -15.853 -16.662 1.00 18.41 H new ATOM 628 N GLU A 50 -31.081 -16.660 -19.168 1.00 16.36 N ANISOU 628 N GLU A 50 2215 1929 2073 -282 -373 -301 N ATOM 629 CA GLU A 50 -31.348 -16.948 -20.554 1.00 17.41 C ANISOU 629 CA GLU A 50 2458 2025 2131 -337 -480 -353 C ATOM 630 C GLU A 50 -30.309 -17.848 -21.159 1.00 16.91 C ANISOU 630 C GLU A 50 2553 1903 1969 -334 -401 -401 C ATOM 631 O GLU A 50 -30.632 -18.691 -22.006 1.00 18.04 O ANISOU 631 O GLU A 50 2801 1981 2074 -400 -457 -460 O ATOM 632 CB GLU A 50 -31.487 -15.636 -21.335 1.00 18.97 C ANISOU 632 CB GLU A 50 2675 2271 2260 -319 -579 -336 C ATOM 633 CG GLU A 50 -32.721 -14.861 -20.880 1.00 26.62 C ANISOU 633 CG GLU A 50 3480 3276 3359 -328 -672 -296 C ATOM 634 CD GLU A 50 -33.032 -13.661 -21.761 1.00 35.59 C ANISOU 634 CD GLU A 50 4638 4441 4444 -315 -802 -272 C ATOM 635 OE1 GLU A 50 -32.334 -13.454 -22.771 1.00 38.91 O ANISOU 635 OE1 GLU A 50 5220 4854 4709 -310 -822 -288 O ATOM 636 OE2 GLU A 50 -34.003 -12.949 -21.443 1.00 39.61 O ANISOU 636 OE2 GLU A 50 5004 4970 5075 -310 -876 -235 O ATOM 0 H GLU A 50 -30.909 -15.835 -18.998 1.00 16.36 H new ATOM 0 HA GLU A 50 -32.186 -17.434 -20.607 1.00 17.41 H new ATOM 0 HB2 GLU A 50 -30.694 -15.093 -21.207 1.00 18.97 H new ATOM 0 HB3 GLU A 50 -31.551 -15.825 -22.284 1.00 18.97 H new ATOM 0 HG2 GLU A 50 -33.486 -15.457 -20.873 1.00 26.62 H new ATOM 0 HG3 GLU A 50 -32.588 -14.560 -19.968 1.00 26.62 H new ATOM 643 N SER A 51 -29.062 -17.710 -20.717 1.00 18.08 N ANISOU 643 N SER A 51 2717 2064 2090 -260 -271 -377 N ATOM 644 CA SER A 51 -27.986 -18.569 -21.238 1.00 17.46 C ANISOU 644 CA SER A 51 2767 1916 1950 -243 -168 -418 C ATOM 645 C SER A 51 -28.012 -19.960 -20.652 1.00 18.25 C ANISOU 645 C SER A 51 2862 1942 2131 -260 -107 -431 C ATOM 646 O SER A 51 -27.327 -20.831 -21.183 1.00 20.00 O ANISOU 646 O SER A 51 3196 2084 2319 -255 -29 -476 O ATOM 647 CB SER A 51 -26.656 -17.928 -20.949 1.00 16.85 C ANISOU 647 CB SER A 51 2676 1870 1856 -158 -60 -381 C ATOM 648 OG SER A 51 -26.347 -17.995 -19.554 1.00 16.51 O ANISOU 648 OG SER A 51 2511 1851 1910 -112 -9 -325 O ATOM 0 H SER A 51 -28.815 -17.137 -20.126 1.00 18.08 H new ATOM 0 HA SER A 51 -28.125 -18.659 -22.194 1.00 17.46 H new ATOM 0 HB2 SER A 51 -25.961 -18.373 -21.459 1.00 16.85 H new ATOM 0 HB3 SER A 51 -26.670 -17.002 -21.236 1.00 16.85 H new ATOM 0 HG SER A 51 -26.680 -17.332 -19.161 1.00 16.51 H new ATOM 654 N GLY A 52 -28.740 -20.188 -19.583 1.00 18.25 N ANISOU 654 N GLY A 52 2744 1955 2235 -276 -123 -392 N ATOM 655 CA GLY A 52 -28.701 -21.458 -18.911 1.00 18.53 C ANISOU 655 CA GLY A 52 2778 1915 2348 -285 -52 -388 C ATOM 656 C GLY A 52 -27.586 -21.588 -17.903 1.00 18.86 C ANISOU 656 C GLY A 52 2789 1958 2420 -199 56 -328 C ATOM 657 O GLY A 52 -27.468 -22.664 -17.276 1.00 21.66 O ANISOU 657 O GLY A 52 3151 2242 2837 -196 115 -309 O ATOM 0 H GLY A 52 -29.270 -19.611 -19.228 1.00 18.25 H new ATOM 0 HA2 GLY A 52 -29.549 -21.601 -18.462 1.00 18.53 H new ATOM 0 HA3 GLY A 52 -28.609 -22.161 -19.573 1.00 18.53 H new ATOM 661 N PHE A 53 -26.746 -20.544 -17.749 1.00 17.94 N ANISOU 661 N PHE A 53 2641 1911 2264 -132 73 -294 N ATOM 662 CA PHE A 53 -25.697 -20.612 -16.739 1.00 17.61 C ANISOU 662 CA PHE A 53 2557 1871 2261 -56 141 -232 C ATOM 663 C PHE A 53 -26.278 -20.739 -15.334 1.00 20.63 C ANISOU 663 C PHE A 53 2871 2272 2694 -62 135 -170 C ATOM 664 O PHE A 53 -25.778 -21.517 -14.521 1.00 21.90 O ANISOU 664 O PHE A 53 3040 2385 2896 -28 181 -124 O ATOM 665 CB PHE A 53 -24.829 -19.351 -16.831 1.00 15.29 C ANISOU 665 CB PHE A 53 2230 1650 1930 -1 141 -212 C ATOM 666 CG PHE A 53 -23.581 -19.413 -15.986 1.00 16.44 C ANISOU 666 CG PHE A 53 2331 1789 2124 75 189 -155 C ATOM 667 CD1 PHE A 53 -22.406 -19.880 -16.497 1.00 17.81 C ANISOU 667 CD1 PHE A 53 2531 1902 2333 124 263 -165 C ATOM 668 CD2 PHE A 53 -23.607 -18.954 -14.678 1.00 17.82 C ANISOU 668 CD2 PHE A 53 2441 2015 2315 94 154 -93 C ATOM 669 CE1 PHE A 53 -21.257 -19.966 -15.727 1.00 18.69 C ANISOU 669 CE1 PHE A 53 2579 2000 2522 195 285 -106 C ATOM 670 CE2 PHE A 53 -22.450 -19.037 -13.886 1.00 17.09 C ANISOU 670 CE2 PHE A 53 2314 1912 2268 158 162 -36 C ATOM 671 CZ PHE A 53 -21.291 -19.539 -14.407 1.00 18.02 C ANISOU 671 CZ PHE A 53 2431 1969 2446 209 217 -39 C ATOM 0 H PHE A 53 -26.772 -19.816 -18.207 1.00 17.94 H new ATOM 0 HA PHE A 53 -25.160 -21.402 -16.908 1.00 17.61 H new ATOM 0 HB2 PHE A 53 -24.577 -19.208 -17.757 1.00 15.29 H new ATOM 0 HB3 PHE A 53 -25.357 -18.584 -16.559 1.00 15.29 H new ATOM 0 HD1 PHE A 53 -22.375 -20.148 -17.387 1.00 17.81 H new ATOM 0 HD2 PHE A 53 -24.388 -18.592 -14.326 1.00 17.82 H new ATOM 0 HE1 PHE A 53 -20.472 -20.306 -16.091 1.00 18.69 H new ATOM 0 HE2 PHE A 53 -22.473 -18.749 -13.002 1.00 17.09 H new ATOM 0 HZ PHE A 53 -20.528 -19.594 -13.879 1.00 18.02 H new ATOM 681 N LEU A 54 -27.324 -19.979 -15.028 1.00 22.58 N ANISOU 681 N LEU A 54 3058 2579 2941 -100 85 -164 N ATOM 682 CA LEU A 54 -27.896 -19.994 -13.683 1.00 24.04 C ANISOU 682 CA LEU A 54 3193 2777 3163 -107 109 -109 C ATOM 683 C LEU A 54 -28.453 -21.357 -13.334 1.00 25.50 C ANISOU 683 C LEU A 54 3404 2874 3410 -152 153 -101 C ATOM 684 O LEU A 54 -28.236 -21.863 -12.217 1.00 24.50 O ANISOU 684 O LEU A 54 3295 2718 3296 -131 206 -39 O ATOM 685 CB LEU A 54 -28.979 -18.913 -13.579 1.00 23.33 C ANISOU 685 CB LEU A 54 3027 2753 3085 -139 70 -115 C ATOM 686 CG LEU A 54 -29.654 -18.654 -12.240 1.00 26.27 C ANISOU 686 CG LEU A 54 3353 3142 3488 -146 121 -67 C ATOM 687 CD1 LEU A 54 -28.674 -18.153 -11.220 1.00 28.81 C ANISOU 687 CD1 LEU A 54 3706 3498 3743 -83 148 -18 C ATOM 688 CD2 LEU A 54 -30.801 -17.624 -12.407 1.00 26.72 C ANISOU 688 CD2 LEU A 54 3317 3244 3591 -175 91 -85 C ATOM 0 H LEU A 54 -27.717 -19.450 -15.580 1.00 22.58 H new ATOM 0 HA LEU A 54 -27.193 -19.803 -13.043 1.00 24.04 H new ATOM 0 HB2 LEU A 54 -28.584 -18.077 -13.872 1.00 23.33 H new ATOM 0 HB3 LEU A 54 -29.675 -19.137 -14.217 1.00 23.33 H new ATOM 0 HG LEU A 54 -30.017 -19.497 -11.927 1.00 26.27 H new ATOM 0 HD11 LEU A 54 -29.133 -17.997 -10.379 1.00 28.81 H new ATOM 0 HD12 LEU A 54 -27.976 -18.814 -11.090 1.00 28.81 H new ATOM 0 HD13 LEU A 54 -28.279 -17.323 -11.531 1.00 28.81 H new ATOM 0 HD21 LEU A 54 -31.223 -17.467 -11.548 1.00 26.72 H new ATOM 0 HD22 LEU A 54 -30.440 -16.790 -12.746 1.00 26.72 H new ATOM 0 HD23 LEU A 54 -31.458 -17.969 -13.031 1.00 26.72 H new ATOM 700 N ASP A 55 -29.146 -21.998 -14.285 1.00 28.12 N ANISOU 700 N ASP A 55 3755 3153 3777 -218 125 -160 N ATOM 701 CA ASP A 55 -29.710 -23.326 -14.065 1.00 35.04 C ANISOU 701 CA ASP A 55 4656 3930 4727 -274 166 -162 C ATOM 702 C ASP A 55 -28.632 -24.363 -13.821 1.00 27.20 C ANISOU 702 C ASP A 55 3745 2856 3734 -223 232 -136 C ATOM 703 O ASP A 55 -28.911 -25.407 -13.198 1.00 25.61 O ANISOU 703 O ASP A 55 3570 2570 3592 -247 287 -102 O ATOM 704 CB ASP A 55 -30.541 -23.737 -15.289 1.00 54.67 C ANISOU 704 CB ASP A 55 7157 6371 7243 -361 96 -245 C ATOM 705 CG ASP A 55 -31.149 -25.121 -15.144 1.00 73.56 C ANISOU 705 CG ASP A 55 9575 8649 9727 -433 134 -257 C ATOM 706 OD1 ASP A 55 -30.911 -25.976 -16.023 1.00 80.63 O ANISOU 706 OD1 ASP A 55 10563 9460 10613 -463 124 -320 O ATOM 707 OD2 ASP A 55 -31.856 -25.354 -14.141 1.00 79.02 O ANISOU 707 OD2 ASP A 55 10204 9324 10497 -463 186 -205 O ATOM 0 H ASP A 55 -29.298 -21.674 -15.067 1.00 28.12 H new ATOM 0 HA ASP A 55 -30.270 -23.284 -13.274 1.00 35.04 H new ATOM 0 HB2 ASP A 55 -31.250 -23.089 -15.427 1.00 54.67 H new ATOM 0 HB3 ASP A 55 -29.979 -23.715 -16.079 1.00 54.67 H new ATOM 712 N ALA A 56 -27.415 -24.108 -14.293 1.00 24.83 N ANISOU 712 N ALA A 56 3481 2568 3384 -151 235 -144 N ATOM 713 CA ALA A 56 -26.327 -25.064 -14.149 1.00 25.69 C ANISOU 713 CA ALA A 56 3648 2590 3524 -90 297 -119 C ATOM 714 C ALA A 56 -25.736 -25.090 -12.750 1.00 25.08 C ANISOU 714 C ALA A 56 3549 2521 3459 -25 314 -14 C ATOM 715 O ALA A 56 -24.991 -26.009 -12.438 1.00 25.36 O ANISOU 715 O ALA A 56 3622 2470 3543 24 353 28 O ATOM 716 CB ALA A 56 -25.225 -24.763 -15.182 1.00 25.35 C ANISOU 716 CB ALA A 56 3636 2548 3450 -35 312 -165 C ATOM 0 H ALA A 56 -27.200 -23.383 -14.702 1.00 24.83 H new ATOM 0 HA ALA A 56 -26.703 -25.944 -14.308 1.00 25.69 H new ATOM 0 HB1 ALA A 56 -24.503 -25.403 -15.081 1.00 25.35 H new ATOM 0 HB2 ALA A 56 -25.593 -24.830 -16.077 1.00 25.35 H new ATOM 0 HB3 ALA A 56 -24.884 -23.866 -15.039 1.00 25.35 H new ATOM 722 N LEU A 57 -26.068 -24.111 -11.899 1.00 23.39 N ANISOU 722 N LEU A 57 3285 2400 3201 -25 282 29 N ATOM 723 CA LEU A 57 -25.540 -24.037 -10.539 1.00 22.80 C ANISOU 723 CA LEU A 57 3221 2337 3106 26 279 124 C ATOM 724 C LEU A 57 -26.668 -24.349 -9.551 1.00 27.94 C ANISOU 724 C LEU A 57 3895 2970 3753 -32 322 167 C ATOM 725 O LEU A 57 -27.267 -23.427 -8.996 1.00 27.39 O ANISOU 725 O LEU A 57 3796 2974 3638 -54 319 174 O ATOM 726 CB LEU A 57 -24.966 -22.649 -10.250 1.00 22.81 C ANISOU 726 CB LEU A 57 3176 2447 3045 68 222 136 C ATOM 727 CG LEU A 57 -23.865 -22.113 -11.168 1.00 24.90 C ANISOU 727 CG LEU A 57 3404 2738 3320 120 196 100 C ATOM 728 CD1 LEU A 57 -23.554 -20.664 -10.807 1.00 23.12 C ANISOU 728 CD1 LEU A 57 3131 2616 3040 139 142 109 C ATOM 729 CD2 LEU A 57 -22.623 -22.933 -11.075 1.00 28.63 C ANISOU 729 CD2 LEU A 57 3886 3133 3860 192 207 143 C ATOM 0 H LEU A 57 -26.607 -23.472 -12.099 1.00 23.39 H new ATOM 0 HA LEU A 57 -24.824 -24.684 -10.443 1.00 22.80 H new ATOM 0 HB2 LEU A 57 -25.700 -22.016 -10.268 1.00 22.81 H new ATOM 0 HB3 LEU A 57 -24.619 -22.655 -9.344 1.00 22.81 H new ATOM 0 HG LEU A 57 -24.188 -22.164 -12.081 1.00 24.90 H new ATOM 0 HD11 LEU A 57 -22.856 -20.328 -11.391 1.00 23.12 H new ATOM 0 HD12 LEU A 57 -24.353 -20.125 -10.915 1.00 23.12 H new ATOM 0 HD13 LEU A 57 -23.255 -20.617 -9.885 1.00 23.12 H new ATOM 0 HD21 LEU A 57 -21.948 -22.567 -11.668 1.00 28.63 H new ATOM 0 HD22 LEU A 57 -22.294 -22.919 -10.163 1.00 28.63 H new ATOM 0 HD23 LEU A 57 -22.818 -23.847 -11.334 1.00 28.63 H new ATOM 741 N PRO A 58 -26.917 -25.620 -9.256 1.00 37.84 N ANISOU 741 N PRO A 58 5204 4115 5058 -54 376 200 N ATOM 742 CA PRO A 58 -28.096 -25.939 -8.451 1.00 40.55 C ANISOU 742 CA PRO A 58 5564 4428 5414 -124 443 233 C ATOM 743 C PRO A 58 -28.012 -25.437 -7.017 1.00 36.63 C ANISOU 743 C PRO A 58 5118 3971 4830 -98 461 321 C ATOM 744 O PRO A 58 -29.042 -25.055 -6.440 1.00 36.08 O ANISOU 744 O PRO A 58 5038 3922 4748 -153 525 326 O ATOM 745 CB PRO A 58 -28.141 -27.473 -8.503 1.00 42.54 C ANISOU 745 CB PRO A 58 5881 4539 5745 -145 498 255 C ATOM 746 CG PRO A 58 -26.697 -27.865 -8.608 1.00 42.98 C ANISOU 746 CG PRO A 58 5976 4556 5797 -47 460 289 C ATOM 747 CD PRO A 58 -26.047 -26.796 -9.468 1.00 43.13 C ANISOU 747 CD PRO A 58 5928 4675 5785 -7 393 223 C ATOM 0 HA PRO A 58 -28.894 -25.507 -8.794 1.00 40.55 H new ATOM 0 HB2 PRO A 58 -28.555 -27.845 -7.708 1.00 42.54 H new ATOM 0 HB3 PRO A 58 -28.653 -27.789 -9.264 1.00 42.54 H new ATOM 0 HG2 PRO A 58 -26.282 -27.908 -7.732 1.00 42.98 H new ATOM 0 HG3 PRO A 58 -26.602 -28.742 -9.010 1.00 42.98 H new ATOM 0 HD2 PRO A 58 -25.134 -26.621 -9.193 1.00 43.13 H new ATOM 0 HD3 PRO A 58 -26.017 -27.056 -10.402 1.00 43.13 H new ATOM 755 N ASP A 59 -26.825 -25.426 -6.415 1.00 31.23 N ANISOU 755 N ASP A 59 4490 3289 4088 -18 405 389 N ATOM 756 CA ASP A 59 -26.725 -25.212 -4.984 1.00 30.95 C ANISOU 756 CA ASP A 59 4549 3262 3949 -2 411 480 C ATOM 757 C ASP A 59 -26.205 -23.836 -4.608 1.00 27.20 C ANISOU 757 C ASP A 59 4059 2898 3376 33 333 474 C ATOM 758 O ASP A 59 -26.363 -23.422 -3.454 1.00 29.52 O ANISOU 758 O ASP A 59 4444 3212 3561 27 347 525 O ATOM 759 CB ASP A 59 -25.805 -26.265 -4.356 1.00 33.40 C ANISOU 759 CB ASP A 59 4956 3478 4257 56 377 583 C ATOM 760 CG ASP A 59 -26.293 -27.683 -4.612 1.00 37.54 C ANISOU 760 CG ASP A 59 5515 3872 4879 22 463 598 C ATOM 761 OD1 ASP A 59 -27.520 -27.903 -4.569 1.00 39.37 O ANISOU 761 OD1 ASP A 59 5746 4078 5137 -64 566 573 O ATOM 762 OD2 ASP A 59 -25.450 -28.554 -4.866 1.00 39.68 O ANISOU 762 OD2 ASP A 59 5804 4059 5216 79 431 632 O ATOM 0 H ASP A 59 -26.074 -25.540 -6.818 1.00 31.23 H new ATOM 0 HA ASP A 59 -27.630 -25.286 -4.643 1.00 30.95 H new ATOM 0 HB2 ASP A 59 -24.909 -26.164 -4.714 1.00 33.40 H new ATOM 0 HB3 ASP A 59 -25.747 -26.112 -3.400 1.00 33.40 H new ATOM 767 N ALA A 60 -25.623 -23.117 -5.539 1.00 21.82 N ANISOU 767 N ALA A 60 3282 2281 2726 63 264 409 N ATOM 768 CA ALA A 60 -24.947 -21.876 -5.180 1.00 19.94 C ANISOU 768 CA ALA A 60 3032 2133 2411 99 182 408 C ATOM 769 C ALA A 60 -25.937 -20.810 -4.730 1.00 18.99 C ANISOU 769 C ALA A 60 2916 2079 2221 50 233 374 C ATOM 770 O ALA A 60 -27.086 -20.745 -5.173 1.00 20.97 O ANISOU 770 O ALA A 60 3116 2331 2521 -4 315 324 O ATOM 771 CB ALA A 60 -24.156 -21.348 -6.362 1.00 20.50 C ANISOU 771 CB ALA A 60 2997 2246 2545 135 122 346 C ATOM 0 H ALA A 60 -25.602 -23.318 -6.375 1.00 21.82 H new ATOM 0 HA ALA A 60 -24.349 -22.075 -4.443 1.00 19.94 H new ATOM 0 HB1 ALA A 60 -23.711 -20.523 -6.111 1.00 20.50 H new ATOM 0 HB2 ALA A 60 -23.493 -22.005 -6.627 1.00 20.50 H new ATOM 0 HB3 ALA A 60 -24.757 -21.178 -7.104 1.00 20.50 H new ATOM 777 N HIS A 61 -25.456 -19.936 -3.856 1.00 18.55 N ANISOU 777 N HIS A 61 2917 2071 2060 70 178 398 N ATOM 778 CA HIS A 61 -26.102 -18.648 -3.632 1.00 18.27 C ANISOU 778 CA HIS A 61 2868 2103 1969 42 214 346 C ATOM 779 C HIS A 61 -25.598 -17.717 -4.709 1.00 18.02 C ANISOU 779 C HIS A 61 2718 2138 1992 64 143 280 C ATOM 780 O HIS A 61 -24.400 -17.380 -4.734 1.00 18.55 O ANISOU 780 O HIS A 61 2774 2226 2048 107 39 293 O ATOM 781 CB HIS A 61 -25.786 -18.168 -2.236 1.00 19.42 C ANISOU 781 CB HIS A 61 3156 2256 1966 46 188 393 C ATOM 782 CG HIS A 61 -26.339 -16.819 -1.925 1.00 22.70 C ANISOU 782 CG HIS A 61 3577 2727 2320 23 233 336 C ATOM 783 ND1 HIS A 61 -25.909 -16.074 -0.843 1.00 24.97 N ANISOU 783 ND1 HIS A 61 3993 3032 2463 24 188 350 N ATOM 784 CD2 HIS A 61 -27.253 -16.061 -2.570 1.00 24.66 C ANISOU 784 CD2 HIS A 61 3721 3009 2638 0 310 265 C ATOM 785 CE1 HIS A 61 -26.556 -14.919 -0.831 1.00 26.03 C ANISOU 785 CE1 HIS A 61 4105 3203 2583 4 257 283 C ATOM 786 NE2 HIS A 61 -27.379 -14.890 -1.859 1.00 23.45 N ANISOU 786 NE2 HIS A 61 3631 2887 2394 -6 331 236 N ATOM 0 H HIS A 61 -24.753 -20.069 -3.379 1.00 18.55 H new ATOM 0 HA HIS A 61 -27.069 -18.698 -3.689 1.00 18.27 H new ATOM 0 HB2 HIS A 61 -26.136 -18.807 -1.596 1.00 19.42 H new ATOM 0 HB3 HIS A 61 -24.823 -18.148 -2.120 1.00 19.42 H new ATOM 0 HD2 HIS A 61 -27.710 -16.288 -3.347 1.00 24.66 H new ATOM 0 HE1 HIS A 61 -26.448 -14.242 -0.203 1.00 26.03 H new ATOM 0 HE2 HIS A 61 -27.910 -14.243 -2.054 1.00 23.45 H new ATOM 794 N VAL A 62 -26.473 -17.314 -5.620 1.00 17.18 N ANISOU 794 N VAL A 62 2519 2054 1953 35 193 215 N ATOM 795 CA VAL A 62 -26.082 -16.564 -6.792 1.00 16.40 C ANISOU 795 CA VAL A 62 2325 2004 1902 52 137 159 C ATOM 796 C VAL A 62 -26.458 -15.101 -6.625 1.00 15.51 C ANISOU 796 C VAL A 62 2188 1952 1755 45 140 121 C ATOM 797 O VAL A 62 -27.598 -14.767 -6.297 1.00 16.39 O ANISOU 797 O VAL A 62 2293 2062 1872 13 219 105 O ATOM 798 CB VAL A 62 -26.703 -17.132 -8.070 1.00 18.86 C ANISOU 798 CB VAL A 62 2568 2293 2304 26 160 115 C ATOM 799 CG1 VAL A 62 -26.372 -16.275 -9.260 1.00 21.24 C ANISOU 799 CG1 VAL A 62 2804 2640 2626 39 109 62 C ATOM 800 CG2 VAL A 62 -26.197 -18.554 -8.286 1.00 20.55 C ANISOU 800 CG2 VAL A 62 2817 2435 2557 37 162 143 C ATOM 0 H VAL A 62 -27.317 -17.472 -5.571 1.00 17.18 H new ATOM 0 HA VAL A 62 -25.119 -16.640 -6.881 1.00 16.40 H new ATOM 0 HB VAL A 62 -27.668 -17.141 -7.971 1.00 18.86 H new ATOM 0 HG11 VAL A 62 -26.776 -16.655 -10.055 1.00 21.24 H new ATOM 0 HG12 VAL A 62 -26.716 -15.379 -9.120 1.00 21.24 H new ATOM 0 HG13 VAL A 62 -25.409 -16.237 -9.374 1.00 21.24 H new ATOM 0 HG21 VAL A 62 -26.589 -18.918 -9.096 1.00 20.55 H new ATOM 0 HG22 VAL A 62 -25.231 -18.544 -8.371 1.00 20.55 H new ATOM 0 HG23 VAL A 62 -26.449 -19.106 -7.529 1.00 20.55 H new ATOM 810 N LEU A 63 -25.484 -14.239 -6.866 1.00 14.84 N ANISOU 810 N LEU A 63 2082 1906 1652 75 65 107 N ATOM 811 CA LEU A 63 -25.706 -12.795 -6.884 1.00 16.50 C ANISOU 811 CA LEU A 63 2266 2163 1842 72 62 67 C ATOM 812 C LEU A 63 -25.434 -12.313 -8.294 1.00 16.04 C ANISOU 812 C LEU A 63 2121 2129 1846 83 26 30 C ATOM 813 O LEU A 63 -24.345 -12.520 -8.812 1.00 17.24 O ANISOU 813 O LEU A 63 2255 2278 2018 108 -22 37 O ATOM 814 CB LEU A 63 -24.791 -12.084 -5.887 1.00 16.72 C ANISOU 814 CB LEU A 63 2359 2207 1786 86 1 82 C ATOM 815 CG LEU A 63 -24.913 -12.609 -4.452 1.00 19.94 C ANISOU 815 CG LEU A 63 2896 2584 2095 74 20 127 C ATOM 816 CD1 LEU A 63 -23.810 -12.054 -3.579 1.00 20.56 C ANISOU 816 CD1 LEU A 63 3051 2673 2088 84 -88 145 C ATOM 817 CD2 LEU A 63 -26.296 -12.262 -3.870 1.00 21.48 C ANISOU 817 CD2 LEU A 63 3135 2768 2258 41 150 105 C ATOM 0 H LEU A 63 -24.671 -14.471 -7.025 1.00 14.84 H new ATOM 0 HA LEU A 63 -26.618 -12.594 -6.623 1.00 16.50 H new ATOM 0 HB2 LEU A 63 -23.871 -12.179 -6.180 1.00 16.72 H new ATOM 0 HB3 LEU A 63 -24.994 -11.136 -5.894 1.00 16.72 H new ATOM 0 HG LEU A 63 -24.821 -13.574 -4.472 1.00 19.94 H new ATOM 0 HD11 LEU A 63 -23.906 -12.398 -2.677 1.00 20.56 H new ATOM 0 HD12 LEU A 63 -22.949 -12.321 -3.936 1.00 20.56 H new ATOM 0 HD13 LEU A 63 -23.866 -11.086 -3.562 1.00 20.56 H new ATOM 0 HD21 LEU A 63 -26.360 -12.600 -2.963 1.00 21.48 H new ATOM 0 HD22 LEU A 63 -26.413 -11.299 -3.865 1.00 21.48 H new ATOM 0 HD23 LEU A 63 -26.988 -12.668 -4.415 1.00 21.48 H new ATOM 829 N ALA A 64 -26.417 -11.662 -8.908 1.00 14.95 N ANISOU 829 N ALA A 64 1930 2005 1743 67 54 -6 N ATOM 830 CA ALA A 64 -26.253 -11.198 -10.276 1.00 16.52 C ANISOU 830 CA ALA A 64 2076 2220 1979 73 16 -34 C ATOM 831 C ALA A 64 -26.581 -9.708 -10.286 1.00 16.25 C ANISOU 831 C ALA A 64 2015 2214 1944 79 13 -55 C ATOM 832 O ALA A 64 -27.687 -9.335 -9.923 1.00 17.00 O ANISOU 832 O ALA A 64 2088 2305 2065 67 55 -63 O ATOM 833 CB ALA A 64 -27.137 -11.942 -11.262 1.00 17.62 C ANISOU 833 CB ALA A 64 2187 2338 2169 47 20 -50 C ATOM 0 H ALA A 64 -27.179 -11.481 -8.552 1.00 14.95 H new ATOM 0 HA ALA A 64 -25.341 -11.366 -10.562 1.00 16.52 H new ATOM 0 HB1 ALA A 64 -26.989 -11.595 -12.156 1.00 17.62 H new ATOM 0 HB2 ALA A 64 -26.920 -12.887 -11.243 1.00 17.62 H new ATOM 0 HB3 ALA A 64 -28.068 -11.820 -11.018 1.00 17.62 H new ATOM 839 N LEU A 65 -25.627 -8.896 -10.658 1.00 15.41 N ANISOU 839 N LEU A 65 1906 2124 1824 97 -25 -60 N ATOM 840 CA LEU A 65 -25.854 -7.452 -10.698 1.00 16.68 C ANISOU 840 CA LEU A 65 2049 2299 1989 103 -27 -79 C ATOM 841 C LEU A 65 -26.027 -6.944 -12.112 1.00 13.97 C ANISOU 841 C LEU A 65 1674 1959 1676 107 -53 -86 C ATOM 842 O LEU A 65 -25.483 -7.479 -13.067 1.00 14.59 O ANISOU 842 O LEU A 65 1762 2032 1749 107 -70 -83 O ATOM 843 CB LEU A 65 -24.712 -6.669 -10.025 1.00 18.77 C ANISOU 843 CB LEU A 65 2340 2570 2220 110 -53 -80 C ATOM 844 CG LEU A 65 -23.340 -6.612 -10.688 1.00 22.37 C ANISOU 844 CG LEU A 65 2776 3027 2696 119 -93 -72 C ATOM 845 CD1 LEU A 65 -22.592 -5.344 -10.324 1.00 22.09 C ANISOU 845 CD1 LEU A 65 2739 2992 2663 114 -121 -84 C ATOM 846 CD2 LEU A 65 -22.570 -7.799 -10.223 1.00 24.68 C ANISOU 846 CD2 LEU A 65 3080 3310 2987 126 -115 -45 C ATOM 0 H LEU A 65 -24.838 -9.146 -10.893 1.00 15.41 H new ATOM 0 HA LEU A 65 -26.675 -7.302 -10.204 1.00 16.68 H new ATOM 0 HB2 LEU A 65 -25.016 -5.755 -9.910 1.00 18.77 H new ATOM 0 HB3 LEU A 65 -24.590 -7.041 -9.138 1.00 18.77 H new ATOM 0 HG LEU A 65 -23.448 -6.614 -11.652 1.00 22.37 H new ATOM 0 HD11 LEU A 65 -21.726 -5.342 -10.762 1.00 22.09 H new ATOM 0 HD12 LEU A 65 -23.103 -4.572 -10.614 1.00 22.09 H new ATOM 0 HD13 LEU A 65 -22.468 -5.306 -9.363 1.00 22.09 H new ATOM 0 HD21 LEU A 65 -21.689 -7.792 -10.628 1.00 24.68 H new ATOM 0 HD22 LEU A 65 -22.482 -7.770 -9.257 1.00 24.68 H new ATOM 0 HD23 LEU A 65 -23.037 -8.609 -10.480 1.00 24.68 H new ATOM 858 N ASP A 66 -26.783 -5.850 -12.228 1.00 12.33 N ANISOU 858 N ASP A 66 1440 1750 1497 113 -51 -94 N ATOM 859 CA ASP A 66 -26.684 -4.984 -13.406 1.00 13.15 C ANISOU 859 CA ASP A 66 1537 1851 1610 123 -87 -90 C ATOM 860 C ASP A 66 -25.531 -4.001 -13.152 1.00 15.29 C ANISOU 860 C ASP A 66 1828 2120 1862 131 -80 -93 C ATOM 861 O ASP A 66 -25.529 -3.296 -12.149 1.00 14.09 O ANISOU 861 O ASP A 66 1680 1964 1712 133 -61 -107 O ATOM 862 CB ASP A 66 -27.984 -4.237 -13.635 1.00 13.20 C ANISOU 862 CB ASP A 66 1497 1843 1676 133 -99 -86 C ATOM 863 CG ASP A 66 -29.100 -5.103 -14.130 1.00 15.50 C ANISOU 863 CG ASP A 66 1748 2129 2012 116 -132 -81 C ATOM 864 OD1 ASP A 66 -28.813 -5.968 -15.006 1.00 18.01 O ANISOU 864 OD1 ASP A 66 2102 2450 2292 97 -172 -81 O ATOM 865 OD2 ASP A 66 -30.259 -4.969 -13.713 1.00 16.43 O ANISOU 865 OD2 ASP A 66 1798 2231 2212 119 -115 -80 O ATOM 0 H ASP A 66 -27.356 -5.593 -11.640 1.00 12.33 H new ATOM 0 HA ASP A 66 -26.514 -5.511 -14.202 1.00 13.15 H new ATOM 0 HB2 ASP A 66 -28.256 -3.817 -12.804 1.00 13.20 H new ATOM 0 HB3 ASP A 66 -27.830 -3.525 -14.276 1.00 13.20 H new ATOM 870 N LEU A 67 -24.520 -4.009 -14.007 1.00 15.62 N ANISOU 870 N LEU A 67 1886 2158 1889 130 -87 -84 N ATOM 871 CA LEU A 67 -23.495 -2.975 -13.928 1.00 16.52 C ANISOU 871 CA LEU A 67 2001 2262 2016 129 -79 -84 C ATOM 872 C LEU A 67 -24.126 -1.608 -14.153 1.00 16.23 C ANISOU 872 C LEU A 67 1965 2204 1997 138 -81 -82 C ATOM 873 O LEU A 67 -25.165 -1.482 -14.774 1.00 15.06 O ANISOU 873 O LEU A 67 1814 2050 1856 150 -99 -70 O ATOM 874 CB LEU A 67 -22.423 -3.211 -14.976 1.00 17.75 C ANISOU 874 CB LEU A 67 2167 2403 2172 126 -57 -70 C ATOM 875 CG LEU A 67 -21.505 -4.418 -14.715 1.00 17.84 C ANISOU 875 CG LEU A 67 2163 2418 2199 127 -44 -69 C ATOM 876 CD1 LEU A 67 -20.613 -4.629 -15.933 1.00 18.29 C ANISOU 876 CD1 LEU A 67 2235 2447 2269 130 14 -60 C ATOM 877 CD2 LEU A 67 -20.645 -4.202 -13.489 1.00 18.88 C ANISOU 877 CD2 LEU A 67 2255 2551 2367 122 -73 -71 C ATOM 0 H LEU A 67 -24.407 -4.591 -14.630 1.00 15.62 H new ATOM 0 HA LEU A 67 -23.089 -3.008 -13.047 1.00 16.52 H new ATOM 0 HB2 LEU A 67 -22.854 -3.331 -15.837 1.00 17.75 H new ATOM 0 HB3 LEU A 67 -21.874 -2.414 -15.042 1.00 17.75 H new ATOM 0 HG LEU A 67 -22.057 -5.200 -14.558 1.00 17.84 H new ATOM 0 HD11 LEU A 67 -20.029 -5.388 -15.779 1.00 18.29 H new ATOM 0 HD12 LEU A 67 -21.165 -4.798 -16.713 1.00 18.29 H new ATOM 0 HD13 LEU A 67 -20.077 -3.835 -16.083 1.00 18.29 H new ATOM 0 HD21 LEU A 67 -20.079 -4.977 -13.350 1.00 18.88 H new ATOM 0 HD22 LEU A 67 -20.091 -3.416 -13.616 1.00 18.88 H new ATOM 0 HD23 LEU A 67 -21.213 -4.074 -12.713 1.00 18.88 H new ATOM 889 N ARG A 68 -23.424 -0.588 -13.696 1.00 15.98 N ANISOU 889 N ARG A 68 1934 2154 1984 130 -72 -93 N ATOM 890 CA ARG A 68 -23.862 0.779 -13.909 1.00 15.61 C ANISOU 890 CA ARG A 68 1894 2072 1966 140 -65 -90 C ATOM 891 C ARG A 68 -24.277 0.988 -15.364 1.00 15.95 C ANISOU 891 C ARG A 68 1957 2100 2003 155 -78 -50 C ATOM 892 O ARG A 68 -23.624 0.514 -16.301 1.00 15.15 O ANISOU 892 O ARG A 68 1885 2002 1870 144 -69 -31 O ATOM 893 CB ARG A 68 -22.742 1.751 -13.569 1.00 13.72 C ANISOU 893 CB ARG A 68 1659 1802 1750 117 -55 -104 C ATOM 894 CG ARG A 68 -21.451 1.534 -14.331 1.00 13.03 C ANISOU 894 CG ARG A 68 1561 1710 1679 98 -41 -83 C ATOM 895 CD ARG A 68 -20.352 2.477 -13.900 1.00 14.86 C ANISOU 895 CD ARG A 68 1774 1906 1967 64 -38 -98 C ATOM 896 NE ARG A 68 -20.244 2.439 -12.451 1.00 14.81 N ANISOU 896 NE ARG A 68 1766 1910 1952 47 -86 -140 N ATOM 897 CZ ARG A 68 -20.061 3.476 -11.665 1.00 16.74 C ANISOU 897 CZ ARG A 68 2030 2118 2213 20 -103 -175 C ATOM 898 NH1 ARG A 68 -19.801 4.685 -12.167 1.00 17.19 N ANISOU 898 NH1 ARG A 68 2090 2120 2322 5 -75 -173 N ATOM 899 NH2 ARG A 68 -20.105 3.299 -10.351 1.00 16.32 N ANISOU 899 NH2 ARG A 68 2010 2074 2115 3 -149 -215 N ATOM 0 H ARG A 68 -22.688 -0.665 -13.258 1.00 15.98 H new ATOM 0 HA ARG A 68 -24.623 0.944 -13.331 1.00 15.61 H new ATOM 0 HB2 ARG A 68 -23.053 2.654 -13.738 1.00 13.72 H new ATOM 0 HB3 ARG A 68 -22.555 1.689 -12.619 1.00 13.72 H new ATOM 0 HG2 ARG A 68 -21.155 0.619 -14.204 1.00 13.03 H new ATOM 0 HG3 ARG A 68 -21.617 1.649 -15.280 1.00 13.03 H new ATOM 0 HD2 ARG A 68 -19.510 2.219 -14.306 1.00 14.86 H new ATOM 0 HD3 ARG A 68 -20.547 3.379 -14.199 1.00 14.86 H new ATOM 0 HE ARG A 68 -20.305 1.668 -12.074 1.00 14.81 H new ATOM 0 HH11 ARG A 68 -19.751 4.795 -13.018 1.00 17.19 H new ATOM 0 HH12 ARG A 68 -19.684 5.354 -11.639 1.00 17.19 H new ATOM 0 HH21 ARG A 68 -20.251 2.516 -10.027 1.00 16.32 H new ATOM 0 HH22 ARG A 68 -19.987 3.967 -9.823 1.00 16.32 H new ATOM 913 N GLY A 69 -25.382 1.716 -15.535 1.00 15.27 N ANISOU 913 N GLY A 69 1863 1990 1950 180 -96 -36 N ATOM 914 CA GLY A 69 -25.846 2.120 -16.842 1.00 16.72 C ANISOU 914 CA GLY A 69 2079 2149 2125 196 -136 11 C ATOM 915 C GLY A 69 -26.591 1.075 -17.614 1.00 18.38 C ANISOU 915 C GLY A 69 2298 2385 2301 196 -196 28 C ATOM 916 O GLY A 69 -27.084 1.371 -18.705 1.00 18.35 O ANISOU 916 O GLY A 69 2336 2359 2277 206 -258 70 O ATOM 0 H GLY A 69 -25.879 1.986 -14.887 1.00 15.27 H new ATOM 0 HA2 GLY A 69 -26.421 2.894 -16.739 1.00 16.72 H new ATOM 0 HA3 GLY A 69 -25.081 2.403 -17.366 1.00 16.72 H new ATOM 920 N ARG A 70 -26.656 -0.167 -17.102 1.00 18.92 N ANISOU 920 N ARG A 70 2340 2492 2358 180 -190 -2 N ATOM 921 CA ARG A 70 -27.352 -1.293 -17.732 1.00 19.49 C ANISOU 921 CA ARG A 70 2418 2581 2406 167 -246 1 C ATOM 922 C ARG A 70 -28.504 -1.725 -16.822 1.00 19.30 C ANISOU 922 C ARG A 70 2306 2567 2462 172 -254 -15 C ATOM 923 O ARG A 70 -28.499 -1.497 -15.605 1.00 15.37 O ANISOU 923 O ARG A 70 1768 2070 2001 180 -191 -38 O ATOM 924 CB ARG A 70 -26.367 -2.476 -17.999 1.00 18.01 C ANISOU 924 CB ARG A 70 2282 2412 2150 141 -210 -19 C ATOM 925 CG ARG A 70 -25.646 -2.416 -19.372 1.00 19.74 C ANISOU 925 CG ARG A 70 2606 2609 2285 130 -202 0 C ATOM 926 CD ARG A 70 -24.837 -1.125 -19.679 1.00 23.47 C ANISOU 926 CD ARG A 70 3112 3053 2754 139 -156 26 C ATOM 927 NE ARG A 70 -23.783 -0.864 -18.733 1.00 23.61 N ANISOU 927 NE ARG A 70 3074 3074 2823 137 -84 7 N ATOM 928 CZ ARG A 70 -22.557 -1.366 -18.765 1.00 24.37 C ANISOU 928 CZ ARG A 70 3172 3166 2919 124 -15 -4 C ATOM 929 NH1 ARG A 70 -22.173 -2.199 -19.731 1.00 24.26 N ANISOU 929 NH1 ARG A 70 3227 3140 2849 115 24 -4 N ATOM 930 NH2 ARG A 70 -21.698 -1.054 -17.795 1.00 24.30 N ANISOU 930 NH2 ARG A 70 3097 3159 2977 119 14 -18 N ATOM 0 H ARG A 70 -26.283 -0.378 -16.356 1.00 18.92 H new ATOM 0 HA ARG A 70 -27.707 -1.019 -18.592 1.00 19.49 H new ATOM 0 HB2 ARG A 70 -25.699 -2.490 -17.296 1.00 18.01 H new ATOM 0 HB3 ARG A 70 -26.858 -3.310 -17.941 1.00 18.01 H new ATOM 0 HG2 ARG A 70 -25.042 -3.173 -19.430 1.00 19.74 H new ATOM 0 HG3 ARG A 70 -26.311 -2.529 -20.069 1.00 19.74 H new ATOM 0 HD2 ARG A 70 -24.453 -1.197 -20.567 1.00 23.47 H new ATOM 0 HD3 ARG A 70 -25.444 -0.368 -19.692 1.00 23.47 H new ATOM 0 HE ARG A 70 -23.967 -0.330 -18.084 1.00 23.61 H new ATOM 0 HH11 ARG A 70 -22.725 -2.422 -20.351 1.00 24.26 H new ATOM 0 HH12 ARG A 70 -21.373 -2.514 -19.734 1.00 24.26 H new ATOM 0 HH21 ARG A 70 -21.941 -0.532 -17.157 1.00 24.30 H new ATOM 0 HH22 ARG A 70 -20.900 -1.375 -17.807 1.00 24.30 H new ATOM 944 N GLY A 71 -29.544 -2.308 -17.429 1.00 21.74 N ANISOU 944 N GLY A 71 2589 2873 2797 163 -331 -3 N ATOM 945 CA GLY A 71 -30.603 -2.895 -16.624 1.00 19.45 C ANISOU 945 CA GLY A 71 2205 2585 2601 158 -320 -18 C ATOM 946 C GLY A 71 -31.212 -1.908 -15.669 1.00 17.99 C ANISOU 946 C GLY A 71 1942 2376 2516 193 -262 -19 C ATOM 947 O GLY A 71 -31.609 -0.785 -16.050 1.00 19.60 O ANISOU 947 O GLY A 71 2122 2548 2775 227 -296 9 O ATOM 0 H GLY A 71 -29.649 -2.370 -18.280 1.00 21.74 H new ATOM 0 HA2 GLY A 71 -31.294 -3.244 -17.208 1.00 19.45 H new ATOM 0 HA3 GLY A 71 -30.247 -3.647 -16.125 1.00 19.45 H new ATOM 951 N GLU A 72 -31.311 -2.299 -14.398 1.00 15.40 N ANISOU 951 N GLU A 72 1587 2053 2211 187 -164 -48 N ATOM 952 CA GLU A 72 -31.975 -1.489 -13.384 1.00 18.62 C ANISOU 952 CA GLU A 72 1939 2427 2708 216 -77 -61 C ATOM 953 C GLU A 72 -31.016 -0.656 -12.563 1.00 17.81 C ANISOU 953 C GLU A 72 1911 2318 2536 225 -5 -88 C ATOM 954 O GLU A 72 -31.428 -0.103 -11.520 1.00 17.75 O ANISOU 954 O GLU A 72 1895 2278 2569 241 92 -114 O ATOM 955 CB GLU A 72 -32.799 -2.399 -12.478 1.00 20.38 C ANISOU 955 CB GLU A 72 2106 2645 2992 197 2 -77 C ATOM 956 CG GLU A 72 -33.946 -3.087 -13.247 1.00 22.61 C ANISOU 956 CG GLU A 72 2283 2917 3391 182 -76 -53 C ATOM 957 CD GLU A 72 -34.595 -4.254 -12.500 1.00 26.62 C ANISOU 957 CD GLU A 72 2743 3418 3954 145 2 -66 C ATOM 958 OE1 GLU A 72 -34.774 -4.154 -11.280 1.00 29.02 O ANISOU 958 OE1 GLU A 72 3052 3702 4272 151 144 -84 O ATOM 959 OE2 GLU A 72 -34.966 -5.259 -13.154 1.00 28.85 O ANISOU 959 OE2 GLU A 72 2991 3706 4264 106 -77 -57 O ATOM 0 H GLU A 72 -30.994 -3.042 -14.102 1.00 15.40 H new ATOM 0 HA GLU A 72 -32.550 -0.859 -13.846 1.00 18.62 H new ATOM 0 HB2 GLU A 72 -32.222 -3.073 -12.086 1.00 20.38 H new ATOM 0 HB3 GLU A 72 -33.166 -1.880 -11.746 1.00 20.38 H new ATOM 0 HG2 GLU A 72 -34.628 -2.427 -13.449 1.00 22.61 H new ATOM 0 HG3 GLU A 72 -33.604 -3.410 -14.095 1.00 22.61 H new ATOM 966 N SER A 73 -29.757 -0.584 -12.947 1.00 16.36 N ANISOU 966 N SER A 73 1804 2158 2254 211 -41 -88 N ATOM 967 CA SER A 73 -28.804 0.215 -12.184 1.00 14.79 C ANISOU 967 CA SER A 73 1666 1948 2005 208 5 -115 C ATOM 968 C SER A 73 -28.750 1.649 -12.673 1.00 14.00 C ANISOU 968 C SER A 73 1568 1805 1946 234 -6 -104 C ATOM 969 O SER A 73 -29.313 2.037 -13.710 1.00 15.25 O ANISOU 969 O SER A 73 1693 1944 2157 259 -60 -64 O ATOM 970 CB SER A 73 -27.427 -0.448 -12.269 1.00 15.46 C ANISOU 970 CB SER A 73 1805 2070 2000 178 -24 -117 C ATOM 971 OG SER A 73 -27.454 -1.636 -11.505 1.00 15.15 O ANISOU 971 OG SER A 73 1776 2055 1926 160 -3 -127 O ATOM 0 H SER A 73 -29.431 -0.982 -13.636 1.00 16.36 H new ATOM 0 HA SER A 73 -29.094 0.251 -11.259 1.00 14.79 H new ATOM 0 HB2 SER A 73 -27.204 -0.646 -13.192 1.00 15.46 H new ATOM 0 HB3 SER A 73 -26.742 0.152 -11.935 1.00 15.46 H new ATOM 0 HG SER A 73 -26.816 -2.132 -11.735 1.00 15.15 H new ATOM 977 N GLY A 74 -28.060 2.472 -11.889 1.00 13.63 N ANISOU 977 N GLY A 74 1571 1733 1874 226 38 -138 N ATOM 978 CA GLY A 74 -28.083 3.908 -12.148 1.00 15.16 C ANISOU 978 CA GLY A 74 1772 1866 2120 250 49 -134 C ATOM 979 C GLY A 74 -27.474 4.281 -13.484 1.00 15.76 C ANISOU 979 C GLY A 74 1864 1939 2187 249 -15 -86 C ATOM 980 O GLY A 74 -26.506 3.669 -13.951 1.00 14.92 O ANISOU 980 O GLY A 74 1784 1870 2014 218 -43 -76 O ATOM 0 H GLY A 74 -27.583 2.227 -11.217 1.00 13.63 H new ATOM 0 HA2 GLY A 74 -29.000 4.222 -12.118 1.00 15.16 H new ATOM 0 HA3 GLY A 74 -27.603 4.366 -11.441 1.00 15.16 H new ATOM 984 N ARG A 75 -27.962 5.384 -14.044 1.00 17.90 N ANISOU 984 N ARG A 75 2127 2151 2525 284 -22 -55 N ATOM 985 CA ARG A 75 -27.405 5.856 -15.303 1.00 26.46 C ANISOU 985 CA ARG A 75 3251 3216 3585 282 -69 0 C ATOM 986 C ARG A 75 -26.099 6.591 -15.029 1.00 19.40 C ANISOU 986 C ARG A 75 2408 2294 2668 245 -26 -24 C ATOM 987 O ARG A 75 -25.878 7.118 -13.930 1.00 21.50 O ANISOU 987 O ARG A 75 2681 2533 2955 232 20 -80 O ATOM 988 CB ARG A 75 -28.382 6.771 -16.034 1.00 53.84 C ANISOU 988 CB ARG A 75 6701 6621 7134 334 -108 56 C ATOM 989 CG ARG A 75 -29.720 6.106 -16.362 1.00 88.87 C ANISOU 989 CG ARG A 75 11063 11077 11628 368 -176 86 C ATOM 990 CD ARG A 75 -29.615 4.589 -16.374 1.00120.28 C ANISOU 990 CD ARG A 75 15033 15134 15533 329 -201 65 C ATOM 991 NE ARG A 75 -30.668 3.920 -17.129 1.00147.93 N ANISOU 991 NE ARG A 75 18487 18651 19070 341 -300 104 N ATOM 992 CZ ARG A 75 -31.019 2.657 -16.934 1.00168.63 C ANISOU 992 CZ ARG A 75 21071 21321 21681 314 -315 81 C ATOM 993 NH1 ARG A 75 -30.412 1.943 -15.996 1.00179.01 N ANISOU 993 NH1 ARG A 75 22396 22673 22946 283 -232 28 N ATOM 994 NH2 ARG A 75 -31.978 2.104 -17.661 1.00167.85 N ANISOU 994 NH2 ARG A 75 20925 21225 21625 315 -422 113 N ATOM 0 H ARG A 75 -28.599 5.862 -13.720 1.00 17.90 H new ATOM 0 HA ARG A 75 -27.237 5.090 -15.874 1.00 26.46 H new ATOM 0 HB2 ARG A 75 -28.546 7.557 -15.490 1.00 53.84 H new ATOM 0 HB3 ARG A 75 -27.971 7.077 -16.858 1.00 53.84 H new ATOM 0 HG2 ARG A 75 -30.384 6.378 -15.709 1.00 88.87 H new ATOM 0 HG3 ARG A 75 -30.030 6.415 -17.228 1.00 88.87 H new ATOM 0 HD2 ARG A 75 -28.755 4.338 -16.746 1.00120.28 H new ATOM 0 HD3 ARG A 75 -29.633 4.267 -15.459 1.00120.28 H new ATOM 0 HE ARG A 75 -31.084 4.369 -17.733 1.00147.93 H new ATOM 0 HH11 ARG A 75 -29.793 2.300 -15.517 1.00179.01 H new ATOM 0 HH12 ARG A 75 -30.637 1.123 -15.867 1.00179.01 H new ATOM 0 HH21 ARG A 75 -32.379 2.565 -18.266 1.00167.85 H new ATOM 0 HH22 ARG A 75 -32.200 1.284 -17.528 1.00167.85 H new ATOM 1008 N VAL A 76 -25.236 6.592 -16.038 1.00 15.11 N ANISOU 1008 N VAL A 76 1907 1752 2083 222 -39 15 N ATOM 1009 CA VAL A 76 -23.909 7.151 -15.974 1.00 16.52 C ANISOU 1009 CA VAL A 76 2114 1903 2262 178 2 2 C ATOM 1010 C VAL A 76 -23.747 8.166 -17.096 1.00 17.65 C ANISOU 1010 C VAL A 76 2310 1977 2419 185 15 65 C ATOM 1011 O VAL A 76 -23.708 9.383 -16.858 1.00 18.61 O ANISOU 1011 O VAL A 76 2446 2023 2602 188 43 63 O ATOM 1012 CB VAL A 76 -22.850 6.055 -16.079 1.00 21.66 C ANISOU 1012 CB VAL A 76 2755 2611 2865 139 8 -9 C ATOM 1013 CG1 VAL A 76 -21.455 6.589 -15.830 1.00 19.39 C ANISOU 1013 CG1 VAL A 76 2459 2291 2618 88 46 -27 C ATOM 1014 CG2 VAL A 76 -23.153 4.923 -15.115 1.00 26.88 C ANISOU 1014 CG2 VAL A 76 3378 3336 3501 139 -15 -52 C ATOM 0 H VAL A 76 -25.422 6.252 -16.806 1.00 15.11 H new ATOM 0 HA VAL A 76 -23.787 7.592 -15.119 1.00 16.52 H new ATOM 0 HB VAL A 76 -22.880 5.716 -16.987 1.00 21.66 H new ATOM 0 HG11 VAL A 76 -20.813 5.866 -15.905 1.00 19.39 H new ATOM 0 HG12 VAL A 76 -21.248 7.273 -16.486 1.00 19.39 H new ATOM 0 HG13 VAL A 76 -21.409 6.971 -14.939 1.00 19.39 H new ATOM 0 HG21 VAL A 76 -22.471 4.238 -15.196 1.00 26.88 H new ATOM 0 HG22 VAL A 76 -23.162 5.264 -14.207 1.00 26.88 H new ATOM 0 HG23 VAL A 76 -24.020 4.542 -15.325 1.00 26.88 H new ATOM 1024 N GLY A 77 -23.671 7.694 -18.331 1.00 20.14 N ANISOU 1024 N GLY A 77 2675 2308 2671 187 -1 122 N ATOM 1025 CA GLY A 77 -23.715 8.635 -19.456 1.00 22.83 C ANISOU 1025 CA GLY A 77 3097 2577 3001 200 4 197 C ATOM 1026 C GLY A 77 -22.438 9.422 -19.690 1.00 21.58 C ANISOU 1026 C GLY A 77 2975 2359 2867 153 93 207 C ATOM 1027 O GLY A 77 -22.452 10.368 -20.498 1.00 21.07 O ANISOU 1027 O GLY A 77 2987 2218 2803 161 112 272 O ATOM 0 H GLY A 77 -23.596 6.864 -18.542 1.00 20.14 H new ATOM 0 HA2 GLY A 77 -23.927 8.142 -20.264 1.00 22.83 H new ATOM 0 HA3 GLY A 77 -24.441 9.261 -19.308 1.00 22.83 H new ATOM 1031 N THR A 78 -21.372 9.101 -18.995 1.00 18.76 N ANISOU 1031 N THR A 78 2561 2025 2544 105 141 151 N ATOM 1032 CA THR A 78 -20.051 9.686 -19.240 1.00 17.50 C ANISOU 1032 CA THR A 78 2405 1808 2435 50 228 158 C ATOM 1033 C THR A 78 -19.037 8.577 -19.460 1.00 17.41 C ANISOU 1033 C THR A 78 2358 1847 2408 17 275 145 C ATOM 1034 O THR A 78 -19.179 7.441 -18.932 1.00 16.27 O ANISOU 1034 O THR A 78 2164 1781 2238 28 230 106 O ATOM 1035 CB THR A 78 -19.563 10.538 -18.067 1.00 19.00 C ANISOU 1035 CB THR A 78 2535 1955 2730 12 231 98 C ATOM 1036 OG1 THR A 78 -19.303 9.666 -16.951 1.00 17.56 O ANISOU 1036 OG1 THR A 78 2276 1844 2552 -5 185 27 O ATOM 1037 CG2 THR A 78 -20.587 11.611 -17.693 1.00 19.38 C ANISOU 1037 CG2 THR A 78 2615 1942 2808 50 203 96 C ATOM 0 H THR A 78 -21.383 8.528 -18.354 1.00 18.76 H new ATOM 0 HA THR A 78 -20.135 10.253 -20.022 1.00 17.50 H new ATOM 0 HB THR A 78 -18.750 11.002 -18.321 1.00 19.00 H new ATOM 0 HG1 THR A 78 -19.032 10.120 -16.298 1.00 17.56 H new ATOM 0 HG21 THR A 78 -20.251 12.134 -16.948 1.00 19.38 H new ATOM 0 HG22 THR A 78 -20.739 12.193 -18.454 1.00 19.38 H new ATOM 0 HG23 THR A 78 -21.422 11.187 -17.439 1.00 19.38 H new ATOM 1045 N ALA A 79 -17.977 8.907 -20.225 1.00 17.37 N ANISOU 1045 N ALA A 79 2376 1787 2436 -23 381 180 N ATOM 1046 CA ALA A 79 -16.912 7.943 -20.462 1.00 16.43 C ANISOU 1046 CA ALA A 79 2208 1694 2339 -51 454 168 C ATOM 1047 C ALA A 79 -16.168 7.584 -19.174 1.00 16.48 C ANISOU 1047 C ALA A 79 2071 1733 2456 -81 410 102 C ATOM 1048 O ALA A 79 -15.899 6.411 -18.903 1.00 14.18 O ANISOU 1048 O ALA A 79 1724 1500 2162 -71 392 78 O ATOM 1049 CB ALA A 79 -15.930 8.458 -21.512 1.00 18.15 C ANISOU 1049 CB ALA A 79 2474 1830 2592 -89 606 220 C ATOM 0 H ALA A 79 -17.867 9.671 -20.604 1.00 17.37 H new ATOM 0 HA ALA A 79 -17.332 7.135 -20.797 1.00 16.43 H new ATOM 0 HB1 ALA A 79 -15.231 7.800 -21.652 1.00 18.15 H new ATOM 0 HB2 ALA A 79 -16.400 8.613 -22.346 1.00 18.15 H new ATOM 0 HB3 ALA A 79 -15.534 9.289 -21.205 1.00 18.15 H new ATOM 1055 N GLU A 80 -15.740 8.585 -18.404 1.00 16.96 N ANISOU 1055 N GLU A 80 2078 1745 2621 -122 388 74 N ATOM 1056 CA GLU A 80 -14.957 8.273 -17.215 1.00 19.90 C ANISOU 1056 CA GLU A 80 2329 2141 3090 -160 321 16 C ATOM 1057 C GLU A 80 -15.786 7.554 -16.187 1.00 17.11 C ANISOU 1057 C GLU A 80 1977 1866 2658 -125 205 -30 C ATOM 1058 O GLU A 80 -15.262 6.774 -15.370 1.00 16.99 O ANISOU 1058 O GLU A 80 1886 1893 2675 -138 140 -62 O ATOM 1059 CB GLU A 80 -14.390 9.573 -16.608 1.00 29.73 C ANISOU 1059 CB GLU A 80 3538 3306 4450 -224 306 -12 C ATOM 1060 CG GLU A 80 -13.361 9.316 -15.503 1.00 51.47 C ANISOU 1060 CG GLU A 80 6168 6069 7320 -280 220 -66 C ATOM 1061 CD GLU A 80 -12.005 8.874 -16.043 1.00 69.23 C ANISOU 1061 CD GLU A 80 8295 8296 9714 -315 297 -36 C ATOM 1062 OE1 GLU A 80 -11.767 7.655 -16.157 1.00 73.48 O ANISOU 1062 OE1 GLU A 80 8783 8890 10245 -281 300 -24 O ATOM 1063 OE2 GLU A 80 -11.174 9.754 -16.356 1.00 76.16 O ANISOU 1063 OE2 GLU A 80 9122 9086 10728 -377 366 -23 O ATOM 0 H GLU A 80 -15.886 9.420 -18.546 1.00 16.96 H new ATOM 0 HA GLU A 80 -14.229 7.689 -17.479 1.00 19.90 H new ATOM 0 HB2 GLU A 80 -13.978 10.100 -17.311 1.00 29.73 H new ATOM 0 HB3 GLU A 80 -15.119 10.101 -16.248 1.00 29.73 H new ATOM 0 HG2 GLU A 80 -13.247 10.125 -14.980 1.00 51.47 H new ATOM 0 HG3 GLU A 80 -13.702 8.635 -14.902 1.00 51.47 H new ATOM 1070 N GLY A 81 -17.096 7.795 -16.174 1.00 15.97 N ANISOU 1070 N GLY A 81 1914 1734 2418 -80 176 -28 N ATOM 1071 CA GLY A 81 -17.970 7.074 -15.295 1.00 14.72 C ANISOU 1071 CA GLY A 81 1760 1642 2189 -47 97 -65 C ATOM 1072 C GLY A 81 -18.025 5.590 -15.590 1.00 15.06 C ANISOU 1072 C GLY A 81 1785 1756 2179 -19 92 -51 C ATOM 1073 O GLY A 81 -18.446 4.812 -14.723 1.00 16.26 O ANISOU 1073 O GLY A 81 1925 1961 2290 -4 32 -81 O ATOM 0 H GLY A 81 -17.487 8.376 -16.673 1.00 15.97 H new ATOM 0 HA2 GLY A 81 -17.677 7.205 -14.379 1.00 14.72 H new ATOM 0 HA3 GLY A 81 -18.864 7.444 -15.363 1.00 14.72 H new ATOM 1077 N HIS A 82 -17.628 5.181 -16.788 1.00 13.64 N ANISOU 1077 N HIS A 82 1620 1570 1991 -13 165 -7 N ATOM 1078 CA HIS A 82 -17.534 3.770 -17.172 1.00 14.52 C ANISOU 1078 CA HIS A 82 1725 1731 2062 8 179 1 C ATOM 1079 C HIS A 82 -16.107 3.229 -17.143 1.00 16.67 C ANISOU 1079 C HIS A 82 1907 1991 2435 -17 226 -1 C ATOM 1080 O HIS A 82 -15.814 2.170 -17.712 1.00 18.36 O ANISOU 1080 O HIS A 82 2120 2219 2638 1 279 10 O ATOM 1081 CB HIS A 82 -18.133 3.550 -18.575 1.00 14.43 C ANISOU 1081 CB HIS A 82 1814 1712 1956 33 232 43 C ATOM 1082 CG HIS A 82 -19.634 3.531 -18.595 1.00 15.35 C ANISOU 1082 CG HIS A 82 1988 1857 1988 69 154 48 C ATOM 1083 ND1 HIS A 82 -20.353 2.370 -18.411 1.00 15.05 N ANISOU 1083 ND1 HIS A 82 1949 1874 1897 90 104 31 N ATOM 1084 CD2 HIS A 82 -20.549 4.509 -18.792 1.00 15.37 C ANISOU 1084 CD2 HIS A 82 2036 1830 1973 87 120 71 C ATOM 1085 CE1 HIS A 82 -21.646 2.630 -18.487 1.00 15.16 C ANISOU 1085 CE1 HIS A 82 1992 1894 1873 116 41 42 C ATOM 1086 NE2 HIS A 82 -21.798 3.921 -18.735 1.00 15.49 N ANISOU 1086 NE2 HIS A 82 2061 1886 1938 120 47 68 N ATOM 0 H HIS A 82 -17.400 5.723 -17.416 1.00 13.64 H new ATOM 0 HA HIS A 82 -18.043 3.279 -16.508 1.00 14.52 H new ATOM 0 HB2 HIS A 82 -17.819 4.252 -19.166 1.00 14.43 H new ATOM 0 HB3 HIS A 82 -17.802 2.711 -18.931 1.00 14.43 H new ATOM 0 HD2 HIS A 82 -20.370 5.410 -18.939 1.00 15.37 H new ATOM 0 HE1 HIS A 82 -22.333 2.011 -18.384 1.00 15.16 H new ATOM 0 HE2 HIS A 82 -22.549 4.326 -18.843 1.00 15.49 H new ATOM 1094 N ALA A 83 -15.178 3.938 -16.508 1.00 17.34 N ANISOU 1094 N ALA A 83 1911 2040 2637 -60 210 -16 N ATOM 1095 CA ALA A 83 -13.862 3.385 -16.316 1.00 16.22 C ANISOU 1095 CA ALA A 83 1650 1885 2627 -81 228 -15 C ATOM 1096 C ALA A 83 -13.936 2.055 -15.582 1.00 15.77 C ANISOU 1096 C ALA A 83 1556 1887 2549 -50 148 -29 C ATOM 1097 O ALA A 83 -14.765 1.849 -14.722 1.00 15.80 O ANISOU 1097 O ALA A 83 1603 1936 2465 -37 51 -53 O ATOM 1098 CB ALA A 83 -12.998 4.366 -15.542 1.00 19.68 C ANISOU 1098 CB ALA A 83 2002 2278 3199 -141 174 -36 C ATOM 0 H ALA A 83 -15.295 4.728 -16.188 1.00 17.34 H new ATOM 0 HA ALA A 83 -13.463 3.228 -17.186 1.00 16.22 H new ATOM 0 HB1 ALA A 83 -12.113 3.989 -15.416 1.00 19.68 H new ATOM 0 HB2 ALA A 83 -12.927 5.196 -16.038 1.00 19.68 H new ATOM 0 HB3 ALA A 83 -13.401 4.540 -14.677 1.00 19.68 H new ATOM 1104 N LEU A 84 -12.933 1.195 -15.863 1.00 20.19 N ANISOU 1104 N LEU A 84 2269 3030 2372 41 311 979 N ATOM 1105 CA LEU A 84 -12.870 -0.118 -15.235 1.00 17.98 C ANISOU 1105 CA LEU A 84 1963 2858 2009 140 240 699 C ATOM 1106 C LEU A 84 -12.904 -0.013 -13.714 1.00 16.94 C ANISOU 1106 C LEU A 84 1815 2530 2092 -1 119 514 C ATOM 1107 O LEU A 84 -13.578 -0.783 -13.053 1.00 15.58 O ANISOU 1107 O LEU A 84 1726 2306 1889 84 25 308 O ATOM 1108 CB LEU A 84 -11.604 -0.836 -15.689 1.00 19.36 C ANISOU 1108 CB LEU A 84 1965 3338 2055 211 383 751 C ATOM 1109 CG LEU A 84 -11.273 -2.128 -14.939 1.00 19.33 C ANISOU 1109 CG LEU A 84 1916 3402 2026 335 340 525 C ATOM 1110 CD1 LEU A 84 -12.404 -3.133 -15.113 1.00 21.24 C ANISOU 1110 CD1 LEU A 84 2376 3564 2131 508 266 303 C ATOM 1111 CD2 LEU A 84 -9.982 -2.698 -15.410 1.00 21.79 C ANISOU 1111 CD2 LEU A 84 2024 4013 2240 454 506 608 C ATOM 0 H LEU A 84 -12.291 1.362 -16.411 1.00 20.19 H new ATOM 0 HA LEU A 84 -13.649 -0.627 -15.509 1.00 17.98 H new ATOM 0 HB2 LEU A 84 -11.689 -1.041 -16.633 1.00 19.36 H new ATOM 0 HB3 LEU A 84 -10.855 -0.227 -15.597 1.00 19.36 H new ATOM 0 HG LEU A 84 -11.180 -1.924 -13.995 1.00 19.33 H new ATOM 0 HD11 LEU A 84 -12.188 -3.949 -14.636 1.00 21.24 H new ATOM 0 HD12 LEU A 84 -13.226 -2.760 -14.759 1.00 21.24 H new ATOM 0 HD13 LEU A 84 -12.519 -3.331 -16.056 1.00 21.24 H new ATOM 0 HD21 LEU A 84 -9.792 -3.515 -14.923 1.00 21.79 H new ATOM 0 HD22 LEU A 84 -10.041 -2.894 -16.358 1.00 21.79 H new ATOM 0 HD23 LEU A 84 -9.270 -2.057 -15.257 1.00 21.79 H new ATOM 1123 N ARG A 85 -12.200 0.986 -13.145 1.00 17.97 N ANISOU 1123 N ARG A 85 1844 2549 2434 -242 124 583 N ATOM 1124 CA ARG A 85 -12.179 1.067 -11.691 1.00 21.03 C ANISOU 1124 CA ARG A 85 2221 2819 2950 -372 -6 365 C ATOM 1125 C ARG A 85 -13.563 1.279 -11.110 1.00 18.46 C ANISOU 1125 C ARG A 85 2106 2242 2664 -310 -91 204 C ATOM 1126 O ARG A 85 -13.832 0.833 -9.985 1.00 19.62 O ANISOU 1126 O ARG A 85 2281 2382 2791 -303 -181 0 O ATOM 1127 CB ARG A 85 -11.240 2.209 -11.252 1.00 39.40 C ANISOU 1127 CB ARG A 85 4414 5056 5500 -693 -6 412 C ATOM 1128 CG ARG A 85 -11.702 3.595 -11.688 1.00 57.31 C ANISOU 1128 CG ARG A 85 6829 6971 7976 -829 61 544 C ATOM 1129 CD ARG A 85 -10.691 4.678 -11.315 1.00 73.76 C ANISOU 1129 CD ARG A 85 8784 8914 10326 -1211 79 573 C ATOM 1130 NE ARG A 85 -10.894 5.886 -12.112 1.00 87.16 N ANISOU 1130 NE ARG A 85 10608 10276 12234 -1319 221 831 N ATOM 1131 CZ ARG A 85 -10.340 6.106 -13.303 1.00 98.05 C ANISOU 1131 CZ ARG A 85 11888 11767 13599 -1343 403 1199 C ATOM 1132 NH1 ARG A 85 -9.533 5.206 -13.852 1.00100.36 N ANISOU 1132 NH1 ARG A 85 11942 12516 13675 -1260 474 1308 N ATOM 1133 NH2 ARG A 85 -10.594 7.234 -13.948 1.00104.33 N ANISOU 1133 NH2 ARG A 85 12845 12233 14563 -1405 533 1450 N ATOM 0 H ARG A 85 -11.755 1.590 -13.565 1.00 17.97 H new ATOM 0 HA ARG A 85 -11.852 0.219 -11.351 1.00 21.03 H new ATOM 0 HB2 ARG A 85 -11.159 2.195 -10.286 1.00 39.40 H new ATOM 0 HB3 ARG A 85 -10.355 2.045 -11.614 1.00 39.40 H new ATOM 0 HG2 ARG A 85 -11.842 3.601 -12.648 1.00 57.31 H new ATOM 0 HG3 ARG A 85 -12.557 3.795 -11.275 1.00 57.31 H new ATOM 0 HD2 ARG A 85 -10.774 4.891 -10.372 1.00 73.76 H new ATOM 0 HD3 ARG A 85 -9.790 4.345 -11.452 1.00 73.76 H new ATOM 0 HE ARG A 85 -11.406 6.497 -11.790 1.00 87.16 H new ATOM 0 HH11 ARG A 85 -9.363 4.472 -13.438 1.00100.36 H new ATOM 0 HH12 ARG A 85 -9.180 5.357 -14.622 1.00100.36 H new ATOM 0 HH21 ARG A 85 -11.115 7.822 -13.598 1.00104.33 H new ATOM 0 HH22 ARG A 85 -10.238 7.379 -14.717 1.00104.33 H new ATOM 1147 N ARG A 86 -14.474 1.918 -11.870 1.00 17.72 N ANISOU 1147 N ARG A 86 2142 1985 2606 -233 -54 318 N ATOM 1148 CA ARG A 86 -15.843 2.098 -11.377 1.00 17.10 C ANISOU 1148 CA ARG A 86 2206 1718 2572 -130 -117 182 C ATOM 1149 C ARG A 86 -16.622 0.802 -11.397 1.00 15.70 C ANISOU 1149 C ARG A 86 2040 1710 2216 42 -167 59 C ATOM 1150 O ARG A 86 -17.376 0.485 -10.468 1.00 16.47 O ANISOU 1150 O ARG A 86 2179 1748 2332 68 -213 -117 O ATOM 1151 CB ARG A 86 -16.544 3.193 -12.203 1.00 16.77 C ANISOU 1151 CB ARG A 86 2260 1476 2635 -56 -70 386 C ATOM 1152 CG ARG A 86 -15.882 4.567 -12.149 1.00 21.31 C ANISOU 1152 CG ARG A 86 2875 1758 3465 -253 9 520 C ATOM 1153 CD ARG A 86 -15.843 5.082 -10.736 1.00 26.28 C ANISOU 1153 CD ARG A 86 3564 2143 4280 -415 -38 233 C ATOM 1154 NE ARG A 86 -15.303 6.434 -10.685 1.00 35.65 N ANISOU 1154 NE ARG A 86 4822 2966 5756 -640 34 306 N ATOM 1155 CZ ARG A 86 -14.825 7.000 -9.582 1.00 40.97 C ANISOU 1155 CZ ARG A 86 5530 3456 6581 -886 -8 38 C ATOM 1156 NH1 ARG A 86 -14.811 6.331 -8.437 1.00 35.76 N ANISOU 1156 NH1 ARG A 86 4831 2994 5763 -902 -122 -277 N ATOM 1157 NH2 ARG A 86 -14.347 8.244 -9.624 1.00 44.19 N ANISOU 1157 NH2 ARG A 86 6042 3612 7137 -1080 58 85 N ATOM 0 H ARG A 86 -14.320 2.244 -12.651 1.00 17.72 H new ATOM 0 HA ARG A 86 -15.805 2.380 -10.450 1.00 17.10 H new ATOM 0 HB2 ARG A 86 -16.584 2.905 -13.128 1.00 16.77 H new ATOM 0 HB3 ARG A 86 -17.459 3.278 -11.892 1.00 16.77 H new ATOM 0 HG2 ARG A 86 -14.981 4.511 -12.503 1.00 21.31 H new ATOM 0 HG3 ARG A 86 -16.370 5.189 -12.712 1.00 21.31 H new ATOM 0 HD2 ARG A 86 -16.737 5.074 -10.361 1.00 26.28 H new ATOM 0 HD3 ARG A 86 -15.300 4.493 -10.189 1.00 26.28 H new ATOM 0 HE ARG A 86 -15.293 6.893 -11.412 1.00 35.65 H new ATOM 0 HH11 ARG A 86 -15.112 5.526 -8.406 1.00 35.76 H new ATOM 0 HH12 ARG A 86 -14.500 6.702 -7.726 1.00 35.76 H new ATOM 0 HH21 ARG A 86 -14.348 8.680 -10.365 1.00 44.19 H new ATOM 0 HH22 ARG A 86 -14.038 8.610 -8.910 1.00 44.19 H new ATOM 1171 N TYR A 87 -16.456 -0.006 -12.436 1.00 15.14 N ANISOU 1171 N TYR A 87 1937 1849 1966 147 -142 135 N ATOM 1172 CA TYR A 87 -17.100 -1.319 -12.443 1.00 14.33 C ANISOU 1172 CA TYR A 87 1862 1852 1730 255 -185 -24 C ATOM 1173 C TYR A 87 -16.607 -2.175 -11.282 1.00 14.26 C ANISOU 1173 C TYR A 87 1835 1843 1741 220 -189 -160 C ATOM 1174 O TYR A 87 -17.387 -2.934 -10.672 1.00 16.15 O ANISOU 1174 O TYR A 87 2124 2035 1977 248 -216 -290 O ATOM 1175 CB TYR A 87 -16.807 -2.049 -13.740 1.00 14.52 C ANISOU 1175 CB TYR A 87 1885 2088 1545 363 -147 19 C ATOM 1176 CG TYR A 87 -17.340 -1.405 -15.037 1.00 13.72 C ANISOU 1176 CG TYR A 87 1804 2091 1316 443 -160 180 C ATOM 1177 CD1 TYR A 87 -18.531 -0.714 -15.058 1.00 17.95 C ANISOU 1177 CD1 TYR A 87 2359 2541 1919 482 -247 221 C ATOM 1178 CD2 TYR A 87 -16.640 -1.530 -16.208 1.00 15.44 C ANISOU 1178 CD2 TYR A 87 2011 2534 1321 516 -75 306 C ATOM 1179 CE1 TYR A 87 -19.015 -0.164 -16.255 1.00 20.80 C ANISOU 1179 CE1 TYR A 87 2727 3049 2128 601 -280 416 C ATOM 1180 CE2 TYR A 87 -17.089 -1.021 -17.385 1.00 18.00 C ANISOU 1180 CE2 TYR A 87 2363 3018 1458 613 -89 480 C ATOM 1181 CZ TYR A 87 -18.293 -0.315 -17.420 1.00 18.62 C ANISOU 1181 CZ TYR A 87 2460 3016 1598 660 -209 554 C ATOM 1182 OH TYR A 87 -18.730 0.159 -18.582 1.00 20.47 O ANISOU 1182 OH TYR A 87 2709 3454 1616 795 -244 766 O ATOM 0 H TYR A 87 -15.987 0.178 -13.133 1.00 15.14 H new ATOM 0 HA TYR A 87 -18.055 -1.174 -12.355 1.00 14.33 H new ATOM 0 HB2 TYR A 87 -15.845 -2.144 -13.823 1.00 14.52 H new ATOM 0 HB3 TYR A 87 -17.176 -2.944 -13.673 1.00 14.52 H new ATOM 0 HD1 TYR A 87 -19.018 -0.611 -14.273 1.00 17.95 H new ATOM 0 HD2 TYR A 87 -15.826 -1.980 -16.197 1.00 15.44 H new ATOM 0 HE1 TYR A 87 -19.820 0.301 -16.262 1.00 20.80 H new ATOM 0 HE2 TYR A 87 -16.596 -1.142 -18.164 1.00 18.00 H new ATOM 0 HH TYR A 87 -19.137 0.883 -18.454 1.00 20.47 H new ATOM 1192 N VAL A 88 -15.305 -2.126 -11.000 1.00 15.79 N ANISOU 1192 N VAL A 88 1934 2122 1944 165 -156 -100 N ATOM 1193 CA VAL A 88 -14.770 -2.863 -9.875 1.00 16.06 C ANISOU 1193 CA VAL A 88 1928 2207 1967 169 -183 -176 C ATOM 1194 C VAL A 88 -15.457 -2.416 -8.587 1.00 16.08 C ANISOU 1194 C VAL A 88 1992 2085 2030 84 -249 -293 C ATOM 1195 O VAL A 88 -15.865 -3.239 -7.778 1.00 16.74 O ANISOU 1195 O VAL A 88 2128 2171 2061 141 -256 -361 O ATOM 1196 CB VAL A 88 -13.238 -2.700 -9.817 1.00 16.71 C ANISOU 1196 CB VAL A 88 1825 2472 2054 120 -165 -73 C ATOM 1197 CG1 VAL A 88 -12.651 -3.280 -8.532 1.00 17.28 C ANISOU 1197 CG1 VAL A 88 1821 2654 2092 139 -238 -118 C ATOM 1198 CG2 VAL A 88 -12.645 -3.319 -11.054 1.00 18.27 C ANISOU 1198 CG2 VAL A 88 1965 2823 2154 266 -51 26 C ATOM 0 H VAL A 88 -14.726 -1.675 -11.447 1.00 15.79 H new ATOM 0 HA VAL A 88 -14.952 -3.810 -9.984 1.00 16.06 H new ATOM 0 HB VAL A 88 -13.012 -1.757 -9.798 1.00 16.71 H new ATOM 0 HG11 VAL A 88 -11.689 -3.159 -8.532 1.00 17.28 H new ATOM 0 HG12 VAL A 88 -13.034 -2.824 -7.766 1.00 17.28 H new ATOM 0 HG13 VAL A 88 -12.857 -4.226 -8.480 1.00 17.28 H new ATOM 0 HG21 VAL A 88 -11.680 -3.224 -11.033 1.00 18.27 H new ATOM 0 HG22 VAL A 88 -12.877 -4.260 -11.088 1.00 18.27 H new ATOM 0 HG23 VAL A 88 -12.996 -2.872 -11.840 1.00 18.27 H new ATOM 1208 N GLU A 89 -15.641 -1.108 -8.422 1.00 17.06 N ANISOU 1208 N GLU A 89 2134 2081 2267 -40 -269 -313 N ATOM 1209 CA GLU A 89 -16.310 -0.608 -7.227 1.00 15.99 C ANISOU 1209 CA GLU A 89 2077 1832 2167 -91 -303 -472 C ATOM 1210 C GLU A 89 -17.748 -1.100 -7.174 1.00 16.88 C ANISOU 1210 C GLU A 89 2268 1884 2261 31 -266 -524 C ATOM 1211 O GLU A 89 -18.275 -1.375 -6.085 1.00 19.80 O ANISOU 1211 O GLU A 89 2678 2267 2578 44 -253 -631 O ATOM 1212 CB GLU A 89 -16.239 0.906 -7.178 1.00 16.44 C ANISOU 1212 CB GLU A 89 2173 1686 2388 -228 -305 -510 C ATOM 1213 CG GLU A 89 -14.790 1.422 -6.863 1.00 17.59 C ANISOU 1213 CG GLU A 89 2204 1903 2579 -447 -361 -518 C ATOM 1214 CD GLU A 89 -14.452 2.795 -7.337 1.00 20.39 C ANISOU 1214 CD GLU A 89 2578 2016 3155 -630 -326 -468 C ATOM 1215 OE1 GLU A 89 -15.304 3.528 -7.903 1.00 23.56 O ANISOU 1215 OE1 GLU A 89 3112 2153 3689 -556 -252 -401 O ATOM 1216 OE2 GLU A 89 -13.270 3.240 -7.160 1.00 24.90 O ANISOU 1216 OE2 GLU A 89 3014 2645 3801 -869 -368 -472 O ATOM 0 H GLU A 89 -15.390 -0.504 -8.980 1.00 17.06 H new ATOM 0 HA GLU A 89 -15.853 -0.953 -6.444 1.00 15.99 H new ATOM 0 HB2 GLU A 89 -16.532 1.270 -8.028 1.00 16.44 H new ATOM 0 HB3 GLU A 89 -16.852 1.235 -6.502 1.00 16.44 H new ATOM 0 HG2 GLU A 89 -14.660 1.392 -5.902 1.00 17.59 H new ATOM 0 HG3 GLU A 89 -14.155 0.801 -7.254 1.00 17.59 H new ATOM 1223 N ASP A 90 -18.411 -1.208 -8.330 1.00 16.67 N ANISOU 1223 N ASP A 90 2240 1837 2257 112 -249 -444 N ATOM 1224 CA ASP A 90 -19.772 -1.726 -8.359 1.00 14.15 C ANISOU 1224 CA ASP A 90 1926 1513 1936 190 -237 -499 C ATOM 1225 C ASP A 90 -19.804 -3.147 -7.798 1.00 15.13 C ANISOU 1225 C ASP A 90 2060 1709 1978 185 -209 -540 C ATOM 1226 O ASP A 90 -20.659 -3.479 -6.967 1.00 17.26 O ANISOU 1226 O ASP A 90 2326 1978 2252 167 -152 -561 O ATOM 1227 CB ASP A 90 -20.331 -1.725 -9.789 1.00 13.72 C ANISOU 1227 CB ASP A 90 1838 1511 1866 263 -272 -416 C ATOM 1228 CG ASP A 90 -20.483 -0.341 -10.364 1.00 15.12 C ANISOU 1228 CG ASP A 90 2019 1595 2130 312 -279 -294 C ATOM 1229 OD1 ASP A 90 -20.525 0.673 -9.620 1.00 17.31 O ANISOU 1229 OD1 ASP A 90 2341 1695 2542 295 -244 -323 O ATOM 1230 OD2 ASP A 90 -20.627 -0.267 -11.610 1.00 17.36 O ANISOU 1230 OD2 ASP A 90 2279 1978 2338 386 -314 -165 O ATOM 0 H ASP A 90 -18.091 -0.988 -9.097 1.00 16.67 H new ATOM 0 HA ASP A 90 -20.325 -1.148 -7.811 1.00 14.15 H new ATOM 0 HB2 ASP A 90 -19.743 -2.244 -10.360 1.00 13.72 H new ATOM 0 HB3 ASP A 90 -21.194 -2.168 -9.793 1.00 13.72 H new ATOM 1235 N VAL A 91 -18.887 -3.995 -8.251 1.00 15.67 N ANISOU 1235 N VAL A 91 2138 1836 1979 209 -211 -497 N ATOM 1236 CA VAL A 91 -18.914 -5.391 -7.813 1.00 14.11 C ANISOU 1236 CA VAL A 91 1990 1624 1748 238 -164 -509 C ATOM 1237 C VAL A 91 -18.558 -5.485 -6.331 1.00 15.73 C ANISOU 1237 C VAL A 91 2211 1863 1902 233 -144 -480 C ATOM 1238 O VAL A 91 -19.175 -6.230 -5.582 1.00 17.62 O ANISOU 1238 O VAL A 91 2499 2064 2132 232 -78 -466 O ATOM 1239 CB VAL A 91 -17.974 -6.250 -8.670 1.00 16.43 C ANISOU 1239 CB VAL A 91 2304 1947 1990 325 -143 -476 C ATOM 1240 CG1 VAL A 91 -17.933 -7.704 -8.148 1.00 16.29 C ANISOU 1240 CG1 VAL A 91 2379 1824 1986 385 -70 -467 C ATOM 1241 CG2 VAL A 91 -18.440 -6.218 -10.103 1.00 17.64 C ANISOU 1241 CG2 VAL A 91 2464 2123 2116 332 -166 -536 C ATOM 0 H VAL A 91 -18.255 -3.792 -8.798 1.00 15.67 H new ATOM 0 HA VAL A 91 -19.813 -5.737 -7.930 1.00 14.11 H new ATOM 0 HB VAL A 91 -17.075 -5.889 -8.615 1.00 16.43 H new ATOM 0 HG11 VAL A 91 -17.335 -8.230 -8.702 1.00 16.29 H new ATOM 0 HG12 VAL A 91 -17.614 -7.710 -7.232 1.00 16.29 H new ATOM 0 HG13 VAL A 91 -18.824 -8.086 -8.183 1.00 16.29 H new ATOM 0 HG21 VAL A 91 -17.848 -6.760 -10.648 1.00 17.64 H new ATOM 0 HG22 VAL A 91 -19.342 -6.570 -10.158 1.00 17.64 H new ATOM 0 HG23 VAL A 91 -18.430 -5.304 -10.426 1.00 17.64 H new ATOM 1251 N ARG A 92 -17.581 -4.705 -5.884 1.00 16.06 N ANISOU 1251 N ARG A 92 2203 2002 1896 211 -201 -465 N ATOM 1252 CA ARG A 92 -17.172 -4.773 -4.482 1.00 16.25 C ANISOU 1252 CA ARG A 92 2232 2142 1802 210 -224 -459 C ATOM 1253 C ARG A 92 -18.305 -4.347 -3.566 1.00 16.26 C ANISOU 1253 C ARG A 92 2294 2111 1772 171 -173 -559 C ATOM 1254 O ARG A 92 -18.419 -4.843 -2.430 1.00 17.55 O ANISOU 1254 O ARG A 92 2501 2377 1792 204 -134 -524 O ATOM 1255 CB ARG A 92 -15.910 -3.940 -4.264 1.00 17.71 C ANISOU 1255 CB ARG A 92 2312 2471 1948 139 -332 -475 C ATOM 1256 CG ARG A 92 -14.757 -4.536 -5.002 1.00 18.46 C ANISOU 1256 CG ARG A 92 2295 2669 2050 219 -343 -343 C ATOM 1257 CD ARG A 92 -13.441 -3.838 -4.745 1.00 19.10 C ANISOU 1257 CD ARG A 92 2194 2954 2108 121 -452 -333 C ATOM 1258 NE ARG A 92 -12.876 -4.172 -3.453 1.00 20.80 N ANISOU 1258 NE ARG A 92 2346 3405 2152 155 -554 -317 N ATOM 1259 CZ ARG A 92 -11.856 -3.553 -2.901 1.00 24.10 C ANISOU 1259 CZ ARG A 92 2584 4064 2510 28 -701 -361 C ATOM 1260 NH1 ARG A 92 -11.247 -2.543 -3.534 1.00 29.37 N ANISOU 1260 NH1 ARG A 92 3116 4717 3327 -177 -734 -415 N ATOM 1261 NH2 ARG A 92 -11.396 -3.942 -1.700 1.00 25.50 N ANISOU 1261 NH2 ARG A 92 2720 4472 2497 87 -794 -321 N ATOM 0 H ARG A 92 -17.147 -4.138 -6.364 1.00 16.06 H new ATOM 0 HA ARG A 92 -16.961 -5.693 -4.258 1.00 16.25 H new ATOM 0 HB2 ARG A 92 -16.060 -3.031 -4.567 1.00 17.71 H new ATOM 0 HB3 ARG A 92 -15.706 -3.894 -3.317 1.00 17.71 H new ATOM 0 HG2 ARG A 92 -14.672 -5.470 -4.753 1.00 18.46 H new ATOM 0 HG3 ARG A 92 -14.946 -4.512 -5.953 1.00 18.46 H new ATOM 0 HD2 ARG A 92 -12.810 -4.078 -5.442 1.00 19.10 H new ATOM 0 HD3 ARG A 92 -13.572 -2.878 -4.799 1.00 19.10 H new ATOM 0 HE ARG A 92 -13.233 -4.821 -3.016 1.00 20.80 H new ATOM 0 HH11 ARG A 92 -11.522 -2.293 -4.310 1.00 29.37 H new ATOM 0 HH12 ARG A 92 -10.580 -2.144 -3.165 1.00 29.37 H new ATOM 0 HH21 ARG A 92 -11.769 -4.599 -1.289 1.00 25.50 H new ATOM 0 HH22 ARG A 92 -10.728 -3.534 -1.343 1.00 25.50 H new ATOM 1275 N ALA A 93 -19.177 -3.433 -4.020 1.00 16.69 N ANISOU 1275 N ALA A 93 2346 2049 1945 132 -150 -651 N ATOM 1276 CA ALA A 93 -20.313 -3.043 -3.214 1.00 17.41 C ANISOU 1276 CA ALA A 93 2461 2126 2027 133 -58 -712 C ATOM 1277 C ALA A 93 -21.259 -4.212 -3.005 1.00 16.34 C ANISOU 1277 C ALA A 93 2320 2007 1880 168 47 -674 C ATOM 1278 O ALA A 93 -21.888 -4.311 -1.952 1.00 17.77 O ANISOU 1278 O ALA A 93 2517 2268 1966 181 156 -689 O ATOM 1279 CB ALA A 93 -21.025 -1.878 -3.875 1.00 18.76 C ANISOU 1279 CB ALA A 93 2607 2176 2346 136 -43 -724 C ATOM 0 H ALA A 93 -19.119 -3.039 -4.782 1.00 16.69 H new ATOM 0 HA ALA A 93 -19.999 -2.765 -2.339 1.00 17.41 H new ATOM 0 HB1 ALA A 93 -21.787 -1.616 -3.335 1.00 18.76 H new ATOM 0 HB2 ALA A 93 -20.414 -1.129 -3.956 1.00 18.76 H new ATOM 0 HB3 ALA A 93 -21.330 -2.143 -4.757 1.00 18.76 H new ATOM 1285 N VAL A 94 -21.416 -5.053 -4.027 1.00 16.18 N ANISOU 1285 N VAL A 94 2274 1910 1965 152 38 -601 N ATOM 1286 CA VAL A 94 -22.224 -6.263 -3.894 1.00 15.63 C ANISOU 1286 CA VAL A 94 2200 1795 1944 107 143 -533 C ATOM 1287 C VAL A 94 -21.590 -7.210 -2.889 1.00 15.93 C ANISOU 1287 C VAL A 94 2339 1856 1857 142 213 -386 C ATOM 1288 O VAL A 94 -22.275 -7.786 -2.028 1.00 17.60 O ANISOU 1288 O VAL A 94 2567 2082 2038 110 354 -294 O ATOM 1289 CB VAL A 94 -22.404 -6.940 -5.255 1.00 16.14 C ANISOU 1289 CB VAL A 94 2246 1754 2133 60 91 -557 C ATOM 1290 CG1 VAL A 94 -23.166 -8.237 -5.129 1.00 16.96 C ANISOU 1290 CG1 VAL A 94 2362 1746 2335 -50 195 -520 C ATOM 1291 CG2 VAL A 94 -23.073 -5.967 -6.261 1.00 17.70 C ANISOU 1291 CG2 VAL A 94 2326 1998 2400 63 0 -650 C ATOM 0 H VAL A 94 -21.064 -4.941 -4.803 1.00 16.18 H new ATOM 0 HA VAL A 94 -23.103 -6.018 -3.565 1.00 15.63 H new ATOM 0 HB VAL A 94 -21.527 -7.165 -5.602 1.00 16.14 H new ATOM 0 HG11 VAL A 94 -23.264 -8.641 -6.005 1.00 16.96 H new ATOM 0 HG12 VAL A 94 -22.681 -8.842 -4.546 1.00 16.96 H new ATOM 0 HG13 VAL A 94 -24.043 -8.062 -4.754 1.00 16.96 H new ATOM 0 HG21 VAL A 94 -23.180 -6.410 -7.117 1.00 17.70 H new ATOM 0 HG22 VAL A 94 -23.943 -5.701 -5.924 1.00 17.70 H new ATOM 0 HG23 VAL A 94 -22.515 -5.181 -6.371 1.00 17.70 H new ATOM 1301 N LEU A 95 -20.280 -7.377 -2.960 1.00 15.55 N ANISOU 1301 N LEU A 95 2338 1841 1731 223 127 -324 N ATOM 1302 CA LEU A 95 -19.599 -8.216 -1.974 1.00 15.10 C ANISOU 1302 CA LEU A 95 2356 1852 1531 318 168 -138 C ATOM 1303 C LEU A 95 -19.832 -7.701 -0.557 1.00 15.11 C ANISOU 1303 C LEU A 95 2368 2066 1309 325 204 -128 C ATOM 1304 O LEU A 95 -20.040 -8.474 0.389 1.00 16.27 O ANISOU 1304 O LEU A 95 2583 2267 1330 372 320 59 O ATOM 1305 CB LEU A 95 -18.108 -8.259 -2.281 1.00 15.53 C ANISOU 1305 CB LEU A 95 2380 1991 1529 434 46 -84 C ATOM 1306 CG LEU A 95 -17.717 -8.647 -3.682 1.00 16.40 C ANISOU 1306 CG LEU A 95 2481 1953 1796 467 30 -120 C ATOM 1307 CD1 LEU A 95 -16.212 -8.968 -3.697 1.00 19.42 C ANISOU 1307 CD1 LEU A 95 2804 2467 2108 638 -31 3 C ATOM 1308 CD2 LEU A 95 -18.469 -9.843 -4.212 1.00 17.07 C ANISOU 1308 CD2 LEU A 95 2679 1770 2036 450 152 -105 C ATOM 0 H LEU A 95 -19.771 -7.024 -3.556 1.00 15.55 H new ATOM 0 HA LEU A 95 -19.965 -9.113 -2.028 1.00 15.10 H new ATOM 0 HB2 LEU A 95 -17.735 -7.383 -2.094 1.00 15.53 H new ATOM 0 HB3 LEU A 95 -17.690 -8.882 -1.666 1.00 15.53 H new ATOM 0 HG LEU A 95 -17.939 -7.897 -4.256 1.00 16.40 H new ATOM 0 HD11 LEU A 95 -15.944 -9.220 -4.594 1.00 19.42 H new ATOM 0 HD12 LEU A 95 -15.711 -8.185 -3.418 1.00 19.42 H new ATOM 0 HD13 LEU A 95 -16.031 -9.701 -3.088 1.00 19.42 H new ATOM 0 HD21 LEU A 95 -18.171 -10.039 -5.114 1.00 17.07 H new ATOM 0 HD22 LEU A 95 -18.300 -10.610 -3.642 1.00 17.07 H new ATOM 0 HD23 LEU A 95 -19.420 -9.650 -4.221 1.00 17.07 H new ATOM 1320 N ASP A 96 -19.837 -6.375 -0.375 1.00 14.46 N ANISOU 1320 N ASP A 96 2238 2096 1161 282 124 -332 N ATOM 1321 CA ASP A 96 -20.122 -5.841 0.933 1.00 17.30 C ANISOU 1321 CA ASP A 96 2634 2661 1280 294 170 -401 C ATOM 1322 C ASP A 96 -21.522 -6.223 1.413 1.00 16.78 C ANISOU 1322 C ASP A 96 2574 2578 1223 281 395 -346 C ATOM 1323 O ASP A 96 -21.700 -6.646 2.548 1.00 19.05 O ANISOU 1323 O ASP A 96 2919 3046 1274 331 512 -219 O ATOM 1324 CB ASP A 96 -20.013 -4.303 0.913 1.00 18.95 C ANISOU 1324 CB ASP A 96 2826 2886 1491 238 74 -690 C ATOM 1325 CG ASP A 96 -18.605 -3.803 0.666 1.00 21.40 C ANISOU 1325 CG ASP A 96 3093 3253 1785 185 -132 -742 C ATOM 1326 OD1 ASP A 96 -17.647 -4.593 0.688 1.00 21.83 O ANISOU 1326 OD1 ASP A 96 3105 3434 1754 241 -214 -572 O ATOM 1327 OD2 ASP A 96 -18.463 -2.564 0.514 1.00 22.31 O ANISOU 1327 OD2 ASP A 96 3202 3243 2030 75 -181 -880 O ATOM 0 H ASP A 96 -19.681 -5.791 -0.987 1.00 14.46 H new ATOM 0 HA ASP A 96 -19.470 -6.220 1.543 1.00 17.30 H new ATOM 0 HB2 ASP A 96 -20.599 -3.953 0.224 1.00 18.95 H new ATOM 0 HB3 ASP A 96 -20.330 -3.952 1.760 1.00 18.95 H new ATOM 1332 N ARG A 97 -22.526 -6.061 0.553 1.00 17.24 N ANISOU 1332 N ARG A 97 2546 2468 1536 216 459 -420 N ATOM 1333 CA ARG A 97 -23.892 -6.247 0.998 1.00 19.70 C ANISOU 1333 CA ARG A 97 2784 2819 1880 186 672 -391 C ATOM 1334 C ARG A 97 -24.127 -7.653 1.543 1.00 19.76 C ANISOU 1334 C ARG A 97 2836 2817 1856 140 837 -108 C ATOM 1335 O ARG A 97 -24.816 -7.841 2.535 1.00 23.04 O ANISOU 1335 O ARG A 97 3240 3387 2129 143 1043 -6 O ATOM 1336 CB ARG A 97 -24.893 -5.981 -0.118 1.00 21.93 C ANISOU 1336 CB ARG A 97 2907 2970 2454 122 671 -485 C ATOM 1337 CG ARG A 97 -26.313 -6.499 0.299 1.00 25.50 C ANISOU 1337 CG ARG A 97 3207 3496 2984 48 904 -399 C ATOM 1338 CD ARG A 97 -27.490 -5.659 -0.127 1.00 23.86 C ANISOU 1338 CD ARG A 97 2779 3350 2937 84 945 -540 C ATOM 1339 NE ARG A 97 -28.733 -6.212 0.385 1.00 24.67 N ANISOU 1339 NE ARG A 97 2685 3584 3102 -2 1184 -434 N ATOM 1340 CZ ARG A 97 -29.924 -5.626 0.303 1.00 32.55 C ANISOU 1340 CZ ARG A 97 3421 4725 4221 54 1288 -508 C ATOM 1341 NH1 ARG A 97 -30.063 -4.436 -0.311 1.00 35.42 N ANISOU 1341 NH1 ARG A 97 3719 5075 4663 230 1164 -679 N ATOM 1342 NH2 ARG A 97 -30.981 -6.215 0.827 1.00 38.39 N ANISOU 1342 NH2 ARG A 97 3946 5622 5019 -54 1530 -382 N ATOM 0 H ARG A 97 -22.435 -5.848 -0.275 1.00 17.24 H new ATOM 0 HA ARG A 97 -24.029 -5.603 1.710 1.00 19.70 H new ATOM 0 HB2 ARG A 97 -24.931 -5.031 -0.309 1.00 21.93 H new ATOM 0 HB3 ARG A 97 -24.606 -6.423 -0.932 1.00 21.93 H new ATOM 0 HG2 ARG A 97 -26.429 -7.391 -0.065 1.00 25.50 H new ATOM 0 HG3 ARG A 97 -26.334 -6.582 1.265 1.00 25.50 H new ATOM 0 HD2 ARG A 97 -27.378 -4.751 0.196 1.00 23.86 H new ATOM 0 HD3 ARG A 97 -27.526 -5.613 -1.095 1.00 23.86 H new ATOM 0 HE ARG A 97 -28.695 -6.979 0.772 1.00 24.67 H new ATOM 0 HH11 ARG A 97 -29.378 -4.047 -0.655 1.00 35.42 H new ATOM 0 HH12 ARG A 97 -30.837 -4.065 -0.359 1.00 35.42 H new ATOM 0 HH21 ARG A 97 -30.899 -6.975 1.220 1.00 38.39 H new ATOM 0 HH22 ARG A 97 -31.753 -5.839 0.776 1.00 38.39 H new ATOM 1356 N PHE A 98 -23.524 -8.645 0.912 1.00 18.87 N ANISOU 1356 N PHE A 98 2790 2507 1872 111 773 32 N ATOM 1357 CA PHE A 98 -23.813 -10.001 1.353 1.00 22.05 C ANISOU 1357 CA PHE A 98 3265 2792 2319 57 956 317 C ATOM 1358 C PHE A 98 -22.800 -10.536 2.361 1.00 25.01 C ANISOU 1358 C PHE A 98 3798 3285 2418 223 965 577 C ATOM 1359 O PHE A 98 -23.001 -11.622 2.891 1.00 27.84 O ANISOU 1359 O PHE A 98 4250 3542 2786 216 1145 883 O ATOM 1360 CB PHE A 98 -23.988 -10.874 0.092 1.00 20.14 C ANISOU 1360 CB PHE A 98 3024 2211 2418 -76 926 295 C ATOM 1361 CG PHE A 98 -25.264 -10.511 -0.642 1.00 19.84 C ANISOU 1361 CG PHE A 98 2785 2157 2598 -258 942 104 C ATOM 1362 CD1 PHE A 98 -26.452 -11.039 -0.232 1.00 22.46 C ANISOU 1362 CD1 PHE A 98 3002 2480 3052 -437 1152 207 C ATOM 1363 CD2 PHE A 98 -25.258 -9.539 -1.617 1.00 18.80 C ANISOU 1363 CD2 PHE A 98 2549 2078 2515 -229 754 -140 C ATOM 1364 CE1 PHE A 98 -27.656 -10.662 -0.824 1.00 23.19 C ANISOU 1364 CE1 PHE A 98 2835 2646 3332 -588 1152 45 C ATOM 1365 CE2 PHE A 98 -26.476 -9.164 -2.227 1.00 19.33 C ANISOU 1365 CE2 PHE A 98 2394 2201 2751 -347 750 -275 C ATOM 1366 CZ PHE A 98 -27.642 -9.735 -1.833 1.00 20.84 C ANISOU 1366 CZ PHE A 98 2434 2415 3070 -521 934 -195 C ATOM 0 H PHE A 98 -22.971 -8.566 0.258 1.00 18.87 H new ATOM 0 HA PHE A 98 -24.640 -10.019 1.860 1.00 22.05 H new ATOM 0 HB2 PHE A 98 -23.226 -10.755 -0.497 1.00 20.14 H new ATOM 0 HB3 PHE A 98 -24.009 -11.811 0.343 1.00 20.14 H new ATOM 0 HD1 PHE A 98 -26.459 -11.664 0.457 1.00 22.46 H new ATOM 0 HD2 PHE A 98 -24.461 -9.134 -1.871 1.00 18.80 H new ATOM 0 HE1 PHE A 98 -28.459 -11.035 -0.538 1.00 23.19 H new ATOM 0 HE2 PHE A 98 -26.478 -8.523 -2.901 1.00 19.33 H new ATOM 0 HZ PHE A 98 -28.438 -9.495 -2.251 1.00 20.84 H new ATOM 1376 N GLY A 99 -21.773 -9.751 2.688 1.00 23.91 N ANISOU 1376 N GLY A 99 3674 3381 2031 360 775 475 N ATOM 1377 CA GLY A 99 -21.039 -9.937 3.929 1.00 26.04 C ANISOU 1377 CA GLY A 99 4029 3942 1923 521 761 679 C ATOM 1378 C GLY A 99 -20.215 -11.192 4.044 1.00 28.59 C ANISOU 1378 C GLY A 99 4458 4160 2246 672 766 1041 C ATOM 1379 O GLY A 99 -19.820 -11.556 5.160 1.00 33.81 O ANISOU 1379 O GLY A 99 5156 5044 2644 793 765 1262 O ATOM 0 H GLY A 99 -21.488 -9.103 2.199 1.00 23.91 H new ATOM 0 HA2 GLY A 99 -20.450 -9.176 4.050 1.00 26.04 H new ATOM 0 HA3 GLY A 99 -21.674 -9.923 4.662 1.00 26.04 H new ATOM 1383 N ARG A 100 -19.932 -11.874 2.949 1.00 25.24 N ANISOU 1383 N ARG A 100 4056 3382 2153 667 744 1061 N ATOM 1384 CA ARG A 100 -19.177 -13.116 3.060 1.00 28.85 C ANISOU 1384 CA ARG A 100 4638 3673 2650 864 787 1410 C ATOM 1385 C ARG A 100 -17.672 -12.833 3.059 1.00 28.25 C ANISOU 1385 C ARG A 100 4467 3848 2417 1081 534 1396 C ATOM 1386 O ARG A 100 -17.208 -11.791 2.554 1.00 26.11 O ANISOU 1386 O ARG A 100 4066 3749 2106 1033 345 1116 O ATOM 1387 CB ARG A 100 -19.536 -14.074 1.908 1.00 33.21 C ANISOU 1387 CB ARG A 100 5279 3701 3638 772 900 1390 C ATOM 1388 CG ARG A 100 -21.025 -14.298 1.696 1.00 43.66 C ANISOU 1388 CG ARG A 100 6602 4791 5196 471 1096 1314 C ATOM 1389 CD ARG A 100 -21.738 -14.745 2.958 1.00 64.01 C ANISOU 1389 CD ARG A 100 9229 7456 7637 428 1326 1631 C ATOM 1390 NE ARG A 100 -22.895 -15.596 2.676 1.00 77.84 N ANISOU 1390 NE ARG A 100 10982 8858 9735 150 1522 1656 N ATOM 1391 CZ ARG A 100 -24.095 -15.144 2.310 1.00 81.02 C ANISOU 1391 CZ ARG A 100 11242 9255 10286 -127 1627 1475 C ATOM 1392 NH1 ARG A 100 -25.082 -16.007 2.083 1.00 84.94 N ANISOU 1392 NH1 ARG A 100 11691 9486 11096 -398 1748 1486 N ATOM 1393 NH2 ARG A 100 -24.317 -13.850 2.156 1.00 77.97 N ANISOU 1393 NH2 ARG A 100 10674 9198 9751 -128 1489 1177 N ATOM 0 H ARG A 100 -20.158 -11.647 2.151 1.00 25.24 H new ATOM 0 HA ARG A 100 -19.413 -13.539 3.900 1.00 28.85 H new ATOM 0 HB2 ARG A 100 -19.155 -13.727 1.086 1.00 33.21 H new ATOM 0 HB3 ARG A 100 -19.115 -14.931 2.076 1.00 33.21 H new ATOM 0 HG2 ARG A 100 -21.429 -13.477 1.375 1.00 43.66 H new ATOM 0 HG3 ARG A 100 -21.152 -14.966 1.004 1.00 43.66 H new ATOM 0 HD2 ARG A 100 -21.115 -15.228 3.524 1.00 64.01 H new ATOM 0 HD3 ARG A 100 -22.028 -13.965 3.456 1.00 64.01 H new ATOM 0 HE ARG A 100 -22.794 -16.447 2.752 1.00 77.84 H new ATOM 0 HH11 ARG A 100 -24.944 -16.851 2.173 1.00 84.94 H new ATOM 0 HH12 ARG A 100 -25.858 -15.721 1.847 1.00 84.94 H new ATOM 0 HH21 ARG A 100 -23.683 -13.286 2.292 1.00 77.97 H new ATOM 0 HH22 ARG A 100 -25.096 -13.573 1.920 1.00 77.97 H new ATOM 1407 N ALA A 101 -16.923 -13.783 3.607 1.00 33.01 N ANISOU 1407 N ALA A 101 5072 4454 3015 1258 525 1640 N ATOM 1408 CA ALA A 101 -15.465 -13.742 3.548 1.00 32.99 C ANISOU 1408 CA ALA A 101 4919 4664 2951 1446 322 1638 C ATOM 1409 C ALA A 101 -14.908 -14.355 2.272 1.00 32.59 C ANISOU 1409 C ALA A 101 4877 4298 3209 1549 348 1600 C ATOM 1410 O ALA A 101 -13.760 -14.060 1.912 1.00 34.20 O ANISOU 1410 O ALA A 101 4907 4697 3391 1658 197 1524 O ATOM 1411 CB ALA A 101 -14.855 -14.463 4.751 1.00 35.90 C ANISOU 1411 CB ALA A 101 5273 5226 3142 1626 310 1924 C ATOM 0 H ALA A 101 -17.242 -14.466 4.021 1.00 33.01 H new ATOM 0 HA ALA A 101 -15.222 -12.803 3.560 1.00 32.99 H new ATOM 0 HB1 ALA A 101 -13.887 -14.425 4.695 1.00 35.90 H new ATOM 0 HB2 ALA A 101 -15.148 -14.032 5.569 1.00 35.90 H new ATOM 0 HB3 ALA A 101 -15.143 -15.389 4.753 1.00 35.90 H new ATOM 1417 N ARG A 102 -15.672 -15.220 1.600 1.00 33.39 N ANISOU 1417 N ARG A 102 5159 3927 3600 1487 544 1618 N ATOM 1418 CA ARG A 102 -15.231 -15.845 0.358 1.00 37.64 C ANISOU 1418 CA ARG A 102 5731 4154 4415 1553 579 1496 C ATOM 1419 C ARG A 102 -16.317 -15.737 -0.703 1.00 31.88 C ANISOU 1419 C ARG A 102 5111 3082 3920 1314 664 1244 C ATOM 1420 O ARG A 102 -17.482 -16.064 -0.445 1.00 30.71 O ANISOU 1420 O ARG A 102 5079 2713 3877 1114 805 1278 O ATOM 1421 CB ARG A 102 -14.865 -17.316 0.576 1.00 55.93 C ANISOU 1421 CB ARG A 102 8164 6207 6879 1719 708 1715 C ATOM 1422 CG ARG A 102 -13.516 -17.505 1.254 1.00 74.93 C ANISOU 1422 CG ARG A 102 10428 8936 9107 2008 607 1921 C ATOM 1423 CD ARG A 102 -13.052 -18.962 1.267 1.00 92.46 C ANISOU 1423 CD ARG A 102 12776 10852 11504 2229 742 2131 C ATOM 1424 NE ARG A 102 -13.629 -19.747 0.180 1.00101.74 N ANISOU 1424 NE ARG A 102 14144 11506 13007 2122 887 1957 N ATOM 1425 CZ ARG A 102 -12.962 -20.655 -0.542 1.00113.15 C ANISOU 1425 CZ ARG A 102 15654 12696 14640 2305 951 1922 C ATOM 1426 NH1 ARG A 102 -11.688 -20.903 -0.314 1.00119.74 N ANISOU 1426 NH1 ARG A 102 16366 13744 15387 2626 907 2085 N ATOM 1427 NH2 ARG A 102 -13.606 -21.311 -1.501 1.00115.69 N ANISOU 1427 NH2 ARG A 102 16157 12564 15235 2156 1053 1703 N ATOM 0 H ARG A 102 -16.458 -15.458 1.854 1.00 33.39 H new ATOM 0 HA ARG A 102 -14.439 -15.375 0.055 1.00 37.64 H new ATOM 0 HB2 ARG A 102 -15.553 -17.738 1.115 1.00 55.93 H new ATOM 0 HB3 ARG A 102 -14.856 -17.771 -0.280 1.00 55.93 H new ATOM 0 HG2 ARG A 102 -12.852 -16.964 0.799 1.00 74.93 H new ATOM 0 HG3 ARG A 102 -13.570 -17.180 2.166 1.00 74.93 H new ATOM 0 HD2 ARG A 102 -12.085 -18.990 1.203 1.00 92.46 H new ATOM 0 HD3 ARG A 102 -13.292 -19.366 2.116 1.00 92.46 H new ATOM 0 HE ARG A 102 -14.458 -19.617 -0.010 1.00101.74 H new ATOM 0 HH11 ARG A 102 -11.272 -20.478 0.307 1.00119.74 H new ATOM 0 HH12 ARG A 102 -11.273 -21.490 -0.786 1.00119.74 H new ATOM 0 HH21 ARG A 102 -14.438 -21.149 -1.649 1.00115.69 H new ATOM 0 HH22 ARG A 102 -13.191 -21.898 -1.974 1.00115.69 H new ATOM 1441 N TYR A 103 -15.923 -15.294 -1.886 1.00 19.17 N ANISOU 1441 N TYR A 103 2525 2718 2040 562 -58 264 N ATOM 1442 CA TYR A 103 -16.776 -15.250 -3.060 1.00 18.11 C ANISOU 1442 CA TYR A 103 2368 2515 1999 510 -7 238 C ATOM 1443 C TYR A 103 -16.081 -15.845 -4.276 1.00 17.15 C ANISOU 1443 C TYR A 103 2194 2314 2007 450 -23 213 C ATOM 1444 O TYR A 103 -14.844 -15.774 -4.412 1.00 16.56 O ANISOU 1444 O TYR A 103 2110 2233 1948 435 -81 178 O ATOM 1445 CB TYR A 103 -17.156 -13.816 -3.444 1.00 17.37 C ANISOU 1445 CB TYR A 103 2315 2425 1860 492 -22 135 C ATOM 1446 CG TYR A 103 -18.027 -13.112 -2.458 1.00 16.33 C ANISOU 1446 CG TYR A 103 2232 2360 1613 548 3 135 C ATOM 1447 CD1 TYR A 103 -19.396 -13.216 -2.540 1.00 15.23 C ANISOU 1447 CD1 TYR A 103 2087 2212 1488 556 82 175 C ATOM 1448 CD2 TYR A 103 -17.497 -12.287 -1.492 1.00 17.16 C ANISOU 1448 CD2 TYR A 103 2385 2534 1600 594 -54 85 C ATOM 1449 CE1 TYR A 103 -20.225 -12.555 -1.653 1.00 16.09 C ANISOU 1449 CE1 TYR A 103 2237 2383 1494 612 116 174 C ATOM 1450 CE2 TYR A 103 -18.300 -11.605 -0.616 1.00 17.19 C ANISOU 1450 CE2 TYR A 103 2436 2604 1492 652 -29 70 C ATOM 1451 CZ TYR A 103 -19.692 -11.729 -0.705 1.00 16.81 C ANISOU 1451 CZ TYR A 103 2382 2549 1458 661 63 117 C ATOM 1452 OH TYR A 103 -20.541 -11.058 0.158 1.00 19.10 O ANISOU 1452 OH TYR A 103 2713 2905 1639 723 101 103 O ATOM 0 H TYR A 103 -15.127 -15.002 -2.032 1.00 19.17 H new ATOM 0 HA TYR A 103 -17.566 -15.760 -2.821 1.00 18.11 H new ATOM 0 HB2 TYR A 103 -16.343 -13.301 -3.564 1.00 17.37 H new ATOM 0 HB3 TYR A 103 -17.609 -13.834 -4.301 1.00 17.37 H new ATOM 0 HD1 TYR A 103 -19.773 -13.743 -3.207 1.00 15.23 H new ATOM 0 HD2 TYR A 103 -16.574 -12.190 -1.433 1.00 17.16 H new ATOM 0 HE1 TYR A 103 -21.146 -12.673 -1.702 1.00 16.09 H new ATOM 0 HE2 TYR A 103 -17.921 -11.061 0.036 1.00 17.19 H new ATOM 0 HH TYR A 103 -20.227 -10.297 0.325 1.00 19.10 H new ATOM 1462 N SER A 104 -16.890 -16.388 -5.182 1.00 15.89 N ANISOU 1462 N SER A 104 1999 2095 1943 419 27 225 N ATOM 1463 CA SER A 104 -16.433 -16.810 -6.499 1.00 16.74 C ANISOU 1463 CA SER A 104 2066 2134 2161 367 19 179 C ATOM 1464 C SER A 104 -17.078 -15.924 -7.551 1.00 18.68 C ANISOU 1464 C SER A 104 2330 2357 2410 330 28 101 C ATOM 1465 O SER A 104 -18.284 -15.779 -7.557 1.00 20.99 O ANISOU 1465 O SER A 104 2631 2646 2700 336 67 116 O ATOM 1466 CB SER A 104 -16.810 -18.268 -6.758 1.00 18.83 C ANISOU 1466 CB SER A 104 2267 2343 2545 366 56 246 C ATOM 1467 OG SER A 104 -16.139 -19.129 -5.854 1.00 21.04 O ANISOU 1467 OG SER A 104 2521 2637 2836 398 45 327 O ATOM 0 H SER A 104 -17.728 -16.522 -5.046 1.00 15.89 H new ATOM 0 HA SER A 104 -15.467 -16.730 -6.540 1.00 16.74 H new ATOM 0 HB2 SER A 104 -17.769 -18.380 -6.666 1.00 18.83 H new ATOM 0 HB3 SER A 104 -16.582 -18.508 -7.670 1.00 18.83 H new ATOM 0 HG SER A 104 -16.692 -19.451 -5.310 1.00 21.04 H new ATOM 1473 N LEU A 105 -16.256 -15.299 -8.399 1.00 16.59 N ANISOU 1473 N LEU A 105 2071 2081 2153 295 -6 27 N ATOM 1474 CA LEU A 105 -16.743 -14.374 -9.401 1.00 16.40 C ANISOU 1474 CA LEU A 105 2065 2042 2124 263 -2 -36 C ATOM 1475 C LEU A 105 -16.688 -15.026 -10.783 1.00 16.32 C ANISOU 1475 C LEU A 105 2019 1984 2199 230 12 -65 C ATOM 1476 O LEU A 105 -15.728 -15.740 -11.101 1.00 15.22 O ANISOU 1476 O LEU A 105 1846 1827 2110 222 2 -69 O ATOM 1477 CB LEU A 105 -15.919 -13.101 -9.460 1.00 17.38 C ANISOU 1477 CB LEU A 105 2216 2187 2201 249 -45 -92 C ATOM 1478 CG LEU A 105 -15.557 -12.316 -8.190 1.00 23.19 C ANISOU 1478 CG LEU A 105 2985 2969 2856 282 -85 -97 C ATOM 1479 CD1 LEU A 105 -14.919 -10.967 -8.534 1.00 25.77 C ANISOU 1479 CD1 LEU A 105 3325 3292 3174 259 -129 -164 C ATOM 1480 CD2 LEU A 105 -16.731 -12.122 -7.297 1.00 25.51 C ANISOU 1480 CD2 LEU A 105 3312 3297 3085 320 -57 -70 C ATOM 0 H LEU A 105 -15.403 -15.405 -8.402 1.00 16.59 H new ATOM 0 HA LEU A 105 -17.653 -14.149 -9.152 1.00 16.40 H new ATOM 0 HB2 LEU A 105 -15.084 -13.327 -9.899 1.00 17.38 H new ATOM 0 HB3 LEU A 105 -16.390 -12.488 -10.045 1.00 17.38 H new ATOM 0 HG LEU A 105 -14.907 -12.851 -7.708 1.00 23.19 H new ATOM 0 HD11 LEU A 105 -14.701 -10.494 -7.716 1.00 25.77 H new ATOM 0 HD12 LEU A 105 -14.109 -11.113 -9.048 1.00 25.77 H new ATOM 0 HD13 LEU A 105 -15.542 -10.438 -9.057 1.00 25.77 H new ATOM 0 HD21 LEU A 105 -16.460 -11.624 -6.510 1.00 25.51 H new ATOM 0 HD22 LEU A 105 -17.420 -11.629 -7.770 1.00 25.51 H new ATOM 0 HD23 LEU A 105 -17.080 -12.986 -7.028 1.00 25.51 H new ATOM 1492 N PHE A 106 -17.678 -14.733 -11.618 1.00 13.56 N ANISOU 1492 N PHE A 106 1676 1616 1861 213 30 -92 N ATOM 1493 CA PHE A 106 -17.719 -15.262 -12.986 1.00 15.52 C ANISOU 1493 CA PHE A 106 1898 1829 2169 190 35 -134 C ATOM 1494 C PHE A 106 -18.184 -14.127 -13.884 1.00 16.07 C ANISOU 1494 C PHE A 106 1998 1909 2198 168 30 -179 C ATOM 1495 O PHE A 106 -19.264 -13.563 -13.657 1.00 15.39 O ANISOU 1495 O PHE A 106 1933 1824 2091 171 37 -170 O ATOM 1496 CB PHE A 106 -18.678 -16.456 -13.115 1.00 14.09 C ANISOU 1496 CB PHE A 106 1679 1603 2073 199 55 -111 C ATOM 1497 CG PHE A 106 -18.644 -17.100 -14.477 1.00 15.06 C ANISOU 1497 CG PHE A 106 1773 1691 2257 184 49 -170 C ATOM 1498 CD1 PHE A 106 -19.304 -16.530 -15.553 1.00 14.93 C ANISOU 1498 CD1 PHE A 106 1777 1677 2220 169 41 -223 C ATOM 1499 CD2 PHE A 106 -17.944 -18.270 -14.655 1.00 15.00 C ANISOU 1499 CD2 PHE A 106 1719 1653 2327 190 47 -176 C ATOM 1500 CE1 PHE A 106 -19.195 -17.147 -16.810 1.00 15.98 C ANISOU 1500 CE1 PHE A 106 1888 1790 2392 165 30 -287 C ATOM 1501 CE2 PHE A 106 -17.868 -18.890 -15.907 1.00 17.03 C ANISOU 1501 CE2 PHE A 106 1952 1884 2637 184 39 -247 C ATOM 1502 CZ PHE A 106 -18.491 -18.316 -16.960 1.00 15.29 C ANISOU 1502 CZ PHE A 106 1757 1674 2378 174 30 -304 C ATOM 0 H PHE A 106 -18.342 -14.226 -11.414 1.00 13.56 H new ATOM 0 HA PHE A 106 -16.839 -15.584 -13.237 1.00 15.52 H new ATOM 0 HB2 PHE A 106 -18.452 -17.119 -12.444 1.00 14.09 H new ATOM 0 HB3 PHE A 106 -19.582 -16.159 -12.926 1.00 14.09 H new ATOM 0 HD1 PHE A 106 -19.808 -15.756 -15.446 1.00 14.93 H new ATOM 0 HD2 PHE A 106 -17.512 -18.657 -13.928 1.00 15.00 H new ATOM 0 HE1 PHE A 106 -19.605 -16.759 -17.549 1.00 15.98 H new ATOM 0 HE2 PHE A 106 -17.396 -19.684 -16.013 1.00 17.03 H new ATOM 0 HZ PHE A 106 -18.442 -18.718 -17.797 1.00 15.29 H new ATOM 1512 N GLY A 107 -17.399 -13.806 -14.898 1.00 15.09 N ANISOU 1512 N GLY A 107 1874 1792 2066 148 23 -220 N ATOM 1513 CA GLY A 107 -17.746 -12.723 -15.805 1.00 15.14 C ANISOU 1513 CA GLY A 107 1906 1812 2034 130 19 -249 C ATOM 1514 C GLY A 107 -17.627 -13.126 -17.253 1.00 15.53 C ANISOU 1514 C GLY A 107 1944 1862 2096 122 26 -289 C ATOM 1515 O GLY A 107 -16.734 -13.885 -17.635 1.00 15.18 O ANISOU 1515 O GLY A 107 1874 1816 2078 126 34 -307 O ATOM 0 H GLY A 107 -16.658 -14.203 -15.080 1.00 15.09 H new ATOM 0 HA2 GLY A 107 -18.654 -12.433 -15.626 1.00 15.14 H new ATOM 0 HA3 GLY A 107 -17.167 -11.964 -15.635 1.00 15.14 H new ATOM 1519 N THR A 108 -18.533 -12.568 -18.072 1.00 14.72 N ANISOU 1519 N THR A 108 1861 1765 1969 115 20 -306 N ATOM 1520 CA THR A 108 -18.559 -12.833 -19.520 1.00 13.34 C ANISOU 1520 CA THR A 108 1685 1604 1780 116 21 -350 C ATOM 1521 C THR A 108 -17.956 -11.655 -20.275 1.00 14.55 C ANISOU 1521 C THR A 108 1858 1797 1874 103 29 -342 C ATOM 1522 O THR A 108 -18.385 -10.517 -20.072 1.00 14.92 O ANISOU 1522 O THR A 108 1925 1847 1898 91 20 -314 O ATOM 1523 CB THR A 108 -19.988 -12.994 -20.029 1.00 16.09 C ANISOU 1523 CB THR A 108 2039 1934 2140 120 0 -370 C ATOM 1524 OG1 THR A 108 -20.806 -11.882 -19.667 1.00 15.88 O ANISOU 1524 OG1 THR A 108 2037 1907 2092 110 -9 -339 O ATOM 1525 CG2 THR A 108 -20.618 -14.252 -19.458 1.00 18.24 C ANISOU 1525 CG2 THR A 108 2278 2157 2496 133 -6 -374 C ATOM 0 H THR A 108 -19.146 -12.028 -17.804 1.00 14.72 H new ATOM 0 HA THR A 108 -18.055 -13.649 -19.668 1.00 13.34 H new ATOM 0 HB THR A 108 -19.936 -13.050 -20.996 1.00 16.09 H new ATOM 0 HG1 THR A 108 -20.349 -11.178 -19.692 1.00 15.88 H new ATOM 0 HG21 THR A 108 -21.525 -14.340 -19.791 1.00 18.24 H new ATOM 0 HG22 THR A 108 -20.099 -15.025 -19.728 1.00 18.24 H new ATOM 0 HG23 THR A 108 -20.633 -14.196 -18.490 1.00 18.24 H new ATOM 1533 N PHE A 109 -16.982 -11.934 -21.153 1.00 14.85 N ANISOU 1533 N PHE A 109 1886 1864 1895 109 51 -362 N ATOM 1534 CA PHE A 109 -16.401 -10.942 -22.072 1.00 15.61 C ANISOU 1534 CA PHE A 109 1992 2002 1938 103 71 -343 C ATOM 1535 C PHE A 109 -15.817 -9.835 -21.198 1.00 16.04 C ANISOU 1535 C PHE A 109 2041 2043 2010 82 70 -294 C ATOM 1536 O PHE A 109 -14.991 -10.143 -20.315 1.00 15.50 O ANISOU 1536 O PHE A 109 1951 1956 1983 80 69 -288 O ATOM 1537 CB PHE A 109 -17.399 -10.532 -23.140 1.00 16.71 C ANISOU 1537 CB PHE A 109 2158 2168 2022 110 58 -352 C ATOM 1538 CG PHE A 109 -17.782 -11.670 -24.054 1.00 20.55 C ANISOU 1538 CG PHE A 109 2645 2669 2493 137 50 -419 C ATOM 1539 CD1 PHE A 109 -16.927 -12.085 -25.061 1.00 19.13 C ANISOU 1539 CD1 PHE A 109 2460 2537 2270 160 81 -449 C ATOM 1540 CD2 PHE A 109 -18.972 -12.347 -23.870 1.00 24.23 C ANISOU 1540 CD2 PHE A 109 3111 3098 2997 143 10 -454 C ATOM 1541 CE1 PHE A 109 -17.257 -13.145 -25.900 1.00 19.10 C ANISOU 1541 CE1 PHE A 109 2457 2547 2252 193 66 -529 C ATOM 1542 CE2 PHE A 109 -19.315 -13.410 -24.700 1.00 23.20 C ANISOU 1542 CE2 PHE A 109 2974 2970 2869 170 -10 -528 C ATOM 1543 CZ PHE A 109 -18.448 -13.828 -25.702 1.00 20.14 C ANISOU 1543 CZ PHE A 109 2586 2633 2432 197 14 -573 C ATOM 0 H PHE A 109 -16.635 -12.717 -21.232 1.00 14.85 H new ATOM 0 HA PHE A 109 -15.673 -11.291 -22.609 1.00 15.61 H new ATOM 0 HB2 PHE A 109 -18.197 -10.183 -22.713 1.00 16.71 H new ATOM 0 HB3 PHE A 109 -17.022 -9.811 -23.669 1.00 16.71 H new ATOM 0 HD1 PHE A 109 -16.116 -11.646 -25.179 1.00 19.13 H new ATOM 0 HD2 PHE A 109 -19.548 -12.091 -23.186 1.00 24.23 H new ATOM 0 HE1 PHE A 109 -16.683 -13.394 -26.588 1.00 19.10 H new ATOM 0 HE2 PHE A 109 -20.130 -13.843 -24.583 1.00 23.20 H new ATOM 0 HZ PHE A 109 -18.664 -14.559 -26.235 1.00 20.14 H new ATOM 1553 N PHE A 110 -16.167 -8.542 -21.390 1.00 14.75 N ANISOU 1553 N PHE A 110 1892 1885 1827 67 62 -259 N ATOM 1554 CA PHE A 110 -15.516 -7.548 -20.541 1.00 15.15 C ANISOU 1554 CA PHE A 110 1928 1913 1914 50 52 -227 C ATOM 1555 C PHE A 110 -15.856 -7.792 -19.083 1.00 15.17 C ANISOU 1555 C PHE A 110 1937 1885 1942 53 22 -242 C ATOM 1556 O PHE A 110 -15.104 -7.399 -18.210 1.00 14.53 O ANISOU 1556 O PHE A 110 1842 1788 1891 49 5 -235 O ATOM 1557 CB PHE A 110 -15.887 -6.147 -20.954 1.00 15.57 C ANISOU 1557 CB PHE A 110 1988 1966 1963 34 45 -190 C ATOM 1558 CG PHE A 110 -14.988 -5.108 -20.345 1.00 15.83 C ANISOU 1558 CG PHE A 110 1993 1970 2053 18 34 -162 C ATOM 1559 CD1 PHE A 110 -13.659 -5.073 -20.661 1.00 16.37 C ANISOU 1559 CD1 PHE A 110 2024 2043 2153 13 60 -139 C ATOM 1560 CD2 PHE A 110 -15.474 -4.217 -19.392 1.00 15.16 C ANISOU 1560 CD2 PHE A 110 1913 1848 1998 10 -6 -168 C ATOM 1561 CE1 PHE A 110 -12.815 -4.162 -20.075 1.00 19.67 C ANISOU 1561 CE1 PHE A 110 2405 2423 2644 -3 40 -119 C ATOM 1562 CE2 PHE A 110 -14.632 -3.313 -18.808 1.00 17.35 C ANISOU 1562 CE2 PHE A 110 2160 2093 2340 -2 -28 -158 C ATOM 1563 CZ PHE A 110 -13.317 -3.270 -19.154 1.00 19.79 C ANISOU 1563 CZ PHE A 110 2427 2400 2692 -11 -10 -133 C ATOM 0 H PHE A 110 -16.736 -8.247 -21.964 1.00 14.75 H new ATOM 0 HA PHE A 110 -14.557 -7.640 -20.652 1.00 15.15 H new ATOM 0 HB2 PHE A 110 -15.848 -6.077 -21.921 1.00 15.57 H new ATOM 0 HB3 PHE A 110 -16.804 -5.969 -20.694 1.00 15.57 H new ATOM 0 HD1 PHE A 110 -13.321 -5.676 -21.283 1.00 16.37 H new ATOM 0 HD2 PHE A 110 -16.372 -4.237 -19.153 1.00 15.16 H new ATOM 0 HE1 PHE A 110 -11.912 -4.148 -20.298 1.00 19.67 H new ATOM 0 HE2 PHE A 110 -14.960 -2.723 -18.169 1.00 17.35 H new ATOM 0 HZ PHE A 110 -12.756 -2.637 -18.768 1.00 19.79 H new ATOM 1573 N GLY A 111 -16.990 -8.439 -18.804 1.00 14.72 N ANISOU 1573 N GLY A 111 1898 1820 1876 65 14 -259 N ATOM 1574 CA GLY A 111 -17.290 -8.846 -17.439 1.00 14.37 C ANISOU 1574 CA GLY A 111 1858 1757 1847 77 -1 -260 C ATOM 1575 C GLY A 111 -16.226 -9.737 -16.851 1.00 14.14 C ANISOU 1575 C GLY A 111 1806 1727 1841 87 2 -261 C ATOM 1576 O GLY A 111 -16.020 -9.743 -15.638 1.00 12.95 O ANISOU 1576 O GLY A 111 1656 1571 1692 98 -16 -252 O ATOM 0 H GLY A 111 -17.589 -8.647 -19.385 1.00 14.72 H new ATOM 0 HA2 GLY A 111 -17.388 -8.056 -16.884 1.00 14.37 H new ATOM 0 HA3 GLY A 111 -18.141 -9.311 -17.424 1.00 14.37 H new ATOM 1580 N GLY A 112 -15.560 -10.529 -17.704 1.00 15.20 N ANISOU 1580 N GLY A 112 1919 1869 1989 87 22 -274 N ATOM 1581 CA GLY A 112 -14.458 -11.341 -17.217 1.00 14.60 C ANISOU 1581 CA GLY A 112 1813 1786 1949 95 24 -272 C ATOM 1582 C GLY A 112 -13.257 -10.515 -16.822 1.00 13.98 C ANISOU 1582 C GLY A 112 1720 1708 1886 84 10 -258 C ATOM 1583 O GLY A 112 -12.611 -10.786 -15.798 1.00 15.65 O ANISOU 1583 O GLY A 112 1917 1910 2120 93 -14 -250 O ATOM 0 H GLY A 112 -15.731 -10.604 -18.544 1.00 15.20 H new ATOM 0 HA2 GLY A 112 -14.756 -11.859 -16.453 1.00 14.60 H new ATOM 0 HA3 GLY A 112 -14.199 -11.974 -17.905 1.00 14.60 H new ATOM 1587 N ARG A 113 -12.948 -9.467 -17.604 1.00 14.62 N ANISOU 1587 N ARG A 113 1798 1798 1961 67 21 -250 N ATOM 1588 CA ARG A 113 -11.888 -8.538 -17.237 1.00 16.16 C ANISOU 1588 CA ARG A 113 1967 1979 2194 55 2 -234 C ATOM 1589 C ARG A 113 -12.211 -7.863 -15.921 1.00 15.57 C ANISOU 1589 C ARG A 113 1911 1888 2116 59 -50 -241 C ATOM 1590 O ARG A 113 -11.355 -7.714 -15.074 1.00 14.23 O ANISOU 1590 O ARG A 113 1722 1705 1978 63 -87 -245 O ATOM 1591 CB ARG A 113 -11.706 -7.483 -18.320 1.00 21.16 C ANISOU 1591 CB ARG A 113 2590 2619 2832 37 27 -210 C ATOM 1592 CG ARG A 113 -11.328 -7.980 -19.686 1.00 26.46 C ANISOU 1592 CG ARG A 113 3247 3321 3487 41 84 -201 C ATOM 1593 CD ARG A 113 -9.828 -8.265 -19.796 1.00 26.87 C ANISOU 1593 CD ARG A 113 3247 3366 3597 41 108 -189 C ATOM 1594 NE ARG A 113 -8.956 -7.062 -19.744 1.00 22.84 N ANISOU 1594 NE ARG A 113 2697 2831 3152 22 103 -147 N ATOM 1595 CZ ARG A 113 -7.669 -7.075 -20.049 1.00 23.35 C ANISOU 1595 CZ ARG A 113 2705 2885 3281 19 133 -123 C ATOM 1596 NH1 ARG A 113 -7.122 -8.204 -20.467 1.00 21.53 N ANISOU 1596 NH1 ARG A 113 2458 2675 3048 36 174 -139 N ATOM 1597 NH2 ARG A 113 -6.919 -5.972 -19.979 1.00 25.76 N ANISOU 1597 NH2 ARG A 113 2963 3156 3668 0 124 -81 N ATOM 0 H ARG A 113 -13.343 -9.285 -18.346 1.00 14.62 H new ATOM 0 HA ARG A 113 -11.064 -9.040 -17.143 1.00 16.16 H new ATOM 0 HB2 ARG A 113 -12.533 -6.982 -18.398 1.00 21.16 H new ATOM 0 HB3 ARG A 113 -11.024 -6.860 -18.025 1.00 21.16 H new ATOM 0 HG2 ARG A 113 -11.826 -8.789 -19.885 1.00 26.46 H new ATOM 0 HG3 ARG A 113 -11.581 -7.321 -20.351 1.00 26.46 H new ATOM 0 HD2 ARG A 113 -9.573 -8.865 -19.078 1.00 26.87 H new ATOM 0 HD3 ARG A 113 -9.661 -8.733 -20.629 1.00 26.87 H new ATOM 0 HE ARG A 113 -9.308 -6.316 -19.502 1.00 22.84 H new ATOM 0 HH11 ARG A 113 -7.602 -8.914 -20.537 1.00 21.53 H new ATOM 0 HH12 ARG A 113 -6.286 -8.228 -20.669 1.00 21.53 H new ATOM 0 HH21 ARG A 113 -7.271 -5.228 -19.730 1.00 25.76 H new ATOM 0 HH22 ARG A 113 -6.084 -6.006 -20.183 1.00 25.76 H new ATOM 1611 N ILE A 114 -13.469 -7.439 -15.734 1.00 15.06 N ANISOU 1611 N ILE A 114 1882 1827 2012 62 -57 -247 N ATOM 1612 CA ILE A 114 -13.871 -6.857 -14.454 1.00 14.29 C ANISOU 1612 CA ILE A 114 1807 1724 1900 77 -99 -263 C ATOM 1613 C ILE A 114 -13.655 -7.853 -13.325 1.00 14.59 C ANISOU 1613 C ILE A 114 1849 1775 1920 104 -115 -264 C ATOM 1614 O ILE A 114 -13.131 -7.510 -12.266 1.00 14.00 O ANISOU 1614 O ILE A 114 1776 1702 1842 120 -160 -278 O ATOM 1615 CB ILE A 114 -15.344 -6.406 -14.508 1.00 14.89 C ANISOU 1615 CB ILE A 114 1915 1801 1941 80 -91 -267 C ATOM 1616 CG1 ILE A 114 -15.536 -5.299 -15.540 1.00 13.49 C ANISOU 1616 CG1 ILE A 114 1730 1609 1784 55 -84 -256 C ATOM 1617 CG2 ILE A 114 -15.806 -5.955 -13.113 1.00 16.43 C ANISOU 1617 CG2 ILE A 114 2134 1999 2108 106 -124 -289 C ATOM 1618 CD1 ILE A 114 -16.979 -5.054 -15.866 1.00 12.68 C ANISOU 1618 CD1 ILE A 114 1654 1507 1658 56 -72 -254 C ATOM 0 H ILE A 114 -14.091 -7.480 -16.326 1.00 15.06 H new ATOM 0 HA ILE A 114 -13.319 -6.078 -14.282 1.00 14.29 H new ATOM 0 HB ILE A 114 -15.892 -7.158 -14.783 1.00 14.89 H new ATOM 0 HG12 ILE A 114 -15.140 -4.479 -15.206 1.00 13.49 H new ATOM 0 HG13 ILE A 114 -15.060 -5.533 -16.352 1.00 13.49 H new ATOM 0 HG21 ILE A 114 -16.733 -5.673 -13.155 1.00 16.43 H new ATOM 0 HG22 ILE A 114 -15.721 -6.693 -12.489 1.00 16.43 H new ATOM 0 HG23 ILE A 114 -15.256 -5.214 -12.814 1.00 16.43 H new ATOM 0 HD11 ILE A 114 -17.046 -4.344 -16.524 1.00 12.68 H new ATOM 0 HD12 ILE A 114 -17.372 -5.865 -16.225 1.00 12.68 H new ATOM 0 HD13 ILE A 114 -17.453 -4.794 -15.061 1.00 12.68 H new ATOM 1630 N ALA A 115 -14.062 -9.115 -13.521 1.00 14.10 N ANISOU 1630 N ALA A 115 1788 1721 1850 114 -82 -248 N ATOM 1631 CA ALA A 115 -13.952 -10.072 -12.435 1.00 15.29 C ANISOU 1631 CA ALA A 115 1939 1882 1991 142 -93 -232 C ATOM 1632 C ALA A 115 -12.489 -10.295 -12.075 1.00 16.24 C ANISOU 1632 C ALA A 115 2028 1998 2146 144 -124 -230 C ATOM 1633 O ALA A 115 -12.151 -10.441 -10.907 1.00 14.95 O ANISOU 1633 O ALA A 115 1870 1849 1962 169 -162 -223 O ATOM 1634 CB ALA A 115 -14.625 -11.386 -12.836 1.00 16.08 C ANISOU 1634 CB ALA A 115 2029 1975 2107 149 -53 -212 C ATOM 0 H ALA A 115 -14.393 -9.421 -14.253 1.00 14.10 H new ATOM 0 HA ALA A 115 -14.403 -9.721 -11.651 1.00 15.29 H new ATOM 0 HB1 ALA A 115 -14.550 -12.023 -12.109 1.00 16.08 H new ATOM 0 HB2 ALA A 115 -15.562 -11.224 -13.028 1.00 16.08 H new ATOM 0 HB3 ALA A 115 -14.190 -11.745 -13.626 1.00 16.08 H new ATOM 1640 N LEU A 116 -11.622 -10.373 -13.080 1.00 15.23 N ANISOU 1640 N LEU A 116 1865 1854 2069 120 -107 -235 N ATOM 1641 CA LEU A 116 -10.195 -10.524 -12.800 1.00 15.99 C ANISOU 1641 CA LEU A 116 1921 1937 2216 119 -135 -232 C ATOM 1642 C LEU A 116 -9.641 -9.349 -12.032 1.00 16.13 C ANISOU 1642 C LEU A 116 1939 1949 2240 119 -197 -251 C ATOM 1643 O LEU A 116 -8.764 -9.522 -11.149 1.00 16.27 O ANISOU 1643 O LEU A 116 1940 1965 2279 135 -249 -252 O ATOM 1644 CB LEU A 116 -9.433 -10.718 -14.104 1.00 17.07 C ANISOU 1644 CB LEU A 116 2018 2061 2407 97 -92 -233 C ATOM 1645 CG LEU A 116 -9.691 -12.022 -14.814 1.00 16.54 C ANISOU 1645 CG LEU A 116 1940 1996 2349 104 -44 -233 C ATOM 1646 CD1 LEU A 116 -9.218 -11.974 -16.260 1.00 16.94 C ANISOU 1646 CD1 LEU A 116 1966 2050 2420 91 8 -244 C ATOM 1647 CD2 LEU A 116 -9.009 -13.190 -14.077 1.00 18.25 C ANISOU 1647 CD2 LEU A 116 2126 2199 2611 122 -61 -218 C ATOM 0 H LEU A 116 -11.831 -10.342 -13.914 1.00 15.23 H new ATOM 0 HA LEU A 116 -10.082 -11.308 -12.240 1.00 15.99 H new ATOM 0 HB2 LEU A 116 -9.658 -9.990 -14.704 1.00 17.07 H new ATOM 0 HB3 LEU A 116 -8.483 -10.650 -13.919 1.00 17.07 H new ATOM 0 HG LEU A 116 -10.650 -12.166 -14.814 1.00 16.54 H new ATOM 0 HD11 LEU A 116 -9.398 -12.826 -16.688 1.00 16.94 H new ATOM 0 HD12 LEU A 116 -9.690 -11.270 -16.732 1.00 16.94 H new ATOM 0 HD13 LEU A 116 -8.265 -11.796 -16.283 1.00 16.94 H new ATOM 0 HD21 LEU A 116 -9.187 -14.019 -14.549 1.00 18.25 H new ATOM 0 HD22 LEU A 116 -8.052 -13.037 -14.043 1.00 18.25 H new ATOM 0 HD23 LEU A 116 -9.358 -13.251 -13.174 1.00 18.25 H new ATOM 1659 N GLN A 117 -10.085 -8.136 -12.359 1.00 15.80 N ANISOU 1659 N GLN A 117 1912 1900 2192 104 -201 -268 N ATOM 1660 CA GLN A 117 -9.546 -6.972 -11.670 1.00 15.95 C ANISOU 1660 CA GLN A 117 1921 1900 2238 105 -267 -297 C ATOM 1661 C GLN A 117 -10.068 -6.895 -10.252 1.00 17.13 C ANISOU 1661 C GLN A 117 2114 2078 2318 144 -319 -323 C ATOM 1662 O GLN A 117 -9.335 -6.474 -9.353 1.00 16.89 O ANISOU 1662 O GLN A 117 2074 2042 2301 160 -392 -354 O ATOM 1663 CB GLN A 117 -9.839 -5.702 -12.466 1.00 15.91 C ANISOU 1663 CB GLN A 117 1908 1870 2266 77 -256 -302 C ATOM 1664 CG GLN A 117 -9.339 -4.381 -11.809 1.00 18.43 C ANISOU 1664 CG GLN A 117 2208 2153 2642 76 -331 -340 C ATOM 1665 CD GLN A 117 -7.838 -4.337 -11.567 1.00 20.98 C ANISOU 1665 CD GLN A 117 2472 2443 3056 70 -379 -344 C ATOM 1666 OE1 GLN A 117 -7.034 -5.092 -12.164 1.00 20.30 O ANISOU 1666 OE1 GLN A 117 2348 2353 3010 58 -342 -308 O ATOM 1667 NE2 GLN A 117 -7.426 -3.470 -10.644 1.00 22.30 N ANISOU 1667 NE2 GLN A 117 2627 2583 3262 82 -467 -394 N ATOM 0 H GLN A 117 -10.679 -7.970 -12.958 1.00 15.80 H new ATOM 0 HA GLN A 117 -8.582 -7.060 -11.609 1.00 15.95 H new ATOM 0 HB2 GLN A 117 -9.432 -5.785 -13.343 1.00 15.91 H new ATOM 0 HB3 GLN A 117 -10.797 -5.636 -12.603 1.00 15.91 H new ATOM 0 HG2 GLN A 117 -9.587 -3.635 -12.377 1.00 18.43 H new ATOM 0 HG3 GLN A 117 -9.797 -4.258 -10.963 1.00 18.43 H new ATOM 0 HE21 GLN A 117 -7.995 -2.962 -10.247 1.00 22.30 H new ATOM 0 HE22 GLN A 117 -6.591 -3.418 -10.445 1.00 22.30 H new ATOM 1676 N VAL A 118 -11.320 -7.281 -10.025 1.00 16.28 N ANISOU 1676 N VAL A 118 2050 2000 2135 162 -283 -313 N ATOM 1677 CA VAL A 118 -11.818 -7.379 -8.644 1.00 15.54 C ANISOU 1677 CA VAL A 118 1997 1946 1960 210 -316 -325 C ATOM 1678 C VAL A 118 -10.960 -8.372 -7.872 1.00 16.32 C ANISOU 1678 C VAL A 118 2084 2066 2052 235 -346 -300 C ATOM 1679 O VAL A 118 -10.595 -8.137 -6.721 1.00 16.02 O ANISOU 1679 O VAL A 118 2062 2055 1969 272 -411 -323 O ATOM 1680 CB VAL A 118 -13.293 -7.773 -8.636 1.00 15.41 C ANISOU 1680 CB VAL A 118 2016 1953 1884 224 -256 -301 C ATOM 1681 CG1 VAL A 118 -13.808 -7.881 -7.222 1.00 16.46 C ANISOU 1681 CG1 VAL A 118 2190 2137 1927 280 -274 -301 C ATOM 1682 CG2 VAL A 118 -14.144 -6.759 -9.401 1.00 15.23 C ANISOU 1682 CG2 VAL A 118 2004 1908 1876 200 -234 -323 C ATOM 0 H VAL A 118 -11.889 -7.487 -10.636 1.00 16.28 H new ATOM 0 HA VAL A 118 -11.752 -6.515 -8.208 1.00 15.54 H new ATOM 0 HB VAL A 118 -13.362 -8.636 -9.074 1.00 15.41 H new ATOM 0 HG11 VAL A 118 -14.745 -8.132 -7.237 1.00 16.46 H new ATOM 0 HG12 VAL A 118 -13.301 -8.555 -6.743 1.00 16.46 H new ATOM 0 HG13 VAL A 118 -13.710 -7.026 -6.775 1.00 16.46 H new ATOM 0 HG21 VAL A 118 -15.074 -7.035 -9.379 1.00 15.23 H new ATOM 0 HG22 VAL A 118 -14.056 -5.886 -8.988 1.00 15.23 H new ATOM 0 HG23 VAL A 118 -13.843 -6.713 -10.322 1.00 15.23 H new ATOM 1692 N ALA A 119 -10.678 -9.521 -8.489 1.00 17.30 N ANISOU 1692 N ALA A 119 2179 2178 2217 220 -303 -255 N ATOM 1693 CA ALA A 119 -9.859 -10.522 -7.817 1.00 16.45 C ANISOU 1693 CA ALA A 119 2050 2081 2118 243 -330 -223 C ATOM 1694 C ALA A 119 -8.503 -9.948 -7.421 1.00 18.04 C ANISOU 1694 C ALA A 119 2223 2267 2366 242 -411 -256 C ATOM 1695 O ALA A 119 -7.959 -10.305 -6.380 1.00 17.15 O ANISOU 1695 O ALA A 119 2112 2178 2226 276 -469 -247 O ATOM 1696 CB ALA A 119 -9.665 -11.734 -8.710 1.00 15.94 C ANISOU 1696 CB ALA A 119 1947 1991 2118 222 -274 -184 C ATOM 0 H ALA A 119 -10.945 -9.734 -9.278 1.00 17.30 H new ATOM 0 HA ALA A 119 -10.324 -10.793 -7.010 1.00 16.45 H new ATOM 0 HB1 ALA A 119 -9.119 -12.391 -8.250 1.00 15.94 H new ATOM 0 HB2 ALA A 119 -10.528 -12.123 -8.921 1.00 15.94 H new ATOM 0 HB3 ALA A 119 -9.224 -11.464 -9.531 1.00 15.94 H new ATOM 1702 N ALA A 120 -7.940 -9.091 -8.260 1.00 18.39 N ANISOU 1702 N ALA A 120 2235 2268 2486 203 -416 -286 N ATOM 1703 CA ALA A 120 -6.628 -8.502 -8.002 1.00 20.30 C ANISOU 1703 CA ALA A 120 2431 2477 2803 196 -491 -316 C ATOM 1704 C ALA A 120 -6.605 -7.634 -6.758 1.00 21.25 C ANISOU 1704 C ALA A 120 2581 2617 2874 232 -587 -371 C ATOM 1705 O ALA A 120 -5.560 -7.533 -6.103 1.00 23.17 O ANISOU 1705 O ALA A 120 2797 2850 3157 247 -672 -393 O ATOM 1706 CB ALA A 120 -6.183 -7.670 -9.207 1.00 21.10 C ANISOU 1706 CB ALA A 120 2487 2527 3003 149 -463 -324 C ATOM 0 H ALA A 120 -8.304 -8.833 -8.995 1.00 18.39 H new ATOM 0 HA ALA A 120 -6.016 -9.239 -7.853 1.00 20.30 H new ATOM 0 HB1 ALA A 120 -5.312 -7.282 -9.029 1.00 21.10 H new ATOM 0 HB2 ALA A 120 -6.129 -8.239 -9.991 1.00 21.10 H new ATOM 0 HB3 ALA A 120 -6.826 -6.961 -9.366 1.00 21.10 H new ATOM 1712 N VAL A 121 -7.718 -6.961 -6.435 1.00 19.50 N ANISOU 1712 N VAL A 121 2413 2424 2574 250 -580 -402 N ATOM 1713 CA VAL A 121 -7.747 -5.964 -5.374 1.00 20.96 C ANISOU 1713 CA VAL A 121 2625 2624 2715 287 -669 -475 C ATOM 1714 C VAL A 121 -8.545 -6.365 -4.160 1.00 22.06 C ANISOU 1714 C VAL A 121 2831 2843 2707 351 -678 -476 C ATOM 1715 O VAL A 121 -8.456 -5.665 -3.132 1.00 25.27 O ANISOU 1715 O VAL A 121 3265 3278 3058 396 -761 -545 O ATOM 1716 CB VAL A 121 -8.238 -4.606 -5.901 1.00 21.88 C ANISOU 1716 CB VAL A 121 2738 2700 2876 261 -667 -525 C ATOM 1717 CG1 VAL A 121 -7.361 -4.127 -7.054 1.00 23.93 C ANISOU 1717 CG1 VAL A 121 2925 2883 3284 203 -658 -510 C ATOM 1718 CG2 VAL A 121 -9.694 -4.674 -6.323 1.00 21.05 C ANISOU 1718 CG2 VAL A 121 2677 2619 2702 259 -578 -500 C ATOM 0 H VAL A 121 -8.474 -7.075 -6.829 1.00 19.50 H new ATOM 0 HA VAL A 121 -6.826 -5.889 -5.079 1.00 20.96 H new ATOM 0 HB VAL A 121 -8.170 -3.963 -5.178 1.00 21.88 H new ATOM 0 HG11 VAL A 121 -7.685 -3.270 -7.373 1.00 23.93 H new ATOM 0 HG12 VAL A 121 -6.446 -4.032 -6.747 1.00 23.93 H new ATOM 0 HG13 VAL A 121 -7.394 -4.774 -7.776 1.00 23.93 H new ATOM 0 HG21 VAL A 121 -9.977 -3.806 -6.651 1.00 21.05 H new ATOM 0 HG22 VAL A 121 -9.797 -5.334 -7.027 1.00 21.05 H new ATOM 0 HG23 VAL A 121 -10.240 -4.926 -5.562 1.00 21.05 H new ATOM 1728 N ASP A 122 -9.315 -7.468 -4.215 1.00 20.45 N ANISOU 1728 N ASP A 122 2651 2678 2440 362 -596 -402 N ATOM 1729 CA ASP A 122 -10.243 -7.797 -3.133 1.00 20.32 C ANISOU 1729 CA ASP A 122 2695 2739 2288 424 -582 -386 C ATOM 1730 C ASP A 122 -9.958 -9.188 -2.622 1.00 21.53 C ANISOU 1730 C ASP A 122 2844 2930 2407 452 -568 -302 C ATOM 1731 O ASP A 122 -10.220 -10.164 -3.319 1.00 20.08 O ANISOU 1731 O ASP A 122 2636 2724 2270 425 -494 -232 O ATOM 1732 CB ASP A 122 -11.693 -7.672 -3.578 1.00 18.98 C ANISOU 1732 CB ASP A 122 2553 2575 2084 417 -490 -369 C ATOM 1733 CG ASP A 122 -12.633 -7.592 -2.420 1.00 19.38 C ANISOU 1733 CG ASP A 122 2662 2702 2001 486 -479 -372 C ATOM 1734 OD1 ASP A 122 -12.511 -8.447 -1.511 1.00 19.20 O ANISOU 1734 OD1 ASP A 122 2656 2739 1900 536 -484 -318 O ATOM 1735 OD2 ASP A 122 -13.465 -6.687 -2.411 1.00 20.29 O ANISOU 1735 OD2 ASP A 122 2802 2817 2089 493 -464 -422 O ATOM 0 H ASP A 122 -9.310 -8.029 -4.867 1.00 20.45 H new ATOM 0 HA ASP A 122 -10.109 -7.160 -2.414 1.00 20.32 H new ATOM 0 HB2 ASP A 122 -11.793 -6.880 -4.129 1.00 18.98 H new ATOM 0 HB3 ASP A 122 -11.927 -8.434 -4.131 1.00 18.98 H new ATOM 1740 N THR A 123 -9.439 -9.276 -1.391 1.00 25.71 N ANISOU 1740 N THR A 123 3395 3516 2856 511 -646 -310 N ATOM 1741 CA THR A 123 -9.002 -10.568 -0.875 1.00 32.49 C ANISOU 1741 CA THR A 123 4242 4406 3697 538 -647 -221 C ATOM 1742 C THR A 123 -10.160 -11.478 -0.505 1.00 25.09 C ANISOU 1742 C THR A 123 3333 3521 2678 573 -554 -127 C ATOM 1743 O THR A 123 -9.924 -12.632 -0.165 1.00 23.24 O ANISOU 1743 O THR A 123 3080 3304 2446 592 -541 -36 O ATOM 1744 CB THR A 123 -8.100 -10.371 0.350 1.00 47.92 C ANISOU 1744 CB THR A 123 6213 6413 5582 596 -767 -254 C ATOM 1745 OG1 THR A 123 -8.722 -9.466 1.269 1.00 48.61 O ANISOU 1745 OG1 THR A 123 6365 6570 5535 656 -801 -322 O ATOM 1746 CG2 THR A 123 -6.747 -9.817 -0.076 1.00 58.58 C ANISOU 1746 CG2 THR A 123 7508 7692 7057 555 -859 -320 C ATOM 0 H THR A 123 -9.335 -8.613 -0.853 1.00 25.71 H new ATOM 0 HA THR A 123 -8.509 -10.999 -1.590 1.00 32.49 H new ATOM 0 HB THR A 123 -7.967 -11.229 0.782 1.00 47.92 H new ATOM 0 HG1 THR A 123 -8.306 -8.736 1.269 1.00 48.61 H new ATOM 0 HG21 THR A 123 -6.186 -9.697 0.706 1.00 58.58 H new ATOM 0 HG22 THR A 123 -6.321 -10.438 -0.687 1.00 58.58 H new ATOM 0 HG23 THR A 123 -6.872 -8.963 -0.519 1.00 58.58 H new ATOM 1754 N ARG A 124 -11.400 -10.994 -0.577 1.00 21.74 N ANISOU 1754 N ARG A 124 2945 3115 2200 581 -490 -142 N ATOM 1755 CA ARG A 124 -12.551 -11.876 -0.402 1.00 21.99 C ANISOU 1755 CA ARG A 124 2987 3177 2192 605 -390 -45 C ATOM 1756 C ARG A 124 -12.832 -12.726 -1.620 1.00 21.11 C ANISOU 1756 C ARG A 124 2823 2990 2208 543 -316 8 C ATOM 1757 O ARG A 124 -13.674 -13.623 -1.546 1.00 23.56 O ANISOU 1757 O ARG A 124 3124 3306 2521 556 -240 96 O ATOM 1758 CB ARG A 124 -13.782 -11.049 -0.077 1.00 20.13 C ANISOU 1758 CB ARG A 124 2800 2981 1867 635 -347 -81 C ATOM 1759 CG ARG A 124 -13.692 -10.264 1.224 1.00 21.68 C ANISOU 1759 CG ARG A 124 3055 3266 1915 713 -411 -140 C ATOM 1760 CD ARG A 124 -14.848 -9.302 1.364 1.00 19.78 C ANISOU 1760 CD ARG A 124 2855 3048 1613 736 -368 -198 C ATOM 1761 NE ARG A 124 -14.831 -8.244 0.352 1.00 17.57 N ANISOU 1761 NE ARG A 124 2557 2687 1433 671 -389 -294 N ATOM 1762 CZ ARG A 124 -15.688 -7.244 0.311 1.00 17.48 C ANISOU 1762 CZ ARG A 124 2568 2672 1399 679 -368 -360 C ATOM 1763 NH1 ARG A 124 -16.681 -7.172 1.193 1.00 18.77 N ANISOU 1763 NH1 ARG A 124 2776 2911 1444 748 -317 -348 N ATOM 1764 NH2 ARG A 124 -15.593 -6.317 -0.651 1.00 17.88 N ANISOU 1764 NH2 ARG A 124 2596 2645 1555 618 -391 -431 N ATOM 0 H ARG A 124 -11.594 -10.169 -0.724 1.00 21.74 H new ATOM 0 HA ARG A 124 -12.337 -12.478 0.328 1.00 21.99 H new ATOM 0 HB2 ARG A 124 -13.942 -10.428 -0.805 1.00 20.13 H new ATOM 0 HB3 ARG A 124 -14.551 -11.639 -0.033 1.00 20.13 H new ATOM 0 HG2 ARG A 124 -13.686 -10.878 1.975 1.00 21.68 H new ATOM 0 HG3 ARG A 124 -12.855 -9.774 1.252 1.00 21.68 H new ATOM 0 HD2 ARG A 124 -15.682 -9.793 1.299 1.00 19.78 H new ATOM 0 HD3 ARG A 124 -14.824 -8.900 2.247 1.00 19.78 H new ATOM 0 HE ARG A 124 -14.222 -8.277 -0.255 1.00 17.57 H new ATOM 0 HH11 ARG A 124 -16.767 -7.780 1.795 1.00 18.77 H new ATOM 0 HH12 ARG A 124 -17.237 -6.517 1.162 1.00 18.77 H new ATOM 0 HH21 ARG A 124 -14.972 -6.374 -1.243 1.00 17.88 H new ATOM 0 HH22 ARG A 124 -16.153 -5.665 -0.677 1.00 17.88 H new ATOM 1778 N VAL A 125 -12.148 -12.481 -2.736 1.00 19.15 N ANISOU 1778 N VAL A 125 2538 2670 2070 479 -335 -42 N ATOM 1779 CA VAL A 125 -12.390 -13.266 -3.954 1.00 17.82 C ANISOU 1779 CA VAL A 125 2323 2436 2013 427 -270 -9 C ATOM 1780 C VAL A 125 -11.513 -14.503 -3.868 1.00 18.56 C ANISOU 1780 C VAL A 125 2369 2511 2171 428 -282 54 C ATOM 1781 O VAL A 125 -10.291 -14.425 -3.953 1.00 20.49 O ANISOU 1781 O VAL A 125 2588 2737 2461 415 -341 27 O ATOM 1782 CB VAL A 125 -12.106 -12.437 -5.210 1.00 17.43 C ANISOU 1782 CB VAL A 125 2257 2330 2035 368 -274 -85 C ATOM 1783 CG1 VAL A 125 -12.236 -13.268 -6.443 1.00 16.65 C ANISOU 1783 CG1 VAL A 125 2116 2177 2035 325 -217 -62 C ATOM 1784 CG2 VAL A 125 -13.088 -11.257 -5.285 1.00 17.59 C ANISOU 1784 CG2 VAL A 125 2318 2362 2003 367 -260 -136 C ATOM 0 H VAL A 125 -11.545 -11.872 -2.813 1.00 19.15 H new ATOM 0 HA VAL A 125 -13.322 -13.528 -4.020 1.00 17.82 H new ATOM 0 HB VAL A 125 -11.195 -12.107 -5.155 1.00 17.43 H new ATOM 0 HG11 VAL A 125 -12.052 -12.721 -7.223 1.00 16.65 H new ATOM 0 HG12 VAL A 125 -11.603 -14.002 -6.407 1.00 16.65 H new ATOM 0 HG13 VAL A 125 -13.138 -13.621 -6.502 1.00 16.65 H new ATOM 0 HG21 VAL A 125 -12.906 -10.734 -6.081 1.00 17.59 H new ATOM 0 HG22 VAL A 125 -13.997 -11.594 -5.321 1.00 17.59 H new ATOM 0 HG23 VAL A 125 -12.982 -10.697 -4.500 1.00 17.59 H new ATOM 1794 N ALA A 126 -12.155 -15.644 -3.638 1.00 17.68 N ANISOU 1794 N ALA A 126 2241 2402 2076 448 -226 144 N ATOM 1795 CA ALA A 126 -11.449 -16.927 -3.587 1.00 17.72 C ANISOU 1795 CA ALA A 126 2191 2379 2164 450 -230 214 C ATOM 1796 C ALA A 126 -11.252 -17.541 -4.973 1.00 18.47 C ANISOU 1796 C ALA A 126 2230 2390 2397 394 -196 191 C ATOM 1797 O ALA A 126 -10.280 -18.295 -5.173 1.00 19.30 O ANISOU 1797 O ALA A 126 2285 2460 2589 384 -217 208 O ATOM 1798 CB ALA A 126 -12.212 -17.881 -2.700 1.00 19.30 C ANISOU 1798 CB ALA A 126 2388 2611 2335 498 -186 330 C ATOM 0 H ALA A 126 -13.003 -15.700 -3.508 1.00 17.68 H new ATOM 0 HA ALA A 126 -10.565 -16.764 -3.222 1.00 17.72 H new ATOM 0 HB1 ALA A 126 -11.747 -18.732 -2.664 1.00 19.30 H new ATOM 0 HB2 ALA A 126 -12.277 -17.510 -1.806 1.00 19.30 H new ATOM 0 HB3 ALA A 126 -13.103 -18.015 -3.059 1.00 19.30 H new ATOM 1804 N ARG A 127 -12.136 -17.252 -5.902 1.00 18.96 N ANISOU 1804 N ARG A 127 2298 2425 2480 364 -146 152 N ATOM 1805 CA ARG A 127 -12.060 -17.771 -7.269 1.00 18.85 C ANISOU 1805 CA ARG A 127 2240 2345 2577 320 -114 116 C ATOM 1806 C ARG A 127 -12.560 -16.677 -8.213 1.00 17.73 C ANISOU 1806 C ARG A 127 2130 2200 2406 288 -100 38 C ATOM 1807 O ARG A 127 -13.512 -15.957 -7.879 1.00 17.06 O ANISOU 1807 O ARG A 127 2088 2145 2250 299 -87 34 O ATOM 1808 CB ARG A 127 -12.937 -19.002 -7.488 1.00 19.91 C ANISOU 1808 CB ARG A 127 2335 2439 2792 325 -62 172 C ATOM 1809 CG ARG A 127 -12.819 -20.108 -6.435 1.00 23.16 C ANISOU 1809 CG ARG A 127 2713 2853 3234 364 -62 279 C ATOM 1810 CD ARG A 127 -13.578 -21.338 -6.907 1.00 26.41 C ANISOU 1810 CD ARG A 127 3066 3197 3771 358 -14 322 C ATOM 1811 NE ARG A 127 -13.521 -22.434 -5.942 1.00 29.50 N ANISOU 1811 NE ARG A 127 3415 3583 4212 395 -7 442 N ATOM 1812 CZ ARG A 127 -14.357 -22.585 -4.930 1.00 30.20 C ANISOU 1812 CZ ARG A 127 3515 3710 4252 435 25 542 C ATOM 1813 NH1 ARG A 127 -15.341 -21.729 -4.723 1.00 30.25 N ANISOU 1813 NH1 ARG A 127 3574 3759 4160 445 54 530 N ATOM 1814 NH2 ARG A 127 -14.214 -23.617 -4.101 1.00 31.79 N ANISOU 1814 NH2 ARG A 127 3670 3904 4504 469 33 664 N ATOM 0 H ARG A 127 -12.813 -16.740 -5.764 1.00 18.96 H new ATOM 0 HA ARG A 127 -11.139 -18.026 -7.436 1.00 18.85 H new ATOM 0 HB2 ARG A 127 -13.863 -18.715 -7.527 1.00 19.91 H new ATOM 0 HB3 ARG A 127 -12.721 -19.381 -8.354 1.00 19.91 H new ATOM 0 HG2 ARG A 127 -11.886 -20.329 -6.286 1.00 23.16 H new ATOM 0 HG3 ARG A 127 -13.176 -19.801 -5.587 1.00 23.16 H new ATOM 0 HD2 ARG A 127 -14.505 -21.101 -7.068 1.00 26.41 H new ATOM 0 HD3 ARG A 127 -13.210 -21.637 -7.753 1.00 26.41 H new ATOM 0 HE ARG A 127 -12.900 -23.021 -6.040 1.00 29.50 H new ATOM 0 HH11 ARG A 127 -15.446 -21.059 -5.252 1.00 30.25 H new ATOM 0 HH12 ARG A 127 -15.877 -21.842 -4.060 1.00 30.25 H new ATOM 0 HH21 ARG A 127 -13.579 -24.183 -4.225 1.00 31.79 H new ATOM 0 HH22 ARG A 127 -14.757 -23.717 -3.442 1.00 31.79 H new ATOM 1828 N ALA A 128 -11.923 -16.582 -9.376 1.00 15.98 N ANISOU 1828 N ALA A 128 1884 1946 2244 252 -97 -18 N ATOM 1829 CA ALA A 128 -12.420 -15.718 -10.444 1.00 15.02 C ANISOU 1829 CA ALA A 128 1784 1819 2105 222 -76 -77 C ATOM 1830 C ALA A 128 -12.323 -16.455 -11.765 1.00 15.69 C ANISOU 1830 C ALA A 128 1831 1864 2267 200 -43 -108 C ATOM 1831 O ALA A 128 -11.271 -17.032 -12.066 1.00 16.82 O ANISOU 1831 O ALA A 128 1933 1987 2471 196 -48 -115 O ATOM 1832 CB ALA A 128 -11.646 -14.409 -10.516 1.00 16.21 C ANISOU 1832 CB ALA A 128 1952 1985 2220 207 -112 -120 C ATOM 0 H ALA A 128 -11.201 -17.009 -9.568 1.00 15.98 H new ATOM 0 HA ALA A 128 -13.345 -15.497 -10.254 1.00 15.02 H new ATOM 0 HB1 ALA A 128 -12.001 -13.862 -11.234 1.00 16.21 H new ATOM 0 HB2 ALA A 128 -11.733 -13.935 -9.674 1.00 16.21 H new ATOM 0 HB3 ALA A 128 -10.709 -14.596 -10.686 1.00 16.21 H new ATOM 1838 N PHE A 129 -13.431 -16.477 -12.508 1.00 15.01 N ANISOU 1838 N PHE A 129 1756 1766 2179 192 -14 -129 N ATOM 1839 CA PHE A 129 -13.555 -17.113 -13.810 1.00 15.13 C ANISOU 1839 CA PHE A 129 1745 1752 2250 179 11 -174 C ATOM 1840 C PHE A 129 -13.821 -16.037 -14.846 1.00 15.41 C ANISOU 1840 C PHE A 129 1813 1809 2232 159 19 -222 C ATOM 1841 O PHE A 129 -14.772 -15.228 -14.674 1.00 15.24 O ANISOU 1841 O PHE A 129 1829 1803 2159 155 17 -216 O ATOM 1842 CB PHE A 129 -14.724 -18.121 -13.853 1.00 14.13 C ANISOU 1842 CB PHE A 129 1598 1590 2181 191 27 -159 C ATOM 1843 CG PHE A 129 -14.674 -19.182 -12.816 1.00 14.32 C ANISOU 1843 CG PHE A 129 1585 1589 2267 213 26 -91 C ATOM 1844 CD1 PHE A 129 -14.209 -20.449 -13.137 1.00 15.18 C ANISOU 1844 CD1 PHE A 129 1634 1649 2484 218 29 -96 C ATOM 1845 CD2 PHE A 129 -15.197 -18.969 -11.549 1.00 15.77 C ANISOU 1845 CD2 PHE A 129 1789 1796 2406 234 26 -19 C ATOM 1846 CE1 PHE A 129 -14.177 -21.441 -12.175 1.00 16.79 C ANISOU 1846 CE1 PHE A 129 1796 1825 2757 240 28 -18 C ATOM 1847 CE2 PHE A 129 -15.205 -19.972 -10.599 1.00 18.39 C ANISOU 1847 CE2 PHE A 129 2085 2111 2791 260 31 62 C ATOM 1848 CZ PHE A 129 -14.686 -21.235 -10.931 1.00 19.83 C ANISOU 1848 CZ PHE A 129 2203 2239 3093 260 31 68 C ATOM 0 H PHE A 129 -14.161 -16.103 -12.250 1.00 15.01 H new ATOM 0 HA PHE A 129 -12.731 -17.593 -13.989 1.00 15.13 H new ATOM 0 HB2 PHE A 129 -15.557 -17.634 -13.758 1.00 14.13 H new ATOM 0 HB3 PHE A 129 -14.739 -18.542 -14.727 1.00 14.13 H new ATOM 0 HD1 PHE A 129 -13.918 -20.631 -14.001 1.00 15.18 H new ATOM 0 HD2 PHE A 129 -15.549 -18.135 -11.335 1.00 15.77 H new ATOM 0 HE1 PHE A 129 -13.800 -22.265 -12.383 1.00 16.79 H new ATOM 0 HE2 PHE A 129 -15.550 -19.813 -9.750 1.00 18.39 H new ATOM 0 HZ PHE A 129 -14.691 -21.923 -10.306 1.00 19.83 H new ATOM 1858 N SER A 130 -13.014 -15.995 -15.903 1.00 13.92 N ANISOU 1858 N SER A 130 1609 1626 2055 148 33 -263 N ATOM 1859 CA SER A 130 -13.170 -14.985 -16.974 1.00 13.66 C ANISOU 1859 CA SER A 130 1602 1619 1968 133 47 -294 C ATOM 1860 C SER A 130 -13.520 -15.743 -18.253 1.00 14.28 C ANISOU 1860 C SER A 130 1670 1695 2061 140 68 -346 C ATOM 1861 O SER A 130 -12.700 -16.487 -18.792 1.00 14.55 O ANISOU 1861 O SER A 130 1671 1723 2135 150 86 -376 O ATOM 1862 CB SER A 130 -11.930 -14.141 -17.170 1.00 14.40 C ANISOU 1862 CB SER A 130 1687 1730 2052 120 51 -289 C ATOM 1863 OG SER A 130 -12.102 -13.232 -18.242 1.00 14.52 O ANISOU 1863 OG SER A 130 1722 1772 2022 108 71 -302 O ATOM 0 H SER A 130 -12.363 -16.543 -16.028 1.00 13.92 H new ATOM 0 HA SER A 130 -13.870 -14.360 -16.729 1.00 13.66 H new ATOM 0 HB2 SER A 130 -11.734 -13.653 -16.355 1.00 14.40 H new ATOM 0 HB3 SER A 130 -11.168 -14.715 -17.347 1.00 14.40 H new ATOM 0 HG SER A 130 -11.565 -13.422 -18.860 1.00 14.52 H new ATOM 1869 N PHE A 131 -14.756 -15.578 -18.703 1.00 13.82 N ANISOU 1869 N PHE A 131 1638 1638 1976 141 62 -363 N ATOM 1870 CA PHE A 131 -15.252 -16.260 -19.882 1.00 14.17 C ANISOU 1870 CA PHE A 131 1676 1681 2028 153 66 -424 C ATOM 1871 C PHE A 131 -14.980 -15.419 -21.119 1.00 14.46 C ANISOU 1871 C PHE A 131 1738 1769 1986 152 84 -449 C ATOM 1872 O PHE A 131 -15.568 -14.348 -21.275 1.00 14.02 O ANISOU 1872 O PHE A 131 1717 1736 1875 140 76 -426 O ATOM 1873 CB PHE A 131 -16.743 -16.552 -19.712 1.00 14.39 C ANISOU 1873 CB PHE A 131 1710 1677 2080 156 41 -426 C ATOM 1874 CG PHE A 131 -17.361 -17.279 -20.873 1.00 16.93 C ANISOU 1874 CG PHE A 131 2022 1989 2421 172 26 -500 C ATOM 1875 CD1 PHE A 131 -17.227 -18.643 -21.007 1.00 18.60 C ANISOU 1875 CD1 PHE A 131 2186 2156 2724 190 19 -544 C ATOM 1876 CD2 PHE A 131 -18.108 -16.574 -21.817 1.00 18.84 C ANISOU 1876 CD2 PHE A 131 2300 2263 2595 172 12 -528 C ATOM 1877 CE1 PHE A 131 -17.804 -19.304 -22.086 1.00 20.86 C ANISOU 1877 CE1 PHE A 131 2462 2430 3032 210 -6 -629 C ATOM 1878 CE2 PHE A 131 -18.665 -17.222 -22.893 1.00 22.48 C ANISOU 1878 CE2 PHE A 131 2755 2721 3065 193 -14 -606 C ATOM 1879 CZ PHE A 131 -18.521 -18.606 -23.029 1.00 21.99 C ANISOU 1879 CZ PHE A 131 2647 2614 3096 213 -26 -664 C ATOM 0 H PHE A 131 -15.333 -15.062 -18.328 1.00 13.82 H new ATOM 0 HA PHE A 131 -14.791 -17.106 -19.995 1.00 14.17 H new ATOM 0 HB2 PHE A 131 -16.870 -17.079 -18.908 1.00 14.39 H new ATOM 0 HB3 PHE A 131 -17.214 -15.714 -19.579 1.00 14.39 H new ATOM 0 HD1 PHE A 131 -16.748 -19.125 -20.372 1.00 18.60 H new ATOM 0 HD2 PHE A 131 -18.230 -15.657 -21.717 1.00 18.84 H new ATOM 0 HE1 PHE A 131 -17.704 -20.225 -22.170 1.00 20.86 H new ATOM 0 HE2 PHE A 131 -19.138 -16.739 -23.532 1.00 22.48 H new ATOM 0 HZ PHE A 131 -18.906 -19.050 -23.750 1.00 21.99 H new ATOM 1889 N CYS A 132 -14.094 -15.888 -21.965 1.00 16.09 N ANISOU 1889 N CYS A 132 1926 1997 2191 168 111 -489 N ATOM 1890 CA CYS A 132 -13.759 -15.283 -23.251 1.00 16.78 C ANISOU 1890 CA CYS A 132 2033 2146 2199 178 140 -509 C ATOM 1891 C CYS A 132 -13.108 -13.921 -23.096 1.00 17.75 C ANISOU 1891 C CYS A 132 2166 2295 2284 156 162 -441 C ATOM 1892 O CYS A 132 -13.251 -13.066 -23.960 1.00 19.59 O ANISOU 1892 O CYS A 132 2422 2573 2446 158 179 -425 O ATOM 1893 CB CYS A 132 -14.994 -15.180 -24.148 1.00 17.98 C ANISOU 1893 CB CYS A 132 2219 2319 2292 191 115 -548 C ATOM 1894 SG CYS A 132 -15.533 -16.856 -24.695 1.00 21.42 S ANISOU 1894 SG CYS A 132 2630 2723 2786 225 86 -654 S ATOM 0 H CYS A 132 -13.644 -16.603 -21.806 1.00 16.09 H new ATOM 0 HA CYS A 132 -13.112 -15.869 -23.673 1.00 16.78 H new ATOM 0 HB2 CYS A 132 -15.714 -14.743 -23.667 1.00 17.98 H new ATOM 0 HB3 CYS A 132 -14.794 -14.630 -24.921 1.00 17.98 H new ATOM 0 HG CYS A 132 -16.578 -17.131 -24.173 1.00 21.42 H new ATOM 1900 N ALA A 133 -12.360 -13.742 -22.026 1.00 16.41 N ANISOU 1900 N ALA A 133 1972 2094 2168 139 159 -399 N ATOM 1901 CA ALA A 133 -11.468 -12.594 -21.895 1.00 15.68 C ANISOU 1901 CA ALA A 133 1870 2014 2072 121 176 -346 C ATOM 1902 C ALA A 133 -10.244 -13.050 -21.124 1.00 15.36 C ANISOU 1902 C ALA A 133 1784 1944 2108 118 178 -334 C ATOM 1903 O ALA A 133 -10.352 -13.883 -20.215 1.00 15.90 O ANISOU 1903 O ALA A 133 1842 1978 2222 122 149 -343 O ATOM 1904 CB ALA A 133 -12.127 -11.419 -21.179 1.00 15.52 C ANISOU 1904 CB ALA A 133 1877 1981 2039 97 141 -305 C ATOM 0 H ALA A 133 -12.350 -14.277 -21.353 1.00 16.41 H new ATOM 0 HA ALA A 133 -11.232 -12.278 -22.781 1.00 15.68 H new ATOM 0 HB1 ALA A 133 -11.498 -10.684 -21.117 1.00 15.52 H new ATOM 0 HB2 ALA A 133 -12.909 -11.133 -21.677 1.00 15.52 H new ATOM 0 HB3 ALA A 133 -12.394 -11.692 -20.287 1.00 15.52 H new ATOM 1910 N HIS A 134 -9.101 -12.558 -21.520 1.00 16.46 N ANISOU 1910 N HIS A 134 1892 2095 2266 114 213 -309 N ATOM 1911 CA HIS A 134 -7.848 -12.861 -20.853 1.00 15.93 C ANISOU 1911 CA HIS A 134 1775 1997 2283 111 211 -294 C ATOM 1912 C HIS A 134 -7.451 -11.705 -19.940 1.00 16.34 C ANISOU 1912 C HIS A 134 1817 2023 2368 85 172 -248 C ATOM 1913 O HIS A 134 -8.170 -10.705 -19.810 1.00 17.05 O ANISOU 1913 O HIS A 134 1940 2118 2420 71 149 -230 O ATOM 1914 CB HIS A 134 -6.777 -13.198 -21.889 1.00 15.33 C ANISOU 1914 CB HIS A 134 1657 1944 2226 128 280 -302 C ATOM 1915 CG HIS A 134 -6.499 -12.051 -22.811 1.00 19.68 C ANISOU 1915 CG HIS A 134 2206 2533 2739 123 328 -258 C ATOM 1916 ND1 HIS A 134 -5.775 -10.951 -22.404 1.00 19.06 N ANISOU 1916 ND1 HIS A 134 2095 2430 2717 98 321 -198 N ATOM 1917 CD2 HIS A 134 -6.839 -11.830 -24.104 1.00 20.19 C ANISOU 1917 CD2 HIS A 134 2294 2658 2719 143 381 -261 C ATOM 1918 CE1 HIS A 134 -5.671 -10.110 -23.414 1.00 19.53 C ANISOU 1918 CE1 HIS A 134 2151 2528 2741 100 376 -154 C ATOM 1919 NE2 HIS A 134 -6.327 -10.610 -24.451 1.00 20.09 N ANISOU 1919 NE2 HIS A 134 2261 2658 2716 129 414 -188 N ATOM 0 H HIS A 134 -9.020 -12.029 -22.193 1.00 16.46 H new ATOM 0 HA HIS A 134 -7.951 -13.643 -20.288 1.00 15.93 H new ATOM 0 HB2 HIS A 134 -5.958 -13.451 -21.434 1.00 15.33 H new ATOM 0 HB3 HIS A 134 -7.062 -13.966 -22.408 1.00 15.33 H new ATOM 0 HD2 HIS A 134 -7.328 -12.400 -24.652 1.00 20.19 H new ATOM 0 HE1 HIS A 134 -5.213 -9.301 -23.401 1.00 19.53 H new ATOM 0 HE2 HIS A 134 -6.416 -10.230 -25.217 1.00 20.09 H new ATOM 1927 N ALA A 135 -6.276 -11.839 -19.323 1.00 16.90 N ANISOU 1927 N ALA A 135 1840 2064 2520 81 158 -233 N ATOM 1928 CA ALA A 135 -5.843 -10.943 -18.266 1.00 17.09 C ANISOU 1928 CA ALA A 135 1849 2055 2588 64 98 -207 C ATOM 1929 C ALA A 135 -4.685 -10.046 -18.667 1.00 17.19 C ANISOU 1929 C ALA A 135 1805 2050 2674 48 119 -171 C ATOM 1930 O ALA A 135 -4.150 -9.376 -17.816 1.00 19.28 O ANISOU 1930 O ALA A 135 2046 2279 3001 36 62 -160 O ATOM 1931 CB ALA A 135 -5.450 -11.759 -17.039 1.00 18.71 C ANISOU 1931 CB ALA A 135 2041 2233 2836 74 43 -216 C ATOM 0 H ALA A 135 -5.709 -12.458 -19.511 1.00 16.90 H new ATOM 0 HA ALA A 135 -6.593 -10.360 -18.071 1.00 17.09 H new ATOM 0 HB1 ALA A 135 -5.160 -11.161 -16.332 1.00 18.71 H new ATOM 0 HB2 ALA A 135 -6.214 -12.274 -16.734 1.00 18.71 H new ATOM 0 HB3 ALA A 135 -4.726 -12.362 -17.269 1.00 18.71 H new ATOM 1937 N GLU A 136 -4.299 -10.040 -19.938 1.00 16.71 N ANISOU 1937 N GLU A 136 1722 2017 2611 54 200 -153 N ATOM 1938 CA GLU A 136 -3.078 -9.377 -20.330 1.00 16.34 C ANISOU 1938 CA GLU A 136 1606 1950 2653 44 235 -106 C ATOM 1939 C GLU A 136 -3.342 -7.951 -20.769 1.00 16.45 C ANISOU 1939 C GLU A 136 1620 1965 2665 25 245 -56 C ATOM 1940 O GLU A 136 -4.452 -7.527 -21.024 1.00 17.85 O ANISOU 1940 O GLU A 136 1853 2169 2759 23 240 -58 O ATOM 1941 CB GLU A 136 -2.354 -10.136 -21.458 1.00 17.97 C ANISOU 1941 CB GLU A 136 1775 2188 2866 67 330 -104 C ATOM 1942 CG GLU A 136 -2.069 -11.588 -21.108 1.00 17.62 C ANISOU 1942 CG GLU A 136 1719 2133 2842 87 323 -155 C ATOM 1943 CD GLU A 136 -1.381 -11.749 -19.763 1.00 18.81 C ANISOU 1943 CD GLU A 136 1832 2222 3091 74 243 -154 C ATOM 1944 OE1 GLU A 136 -0.212 -11.303 -19.629 1.00 22.70 O ANISOU 1944 OE1 GLU A 136 2255 2677 3691 64 243 -119 O ATOM 1945 OE2 GLU A 136 -2.052 -12.252 -18.830 1.00 18.69 O ANISOU 1945 OE2 GLU A 136 1858 2198 3044 77 176 -181 O ATOM 0 H GLU A 136 -4.731 -10.414 -20.581 1.00 16.71 H new ATOM 0 HA GLU A 136 -2.505 -9.366 -19.548 1.00 16.34 H new ATOM 0 HB2 GLU A 136 -2.895 -10.102 -22.263 1.00 17.97 H new ATOM 0 HB3 GLU A 136 -1.518 -9.687 -21.659 1.00 17.97 H new ATOM 0 HG2 GLU A 136 -2.903 -12.084 -21.101 1.00 17.62 H new ATOM 0 HG3 GLU A 136 -1.512 -11.979 -21.799 1.00 17.62 H new ATOM 1952 N GLN A 137 -2.239 -7.172 -20.782 1.00 17.39 N ANISOU 1952 N GLN A 137 1664 2042 2901 9 253 -6 N ATOM 1953 CA GLN A 137 -2.243 -5.848 -21.344 1.00 19.53 C ANISOU 1953 CA GLN A 137 1910 2304 3205 -8 278 60 C ATOM 1954 C GLN A 137 -2.612 -5.912 -22.818 1.00 22.05 C ANISOU 1954 C GLN A 137 2252 2698 3429 12 382 100 C ATOM 1955 O GLN A 137 -2.151 -6.803 -23.549 1.00 24.30 O ANISOU 1955 O GLN A 137 2525 3026 3681 39 457 92 O ATOM 1956 CB GLN A 137 -0.844 -5.238 -21.153 1.00 20.42 C ANISOU 1956 CB GLN A 137 1921 2351 3485 -25 277 109 C ATOM 1957 CG GLN A 137 -0.726 -3.762 -21.563 1.00 22.68 C ANISOU 1957 CG GLN A 137 2160 2603 3853 -47 290 188 C ATOM 1958 CD GLN A 137 0.698 -3.244 -21.382 1.00 27.65 C ANISOU 1958 CD GLN A 137 2675 3156 4675 -63 288 238 C ATOM 1959 OE1 GLN A 137 1.276 -2.618 -22.282 1.00 34.28 O ANISOU 1959 OE1 GLN A 137 3447 3990 5589 -67 371 332 O ATOM 1960 NE2 GLN A 137 1.273 -3.525 -20.235 1.00 25.66 N ANISOU 1960 NE2 GLN A 137 2396 2846 4506 -70 195 182 N ATOM 0 H GLN A 137 -1.479 -7.416 -20.461 1.00 17.39 H new ATOM 0 HA GLN A 137 -2.901 -5.292 -20.898 1.00 19.53 H new ATOM 0 HB2 GLN A 137 -0.592 -5.323 -20.220 1.00 20.42 H new ATOM 0 HB3 GLN A 137 -0.206 -5.756 -21.668 1.00 20.42 H new ATOM 0 HG2 GLN A 137 -0.993 -3.660 -22.490 1.00 22.68 H new ATOM 0 HG3 GLN A 137 -1.336 -3.227 -21.031 1.00 22.68 H new ATOM 0 HE21 GLN A 137 0.841 -3.962 -19.633 1.00 25.66 H new ATOM 0 HE22 GLN A 137 2.081 -3.272 -20.086 1.00 25.66 H new ATOM 1969 N VAL A 138 -3.417 -4.951 -23.256 1.00 21.83 N ANISOU 1969 N VAL A 138 2253 2686 3356 3 385 140 N ATOM 1970 CA VAL A 138 -3.806 -4.846 -24.658 1.00 22.87 C ANISOU 1970 CA VAL A 138 2407 2895 3388 26 474 188 C ATOM 1971 C VAL A 138 -3.520 -3.441 -25.144 1.00 24.39 C ANISOU 1971 C VAL A 138 2548 3066 3654 9 506 296 C ATOM 1972 O VAL A 138 -3.450 -2.506 -24.352 1.00 25.34 O ANISOU 1972 O VAL A 138 2634 3109 3884 -23 438 311 O ATOM 1973 CB VAL A 138 -5.275 -5.177 -24.867 1.00 24.20 C ANISOU 1973 CB VAL A 138 2668 3113 3414 39 447 137 C ATOM 1974 CG1 VAL A 138 -5.555 -6.617 -24.533 1.00 27.22 C ANISOU 1974 CG1 VAL A 138 3091 3514 3739 59 428 42 C ATOM 1975 CG2 VAL A 138 -6.157 -4.283 -24.010 1.00 23.58 C ANISOU 1975 CG2 VAL A 138 2616 2985 3359 10 360 131 C ATOM 0 H VAL A 138 -3.753 -4.342 -22.750 1.00 21.83 H new ATOM 0 HA VAL A 138 -3.290 -5.491 -25.166 1.00 22.87 H new ATOM 0 HB VAL A 138 -5.478 -5.023 -25.803 1.00 24.20 H new ATOM 0 HG11 VAL A 138 -6.496 -6.805 -24.673 1.00 27.22 H new ATOM 0 HG12 VAL A 138 -5.022 -7.192 -25.105 1.00 27.22 H new ATOM 0 HG13 VAL A 138 -5.327 -6.784 -23.605 1.00 27.22 H new ATOM 0 HG21 VAL A 138 -7.088 -4.510 -24.158 1.00 23.58 H new ATOM 0 HG22 VAL A 138 -5.937 -4.413 -23.074 1.00 23.58 H new ATOM 0 HG23 VAL A 138 -6.008 -3.355 -24.251 1.00 23.58 H new ATOM 1985 N GLU A 139 -3.309 -3.311 -26.445 1.00 28.19 N ANISOU 1985 N GLU A 139 3017 3616 4080 35 609 371 N ATOM 1986 CA GLU A 139 -3.220 -2.015 -27.114 1.00 36.59 C ANISOU 1986 CA GLU A 139 4036 4674 5192 25 653 494 C ATOM 1987 C GLU A 139 -4.601 -1.705 -27.671 1.00 31.84 C ANISOU 1987 C GLU A 139 3514 4130 4451 35 639 500 C ATOM 1988 O GLU A 139 -5.117 -2.442 -28.513 1.00 35.07 O ANISOU 1988 O GLU A 139 3986 4634 4704 74 682 472 O ATOM 1989 CB GLU A 139 -2.191 -2.034 -28.237 1.00 53.90 C ANISOU 1989 CB GLU A 139 6167 6919 7395 55 785 591 C ATOM 1990 CG GLU A 139 -2.026 -0.702 -28.949 1.00 75.10 C ANISOU 1990 CG GLU A 139 8794 9598 10144 48 841 742 C ATOM 1991 CD GLU A 139 -1.564 -0.859 -30.390 1.00 90.00 C ANISOU 1991 CD GLU A 139 10666 11593 11938 99 988 839 C ATOM 1992 OE1 GLU A 139 -2.215 -0.279 -31.287 1.00 94.61 O ANISOU 1992 OE1 GLU A 139 11281 12245 12422 119 1027 922 O ATOM 1993 OE2 GLU A 139 -0.560 -1.566 -30.626 1.00 93.78 O ANISOU 1993 OE2 GLU A 139 11102 12093 12438 124 1063 833 O ATOM 0 H GLU A 139 -3.212 -3.981 -26.975 1.00 28.19 H new ATOM 0 HA GLU A 139 -2.934 -1.336 -26.484 1.00 36.59 H new ATOM 0 HB2 GLU A 139 -1.333 -2.303 -27.872 1.00 53.90 H new ATOM 0 HB3 GLU A 139 -2.447 -2.707 -28.886 1.00 53.90 H new ATOM 0 HG2 GLU A 139 -2.871 -0.225 -28.934 1.00 75.10 H new ATOM 0 HG3 GLU A 139 -1.385 -0.158 -28.465 1.00 75.10 H new ATOM 2000 N ILE A 140 -5.217 -0.638 -27.183 1.00 26.19 N ANISOU 2000 N ILE A 140 2797 3355 3799 3 571 525 N ATOM 2001 CA ILE A 140 -6.557 -0.260 -27.602 1.00 27.87 C ANISOU 2001 CA ILE A 140 3078 3607 3903 8 546 532 C ATOM 2002 C ILE A 140 -6.437 0.883 -28.605 1.00 30.63 C ANISOU 2002 C ILE A 140 3382 3975 4279 11 610 680 C ATOM 2003 O ILE A 140 -5.886 1.931 -28.258 1.00 35.68 O ANISOU 2003 O ILE A 140 3942 4530 5086 -20 599 753 O ATOM 2004 CB ILE A 140 -7.423 0.144 -26.399 1.00 30.64 C ANISOU 2004 CB ILE A 140 3457 3882 4302 -24 431 460 C ATOM 2005 CG1 ILE A 140 -7.485 -1.033 -25.422 1.00 30.85 C ANISOU 2005 CG1 ILE A 140 3523 3899 4298 -21 379 333 C ATOM 2006 CG2 ILE A 140 -8.811 0.553 -26.864 1.00 33.24 C ANISOU 2006 CG2 ILE A 140 3848 4246 4535 -19 407 472 C ATOM 2007 CD1 ILE A 140 -8.470 -0.871 -24.276 1.00 28.71 C ANISOU 2007 CD1 ILE A 140 3296 3580 4033 -39 280 256 C ATOM 0 H ILE A 140 -4.869 -0.112 -26.598 1.00 26.19 H new ATOM 0 HA ILE A 140 -6.997 -1.018 -28.019 1.00 27.87 H new ATOM 0 HB ILE A 140 -7.032 0.908 -25.947 1.00 30.64 H new ATOM 0 HG12 ILE A 140 -7.716 -1.834 -25.917 1.00 30.85 H new ATOM 0 HG13 ILE A 140 -6.600 -1.174 -25.051 1.00 30.85 H new ATOM 0 HG21 ILE A 140 -9.348 0.806 -26.097 1.00 33.24 H new ATOM 0 HG22 ILE A 140 -8.740 1.306 -27.471 1.00 33.24 H new ATOM 0 HG23 ILE A 140 -9.232 -0.192 -27.322 1.00 33.24 H new ATOM 0 HD11 ILE A 140 -8.442 -1.659 -23.711 1.00 28.71 H new ATOM 0 HD12 ILE A 140 -8.232 -0.090 -23.752 1.00 28.71 H new ATOM 0 HD13 ILE A 140 -9.366 -0.760 -24.632 1.00 28.71 H new ATOM 2019 N PRO A 141 -6.900 0.719 -29.847 1.00 31.79 N ANISOU 2019 N PRO A 141 3574 4230 4276 51 675 731 N ATOM 2020 CA PRO A 141 -6.825 1.826 -30.810 1.00 29.94 C ANISOU 2020 CA PRO A 141 3297 4019 4058 59 739 890 C ATOM 2021 C PRO A 141 -7.891 2.866 -30.486 1.00 26.54 C ANISOU 2021 C PRO A 141 2879 3531 3673 28 657 915 C ATOM 2022 O PRO A 141 -9.076 2.574 -30.537 1.00 25.00 O ANISOU 2022 O PRO A 141 2766 3374 3361 38 604 850 O ATOM 2023 CB PRO A 141 -7.075 1.151 -32.164 1.00 37.00 C ANISOU 2023 CB PRO A 141 4252 5062 4743 122 821 911 C ATOM 2024 CG PRO A 141 -7.191 -0.312 -31.906 1.00 41.72 C ANISOU 2024 CG PRO A 141 4914 5700 5239 144 800 755 C ATOM 2025 CD PRO A 141 -7.499 -0.497 -30.449 1.00 37.08 C ANISOU 2025 CD PRO A 141 4332 5005 4752 96 690 645 C ATOM 0 HA PRO A 141 -5.979 2.300 -30.796 1.00 29.94 H new ATOM 0 HB2 PRO A 141 -7.885 1.493 -32.573 1.00 37.00 H new ATOM 0 HB3 PRO A 141 -6.347 1.335 -32.779 1.00 37.00 H new ATOM 0 HG2 PRO A 141 -7.892 -0.699 -32.454 1.00 41.72 H new ATOM 0 HG3 PRO A 141 -6.366 -0.765 -32.139 1.00 41.72 H new ATOM 0 HD2 PRO A 141 -8.453 -0.551 -30.284 1.00 37.08 H new ATOM 0 HD3 PRO A 141 -7.104 -1.309 -30.095 1.00 37.08 H new ATOM 2033 N GLU A 142 -7.448 4.079 -30.143 1.00 30.24 N ANISOU 2033 N GLU A 142 3259 3901 4329 -8 646 1006 N ATOM 2034 CA GLU A 142 -8.382 5.143 -29.778 1.00 38.35 C ANISOU 2034 CA GLU A 142 4284 4858 5430 -38 567 1027 C ATOM 2035 C GLU A 142 -9.333 5.467 -30.920 1.00 32.09 C ANISOU 2035 C GLU A 142 3538 4152 4502 -9 595 1115 C ATOM 2036 O GLU A 142 -10.535 5.684 -30.696 1.00 26.83 O ANISOU 2036 O GLU A 142 2925 3473 3795 -17 520 1068 O ATOM 2037 CB GLU A 142 -7.611 6.398 -29.368 1.00 57.98 C ANISOU 2037 CB GLU A 142 6652 7220 8159 -76 557 1119 C ATOM 2038 CG GLU A 142 -7.217 6.445 -27.907 1.00 73.51 C ANISOU 2038 CG GLU A 142 8585 9069 10276 -113 464 1000 C ATOM 2039 CD GLU A 142 -6.218 7.544 -27.609 1.00 85.32 C ANISOU 2039 CD GLU A 142 9950 10444 12024 -144 459 1085 C ATOM 2040 OE1 GLU A 142 -6.210 8.557 -28.335 1.00 89.30 O ANISOU 2040 OE1 GLU A 142 10390 10926 12615 -149 501 1233 O ATOM 2041 OE2 GLU A 142 -5.430 7.385 -26.655 1.00 88.94 O ANISOU 2041 OE2 GLU A 142 10365 10827 12603 -163 410 1007 O ATOM 0 H GLU A 142 -6.618 4.303 -30.116 1.00 30.24 H new ATOM 0 HA GLU A 142 -8.912 4.830 -29.028 1.00 38.35 H new ATOM 0 HB2 GLU A 142 -6.809 6.462 -29.910 1.00 57.98 H new ATOM 0 HB3 GLU A 142 -8.153 7.177 -29.570 1.00 57.98 H new ATOM 0 HG2 GLU A 142 -8.011 6.578 -27.365 1.00 73.51 H new ATOM 0 HG3 GLU A 142 -6.838 5.590 -27.650 1.00 73.51 H new ATOM 2048 N ASP A 143 -8.824 5.502 -32.146 1.00 36.52 N ANISOU 2048 N ASP A 143 4081 4806 4990 29 702 1243 N ATOM 2049 CA ASP A 143 -9.642 5.840 -33.302 1.00 50.33 C ANISOU 2049 CA ASP A 143 5873 6650 6600 64 730 1341 C ATOM 2050 C ASP A 143 -10.762 4.828 -33.494 1.00 36.75 C ANISOU 2050 C ASP A 143 4272 5018 4672 94 679 1211 C ATOM 2051 O ASP A 143 -11.940 5.201 -33.640 1.00 30.70 O ANISOU 2051 O ASP A 143 3550 4256 3858 93 615 1212 O ATOM 2052 CB ASP A 143 -8.764 5.915 -34.559 1.00 79.51 C ANISOU 2052 CB ASP A 143 9530 10447 10232 111 867 1498 C ATOM 2053 CG ASP A 143 -8.071 4.594 -34.873 1.00103.49 C ANISOU 2053 CG ASP A 143 12605 13581 13136 154 937 1415 C ATOM 2054 OD1 ASP A 143 -7.734 3.851 -33.928 1.00110.54 O ANISOU 2054 OD1 ASP A 143 13502 14417 14081 131 895 1276 O ATOM 2055 OD2 ASP A 143 -7.869 4.298 -36.068 1.00113.02 O ANISOU 2055 OD2 ASP A 143 13836 14923 14183 216 1034 1489 O ATOM 0 H ASP A 143 -8.001 5.332 -32.330 1.00 36.52 H new ATOM 0 HA ASP A 143 -10.049 6.707 -33.148 1.00 50.33 H new ATOM 0 HB2 ASP A 143 -9.311 6.177 -35.316 1.00 79.51 H new ATOM 0 HB3 ASP A 143 -8.095 6.607 -34.440 1.00 79.51 H new ATOM 2060 N ALA A 144 -10.425 3.544 -33.491 1.00 32.42 N ANISOU 2060 N ALA A 144 3771 4533 4016 122 702 1098 N ATOM 2061 CA ALA A 144 -11.420 2.506 -33.750 1.00 31.44 C ANISOU 2061 CA ALA A 144 3749 4488 3709 154 656 973 C ATOM 2062 C ALA A 144 -12.462 2.456 -32.646 1.00 27.25 C ANISOU 2062 C ALA A 144 3252 3868 3234 114 538 857 C ATOM 2063 O ALA A 144 -13.658 2.304 -32.920 1.00 28.24 O ANISOU 2063 O ALA A 144 3440 4026 3262 127 480 817 O ATOM 2064 CB ALA A 144 -10.735 1.152 -33.904 1.00 33.97 C ANISOU 2064 CB ALA A 144 4096 4875 3938 190 705 874 C ATOM 0 H ALA A 144 -9.630 3.252 -33.342 1.00 32.42 H new ATOM 0 HA ALA A 144 -11.878 2.723 -34.577 1.00 31.44 H new ATOM 0 HB1 ALA A 144 -11.402 0.469 -34.076 1.00 33.97 H new ATOM 0 HB2 ALA A 144 -10.111 1.187 -34.646 1.00 33.97 H new ATOM 0 HB3 ALA A 144 -10.255 0.937 -33.089 1.00 33.97 H new ATOM 2070 N VAL A 145 -12.034 2.583 -31.392 1.00 23.12 N ANISOU 2070 N VAL A 145 2686 3233 2865 68 500 803 N ATOM 2071 CA VAL A 145 -12.996 2.556 -30.296 1.00 20.99 C ANISOU 2071 CA VAL A 145 2448 2887 2642 37 398 697 C ATOM 2072 C VAL A 145 -13.937 3.736 -30.370 1.00 21.32 C ANISOU 2072 C VAL A 145 2481 2885 2735 18 351 765 C ATOM 2073 O VAL A 145 -15.145 3.602 -30.122 1.00 21.43 O ANISOU 2073 O VAL A 145 2545 2890 2706 17 283 700 O ATOM 2074 CB VAL A 145 -12.268 2.481 -28.945 1.00 23.19 C ANISOU 2074 CB VAL A 145 2683 3067 3062 1 368 628 C ATOM 2075 CG1 VAL A 145 -13.251 2.709 -27.801 1.00 26.42 C ANISOU 2075 CG1 VAL A 145 3116 3398 3524 -26 272 541 C ATOM 2076 CG2 VAL A 145 -11.558 1.137 -28.790 1.00 23.27 C ANISOU 2076 CG2 VAL A 145 2712 3118 3013 21 400 542 C ATOM 0 H VAL A 145 -11.212 2.683 -31.159 1.00 23.12 H new ATOM 0 HA VAL A 145 -13.540 1.757 -30.380 1.00 20.99 H new ATOM 0 HB VAL A 145 -11.597 3.181 -28.916 1.00 23.19 H new ATOM 0 HG11 VAL A 145 -12.780 2.659 -26.955 1.00 26.42 H new ATOM 0 HG12 VAL A 145 -13.658 3.585 -27.893 1.00 26.42 H new ATOM 0 HG13 VAL A 145 -13.941 2.028 -27.827 1.00 26.42 H new ATOM 0 HG21 VAL A 145 -11.105 1.107 -27.933 1.00 23.27 H new ATOM 0 HG22 VAL A 145 -12.209 0.420 -28.836 1.00 23.27 H new ATOM 0 HG23 VAL A 145 -10.909 1.030 -29.503 1.00 23.27 H new ATOM 2086 N GLU A 146 -13.416 4.926 -30.682 1.00 24.10 N ANISOU 2086 N GLU A 146 2760 3198 3199 4 384 901 N ATOM 2087 CA GLU A 146 -14.316 6.067 -30.814 1.00 27.56 C ANISOU 2087 CA GLU A 146 3183 3591 3698 -12 338 974 C ATOM 2088 C GLU A 146 -15.310 5.847 -31.950 1.00 27.83 C ANISOU 2088 C GLU A 146 3284 3731 3561 27 338 1011 C ATOM 2089 O GLU A 146 -16.499 6.160 -31.812 1.00 27.28 O ANISOU 2089 O GLU A 146 3244 3635 3488 20 268 987 O ATOM 2090 CB GLU A 146 -13.501 7.344 -31.026 1.00 34.74 C ANISOU 2090 CB GLU A 146 3989 4436 4773 -33 379 1127 C ATOM 2091 CG GLU A 146 -14.367 8.543 -31.357 1.00 40.88 C ANISOU 2091 CG GLU A 146 4743 5172 5618 -44 342 1227 C ATOM 2092 CD GLU A 146 -15.380 8.891 -30.266 1.00 36.33 C ANISOU 2092 CD GLU A 146 4182 4497 5127 -75 237 1117 C ATOM 2093 OE1 GLU A 146 -15.097 8.600 -29.077 1.00 38.57 O ANISOU 2093 OE1 GLU A 146 4460 4712 5483 -97 197 993 O ATOM 2094 OE2 GLU A 146 -16.453 9.482 -30.607 1.00 30.95 O ANISOU 2094 OE2 GLU A 146 3513 3808 4439 -74 197 1159 O ATOM 0 H GLU A 146 -12.582 5.088 -30.816 1.00 24.10 H new ATOM 0 HA GLU A 146 -14.829 6.161 -29.996 1.00 27.56 H new ATOM 0 HB2 GLU A 146 -12.987 7.532 -30.225 1.00 34.74 H new ATOM 0 HB3 GLU A 146 -12.865 7.201 -31.744 1.00 34.74 H new ATOM 0 HG2 GLU A 146 -13.796 9.311 -31.513 1.00 40.88 H new ATOM 0 HG3 GLU A 146 -14.842 8.370 -32.185 1.00 40.88 H new ATOM 2101 N GLU A 147 -14.850 5.271 -33.066 1.00 31.67 N ANISOU 2101 N GLU A 147 3796 4340 3900 74 413 1061 N ATOM 2102 CA GLU A 147 -15.752 4.977 -34.173 1.00 40.48 C ANISOU 2102 CA GLU A 147 4980 5568 4833 121 404 1082 C ATOM 2103 C GLU A 147 -16.832 3.995 -33.746 1.00 30.09 C ANISOU 2103 C GLU A 147 3741 4256 3435 125 321 916 C ATOM 2104 O GLU A 147 -17.997 4.131 -34.135 1.00 31.26 O ANISOU 2104 O GLU A 147 3929 4426 3521 137 260 914 O ATOM 2105 CB GLU A 147 -14.969 4.418 -35.362 1.00 65.73 C ANISOU 2105 CB GLU A 147 8195 8905 7876 180 502 1140 C ATOM 2106 CG GLU A 147 -15.830 4.126 -36.586 1.00 91.02 C ANISOU 2106 CG GLU A 147 11472 12239 10872 240 488 1158 C ATOM 2107 CD GLU A 147 -15.016 3.653 -37.775 1.00110.99 C ANISOU 2107 CD GLU A 147 14018 14916 13236 308 593 1217 C ATOM 2108 OE1 GLU A 147 -14.035 2.906 -37.569 1.00117.22 O ANISOU 2108 OE1 GLU A 147 14795 15718 14026 316 655 1157 O ATOM 2109 OE2 GLU A 147 -15.352 4.035 -38.915 1.00118.09 O ANISOU 2109 OE2 GLU A 147 14942 15922 14004 358 613 1326 O ATOM 0 H GLU A 147 -14.030 5.047 -33.197 1.00 31.67 H new ATOM 0 HA GLU A 147 -16.182 5.804 -34.441 1.00 40.48 H new ATOM 0 HB2 GLU A 147 -14.276 5.051 -35.608 1.00 65.73 H new ATOM 0 HB3 GLU A 147 -14.523 3.601 -35.089 1.00 65.73 H new ATOM 0 HG2 GLU A 147 -16.488 3.450 -36.360 1.00 91.02 H new ATOM 0 HG3 GLU A 147 -16.319 4.927 -36.832 1.00 91.02 H new ATOM 2116 N GLU A 148 -16.460 2.979 -32.958 1.00 24.15 N ANISOU 2116 N GLU A 148 3004 3482 2691 117 316 784 N ATOM 2117 CA GLU A 148 -17.467 2.039 -32.478 1.00 24.08 C ANISOU 2117 CA GLU A 148 3055 3464 2630 119 242 638 C ATOM 2118 C GLU A 148 -18.445 2.733 -31.529 1.00 22.54 C ANISOU 2118 C GLU A 148 2848 3162 2553 77 164 615 C ATOM 2119 O GLU A 148 -19.650 2.449 -31.553 1.00 22.99 O ANISOU 2119 O GLU A 148 2947 3221 2567 84 100 558 O ATOM 2120 CB GLU A 148 -16.812 0.863 -31.801 1.00 24.83 C ANISOU 2120 CB GLU A 148 3157 3550 2726 118 258 521 C ATOM 2121 CG GLU A 148 -17.779 -0.236 -31.411 1.00 30.75 C ANISOU 2121 CG GLU A 148 3962 4296 3425 126 193 382 C ATOM 2122 CD GLU A 148 -17.205 -1.608 -31.696 1.00 40.25 C ANISOU 2122 CD GLU A 148 5190 5562 4544 160 226 294 C ATOM 2123 OE1 GLU A 148 -17.516 -2.153 -32.780 1.00 47.98 O ANISOU 2123 OE1 GLU A 148 6210 6634 5387 208 228 272 O ATOM 2124 OE2 GLU A 148 -16.430 -2.118 -30.860 1.00 39.90 O ANISOU 2124 OE2 GLU A 148 5120 5472 4567 143 246 244 O ATOM 0 H GLU A 148 -15.655 2.823 -32.699 1.00 24.15 H new ATOM 0 HA GLU A 148 -17.967 1.712 -33.242 1.00 24.08 H new ATOM 0 HB2 GLU A 148 -16.138 0.494 -32.393 1.00 24.83 H new ATOM 0 HB3 GLU A 148 -16.351 1.174 -31.006 1.00 24.83 H new ATOM 0 HG2 GLU A 148 -17.991 -0.162 -30.467 1.00 30.75 H new ATOM 0 HG3 GLU A 148 -18.611 -0.125 -31.898 1.00 30.75 H new ATOM 2131 N ALA A 149 -17.948 3.666 -30.696 1.00 22.45 N ANISOU 2131 N ALA A 149 2775 3054 2700 36 166 657 N ATOM 2132 CA ALA A 149 -18.849 4.370 -29.787 1.00 22.04 C ANISOU 2132 CA ALA A 149 2710 2903 2759 3 96 627 C ATOM 2133 C ALA A 149 -19.897 5.139 -30.571 1.00 22.98 C ANISOU 2133 C ALA A 149 2836 3035 2859 12 62 708 C ATOM 2134 O ALA A 149 -21.080 5.177 -30.194 1.00 24.01 O ANISOU 2134 O ALA A 149 2990 3128 3006 5 -2 653 O ATOM 2135 CB ALA A 149 -18.076 5.324 -28.867 1.00 19.81 C ANISOU 2135 CB ALA A 149 2356 2518 2652 -34 99 655 C ATOM 0 H ALA A 149 -17.120 3.895 -30.647 1.00 22.45 H new ATOM 0 HA ALA A 149 -19.290 3.707 -29.234 1.00 22.04 H new ATOM 0 HB1 ALA A 149 -18.697 5.777 -28.275 1.00 19.81 H new ATOM 0 HB2 ALA A 149 -17.438 4.819 -28.340 1.00 19.81 H new ATOM 0 HB3 ALA A 149 -17.604 5.980 -29.404 1.00 19.81 H new ATOM 2141 N VAL A 150 -19.478 5.778 -31.666 1.00 23.30 N ANISOU 2141 N VAL A 150 2854 3130 2871 28 107 847 N ATOM 2142 CA VAL A 150 -20.427 6.536 -32.485 1.00 22.56 C ANISOU 2142 CA VAL A 150 2763 3054 2754 40 74 942 C ATOM 2143 C VAL A 150 -21.453 5.598 -33.108 1.00 23.62 C ANISOU 2143 C VAL A 150 2976 3273 2726 78 28 870 C ATOM 2144 O VAL A 150 -22.642 5.913 -33.165 1.00 27.15 O ANISOU 2144 O VAL A 150 3436 3694 3185 75 -40 865 O ATOM 2145 CB VAL A 150 -19.672 7.354 -33.548 1.00 25.92 C ANISOU 2145 CB VAL A 150 3145 3531 3173 57 142 1122 C ATOM 2146 CG1 VAL A 150 -20.635 7.858 -34.632 1.00 27.70 C ANISOU 2146 CG1 VAL A 150 3392 3815 3316 86 110 1223 C ATOM 2147 CG2 VAL A 150 -18.962 8.537 -32.901 1.00 26.71 C ANISOU 2147 CG2 VAL A 150 3150 3514 3486 13 160 1202 C ATOM 0 H VAL A 150 -18.665 5.786 -31.948 1.00 23.30 H new ATOM 0 HA VAL A 150 -20.910 7.162 -31.923 1.00 22.56 H new ATOM 0 HB VAL A 150 -19.013 6.775 -33.961 1.00 25.92 H new ATOM 0 HG11 VAL A 150 -20.141 8.370 -35.291 1.00 27.70 H new ATOM 0 HG12 VAL A 150 -21.061 7.101 -35.064 1.00 27.70 H new ATOM 0 HG13 VAL A 150 -21.312 8.422 -34.227 1.00 27.70 H new ATOM 0 HG21 VAL A 150 -18.491 9.043 -33.581 1.00 26.71 H new ATOM 0 HG22 VAL A 150 -19.615 9.109 -32.467 1.00 26.71 H new ATOM 0 HG23 VAL A 150 -18.328 8.213 -32.242 1.00 26.71 H new ATOM 2157 N ALA A 151 -21.009 4.420 -33.561 1.00 22.87 N ANISOU 2157 N ALA A 151 2928 3272 2490 113 61 805 N ATOM 2158 CA ALA A 151 -21.915 3.511 -34.236 1.00 26.79 C ANISOU 2158 CA ALA A 151 3492 3848 2839 154 11 730 C ATOM 2159 C ALA A 151 -22.988 3.013 -33.273 1.00 26.17 C ANISOU 2159 C ALA A 151 3431 3689 2825 130 -67 600 C ATOM 2160 O ALA A 151 -24.155 2.891 -33.650 1.00 29.36 O ANISOU 2160 O ALA A 151 3863 4103 3188 145 -137 575 O ATOM 2161 CB ALA A 151 -21.147 2.330 -34.817 1.00 30.68 C ANISOU 2161 CB ALA A 151 4024 4445 3189 198 62 669 C ATOM 0 H ALA A 151 -20.200 4.140 -33.485 1.00 22.87 H new ATOM 0 HA ALA A 151 -22.346 3.991 -34.960 1.00 26.79 H new ATOM 0 HB1 ALA A 151 -21.765 1.731 -35.265 1.00 30.68 H new ATOM 0 HB2 ALA A 151 -20.491 2.653 -35.454 1.00 30.68 H new ATOM 0 HB3 ALA A 151 -20.696 1.854 -34.102 1.00 30.68 H new ATOM 2167 N VAL A 152 -22.613 2.751 -32.029 1.00 22.18 N ANISOU 2167 N VAL A 152 2903 3102 2421 95 -55 526 N ATOM 2168 CA VAL A 152 -23.540 2.078 -31.127 1.00 19.28 C ANISOU 2168 CA VAL A 152 2555 2675 2096 82 -112 405 C ATOM 2169 C VAL A 152 -24.451 3.054 -30.391 1.00 20.16 C ANISOU 2169 C VAL A 152 2636 2687 2336 50 -158 423 C ATOM 2170 O VAL A 152 -25.498 2.634 -29.883 1.00 21.42 O ANISOU 2170 O VAL A 152 2809 2806 2523 47 -207 347 O ATOM 2171 CB VAL A 152 -22.833 1.215 -30.088 1.00 19.94 C ANISOU 2171 CB VAL A 152 2635 2727 2215 69 -82 312 C ATOM 2172 CG1 VAL A 152 -22.075 0.038 -30.757 1.00 23.82 C ANISOU 2172 CG1 VAL A 152 3155 3307 2587 104 -43 266 C ATOM 2173 CG2 VAL A 152 -21.880 2.031 -29.204 1.00 19.60 C ANISOU 2173 CG2 VAL A 152 2542 2617 2286 34 -44 352 C ATOM 0 H VAL A 152 -21.847 2.948 -31.692 1.00 22.18 H new ATOM 0 HA VAL A 152 -24.072 1.510 -31.706 1.00 19.28 H new ATOM 0 HB VAL A 152 -23.525 0.852 -29.513 1.00 19.94 H new ATOM 0 HG11 VAL A 152 -21.635 -0.493 -30.075 1.00 23.82 H new ATOM 0 HG12 VAL A 152 -22.704 -0.517 -31.244 1.00 23.82 H new ATOM 0 HG13 VAL A 152 -21.411 0.388 -31.371 1.00 23.82 H new ATOM 0 HG21 VAL A 152 -21.454 1.444 -28.560 1.00 19.60 H new ATOM 0 HG22 VAL A 152 -21.202 2.449 -29.758 1.00 19.60 H new ATOM 0 HG23 VAL A 152 -22.381 2.716 -28.734 1.00 19.60 H new ATOM 2183 N GLU A 153 -24.104 4.323 -30.324 1.00 20.59 N ANISOU 2183 N GLU A 153 2644 2698 2481 28 -142 522 N ATOM 2184 CA GLU A 153 -24.899 5.271 -29.550 1.00 19.24 C ANISOU 2184 CA GLU A 153 2439 2425 2446 0 -183 526 C ATOM 2185 C GLU A 153 -25.940 6.002 -30.375 1.00 21.30 C ANISOU 2185 C GLU A 153 2696 2689 2710 9 -232 605 C ATOM 2186 O GLU A 153 -26.786 6.702 -29.815 1.00 25.20 O ANISOU 2186 O GLU A 153 3162 3099 3315 -10 -272 600 O ATOM 2187 CB GLU A 153 -23.990 6.278 -28.849 1.00 19.37 C ANISOU 2187 CB GLU A 153 2397 2368 2595 -30 -153 570 C ATOM 2188 CG GLU A 153 -23.421 7.332 -29.766 1.00 22.63 C ANISOU 2188 CG GLU A 153 2766 2794 3037 -31 -126 720 C ATOM 2189 CD GLU A 153 -22.368 8.173 -29.091 1.00 24.48 C ANISOU 2189 CD GLU A 153 2933 2951 3415 -60 -97 753 C ATOM 2190 OE1 GLU A 153 -22.163 8.005 -27.864 1.00 23.94 O ANISOU 2190 OE1 GLU A 153 2858 2820 3418 -77 -109 650 O ATOM 2191 OE2 GLU A 153 -21.739 8.966 -29.814 1.00 26.35 O ANISOU 2191 OE2 GLU A 153 3124 3196 3693 -62 -63 885 O ATOM 0 H GLU A 153 -23.417 4.661 -30.715 1.00 20.59 H new ATOM 0 HA GLU A 153 -25.383 4.746 -28.893 1.00 19.24 H new ATOM 0 HB2 GLU A 153 -24.490 6.714 -28.141 1.00 19.37 H new ATOM 0 HB3 GLU A 153 -23.259 5.801 -28.427 1.00 19.37 H new ATOM 0 HG2 GLU A 153 -23.038 6.904 -30.548 1.00 22.63 H new ATOM 0 HG3 GLU A 153 -24.138 7.906 -30.079 1.00 22.63 H new ATOM 2198 N GLY A 154 -25.913 5.864 -31.702 1.00 21.09 N ANISOU 2198 N GLY A 154 2695 2759 2560 41 -231 677 N ATOM 2199 CA GLY A 154 -26.812 6.617 -32.548 1.00 23.19 C ANISOU 2199 CA GLY A 154 2954 3034 2822 53 -281 769 C ATOM 2200 C GLY A 154 -28.106 5.851 -32.728 1.00 24.91 C ANISOU 2200 C GLY A 154 3214 3266 2986 72 -356 682 C ATOM 2201 O GLY A 154 -28.285 4.752 -32.217 1.00 23.83 O ANISOU 2201 O GLY A 154 3105 3128 2821 75 -364 559 O ATOM 0 H GLY A 154 -25.379 5.338 -32.123 1.00 21.09 H new ATOM 0 HA2 GLY A 154 -26.992 7.484 -32.153 1.00 23.19 H new ATOM 0 HA3 GLY A 154 -26.399 6.779 -33.411 1.00 23.19 H new ATOM 2205 N PRO A 155 -29.044 6.442 -33.469 1.00 28.13 N ANISOU 2205 N PRO A 155 3617 3680 3390 85 -417 753 N ATOM 2206 CA PRO A 155 -30.305 5.738 -33.737 1.00 26.96 C ANISOU 2206 CA PRO A 155 3500 3541 3201 105 -500 675 C ATOM 2207 C PRO A 155 -30.131 4.332 -34.306 1.00 30.01 C ANISOU 2207 C PRO A 155 3946 4026 3430 144 -508 581 C ATOM 2208 O PRO A 155 -30.933 3.447 -33.985 1.00 30.91 O ANISOU 2208 O PRO A 155 4074 4112 3558 148 -559 468 O ATOM 2209 CB PRO A 155 -31.007 6.679 -34.727 1.00 32.22 C ANISOU 2209 CB PRO A 155 4154 4228 3861 121 -557 798 C ATOM 2210 CG PRO A 155 -30.472 8.041 -34.388 1.00 36.62 C ANISOU 2210 CG PRO A 155 4650 4717 4546 89 -510 918 C ATOM 2211 CD PRO A 155 -29.046 7.842 -33.928 1.00 33.22 C ANISOU 2211 CD PRO A 155 4215 4300 4106 76 -418 907 C ATOM 0 HA PRO A 155 -30.807 5.571 -32.924 1.00 26.96 H new ATOM 0 HB2 PRO A 155 -30.808 6.439 -35.645 1.00 32.22 H new ATOM 0 HB3 PRO A 155 -31.971 6.642 -34.627 1.00 32.22 H new ATOM 0 HG2 PRO A 155 -30.507 8.627 -35.160 1.00 36.62 H new ATOM 0 HG3 PRO A 155 -31.004 8.457 -33.692 1.00 36.62 H new ATOM 0 HD2 PRO A 155 -28.412 7.986 -34.648 1.00 33.22 H new ATOM 0 HD3 PRO A 155 -28.809 8.455 -33.215 1.00 33.22 H new ATOM 2219 N GLY A 156 -29.139 4.120 -35.147 1.00 31.65 N ANISOU 2219 N GLY A 156 4182 4342 3501 176 -460 626 N ATOM 2220 CA GLY A 156 -28.937 2.769 -35.671 1.00 30.86 C ANISOU 2220 CA GLY A 156 4135 4332 3257 218 -468 522 C ATOM 2221 C GLY A 156 -28.126 1.842 -34.807 1.00 24.92 C ANISOU 2221 C GLY A 156 3385 3557 2526 202 -409 419 C ATOM 2222 O GLY A 156 -27.750 0.750 -35.258 1.00 23.65 O ANISOU 2222 O GLY A 156 3262 3471 2255 237 -402 338 O ATOM 0 H GLY A 156 -28.584 4.716 -35.425 1.00 31.65 H new ATOM 0 HA2 GLY A 156 -29.806 2.366 -35.820 1.00 30.86 H new ATOM 0 HA3 GLY A 156 -28.504 2.838 -36.536 1.00 30.86 H new ATOM 2226 N GLY A 157 -27.867 2.219 -33.554 1.00 21.25 N ANISOU 2226 N GLY A 157 2880 2991 2203 153 -370 414 N ATOM 2227 CA GLY A 157 -26.855 1.504 -32.774 1.00 20.45 C ANISOU 2227 CA GLY A 157 2777 2879 2116 140 -305 346 C ATOM 2228 C GLY A 157 -27.261 0.096 -32.386 1.00 20.78 C ANISOU 2228 C GLY A 157 2841 2910 2144 150 -334 206 C ATOM 2229 O GLY A 157 -26.439 -0.827 -32.433 1.00 22.17 O ANISOU 2229 O GLY A 157 3034 3131 2260 167 -295 148 O ATOM 0 H GLY A 157 -28.255 2.869 -33.145 1.00 21.25 H new ATOM 0 HA2 GLY A 157 -26.033 1.464 -33.287 1.00 20.45 H new ATOM 0 HA3 GLY A 157 -26.663 2.009 -31.969 1.00 20.45 H new ATOM 2233 N HIS A 158 -28.525 -0.092 -31.984 1.00 20.83 N ANISOU 2233 N HIS A 158 2840 2851 2223 142 -401 154 N ATOM 2234 CA HIS A 158 -28.965 -1.442 -31.636 1.00 20.42 C ANISOU 2234 CA HIS A 158 2797 2779 2181 152 -430 32 C ATOM 2235 C HIS A 158 -28.951 -2.361 -32.858 1.00 19.16 C ANISOU 2235 C HIS A 158 2676 2713 1889 202 -470 -25 C ATOM 2236 O HIS A 158 -28.515 -3.517 -32.758 1.00 21.17 O ANISOU 2236 O HIS A 158 2941 2984 2118 217 -456 -115 O ATOM 2237 CB HIS A 158 -30.393 -1.393 -31.070 1.00 22.94 C ANISOU 2237 CB HIS A 158 3091 3009 2615 136 -493 2 C ATOM 2238 CG HIS A 158 -30.475 -0.805 -29.703 1.00 21.32 C ANISOU 2238 CG HIS A 158 2851 2712 2538 97 -452 19 C ATOM 2239 ND1 HIS A 158 -31.594 -0.153 -29.253 1.00 18.82 N ANISOU 2239 ND1 HIS A 158 2504 2319 2326 81 -486 38 N ATOM 2240 CD2 HIS A 158 -29.603 -0.803 -28.674 1.00 18.03 C ANISOU 2240 CD2 HIS A 158 2423 2269 2157 76 -384 12 C ATOM 2241 CE1 HIS A 158 -31.419 0.262 -28.016 1.00 18.21 C ANISOU 2241 CE1 HIS A 158 2404 2180 2337 56 -438 39 C ATOM 2242 NE2 HIS A 158 -30.197 -0.096 -27.637 1.00 17.37 N ANISOU 2242 NE2 HIS A 158 2310 2104 2188 52 -379 24 N ATOM 0 H HIS A 158 -29.120 0.525 -31.909 1.00 20.83 H new ATOM 0 HA HIS A 158 -28.351 -1.793 -30.972 1.00 20.42 H new ATOM 0 HB2 HIS A 158 -30.953 -0.876 -31.670 1.00 22.94 H new ATOM 0 HB3 HIS A 158 -30.755 -2.293 -31.049 1.00 22.94 H new ATOM 0 HD2 HIS A 158 -28.762 -1.200 -28.661 1.00 18.03 H new ATOM 0 HE1 HIS A 158 -32.040 0.723 -27.500 1.00 18.21 H new ATOM 0 HE2 HIS A 158 -29.835 0.080 -26.877 1.00 17.37 H new ATOM 2250 N ALA A 159 -29.392 -1.851 -33.998 1.00 20.22 N ANISOU 2250 N ALA A 159 2832 2912 1938 232 -520 26 N ATOM 2251 CA ALA A 159 -29.363 -2.620 -35.241 1.00 22.47 C ANISOU 2251 CA ALA A 159 3161 3303 2075 290 -564 -30 C ATOM 2252 C ALA A 159 -27.931 -2.980 -35.620 1.00 23.22 C ANISOU 2252 C ALA A 159 3278 3487 2057 315 -477 -28 C ATOM 2253 O ALA A 159 -27.674 -4.096 -36.079 1.00 24.74 O ANISOU 2253 O ALA A 159 3496 3733 2172 355 -489 -131 O ATOM 2254 CB ALA A 159 -30.031 -1.838 -36.359 1.00 25.09 C ANISOU 2254 CB ALA A 159 3512 3696 2323 321 -630 46 C ATOM 0 H ALA A 159 -29.714 -1.058 -34.077 1.00 20.22 H new ATOM 0 HA ALA A 159 -29.855 -3.445 -35.103 1.00 22.47 H new ATOM 0 HB1 ALA A 159 -30.006 -2.358 -37.178 1.00 25.09 H new ATOM 0 HB2 ALA A 159 -30.953 -1.656 -36.120 1.00 25.09 H new ATOM 0 HB3 ALA A 159 -29.561 -1.000 -36.494 1.00 25.09 H new ATOM 2260 N TYR A 160 -27.000 -2.039 -35.451 1.00 22.86 N ANISOU 2260 N TYR A 160 3217 3454 2014 294 -392 87 N ATOM 2261 CA TYR A 160 -25.595 -2.305 -35.745 1.00 25.12 C ANISOU 2261 CA TYR A 160 3513 3815 2217 314 -299 102 C ATOM 2262 C TYR A 160 -25.088 -3.492 -34.943 1.00 24.02 C ANISOU 2262 C TYR A 160 3365 3633 2130 303 -272 -16 C ATOM 2263 O TYR A 160 -24.510 -4.426 -35.503 1.00 25.59 O ANISOU 2263 O TYR A 160 3586 3901 2234 345 -252 -88 O ATOM 2264 CB TYR A 160 -24.786 -1.037 -35.465 1.00 27.41 C ANISOU 2264 CB TYR A 160 3768 4088 2558 282 -220 246 C ATOM 2265 CG TYR A 160 -23.283 -1.181 -35.436 1.00 35.58 C ANISOU 2265 CG TYR A 160 4791 5163 3565 286 -115 274 C ATOM 2266 CD1 TYR A 160 -22.533 -1.127 -36.607 1.00 42.71 C ANISOU 2266 CD1 TYR A 160 5715 6192 4323 338 -59 336 C ATOM 2267 CD2 TYR A 160 -22.611 -1.319 -34.236 1.00 41.40 C ANISOU 2267 CD2 TYR A 160 5492 5816 4423 241 -71 246 C ATOM 2268 CE1 TYR A 160 -21.145 -1.246 -36.577 1.00 49.45 C ANISOU 2268 CE1 TYR A 160 6547 7076 5165 342 44 367 C ATOM 2269 CE2 TYR A 160 -21.230 -1.435 -34.190 1.00 48.94 C ANISOU 2269 CE2 TYR A 160 6428 6799 5370 244 18 273 C ATOM 2270 CZ TYR A 160 -20.502 -1.399 -35.361 1.00 52.17 C ANISOU 2270 CZ TYR A 160 6851 7323 5647 292 78 334 C ATOM 2271 OH TYR A 160 -19.126 -1.512 -35.302 1.00 53.79 O ANISOU 2271 OH TYR A 160 7028 7550 5860 294 173 365 O ATOM 0 H TYR A 160 -27.163 -1.243 -35.168 1.00 22.86 H new ATOM 0 HA TYR A 160 -25.492 -2.541 -36.680 1.00 25.12 H new ATOM 0 HB2 TYR A 160 -25.014 -0.378 -36.139 1.00 27.41 H new ATOM 0 HB3 TYR A 160 -25.072 -0.678 -34.610 1.00 27.41 H new ATOM 0 HD1 TYR A 160 -22.965 -1.010 -37.422 1.00 42.71 H new ATOM 0 HD2 TYR A 160 -23.096 -1.334 -33.442 1.00 41.40 H new ATOM 0 HE1 TYR A 160 -20.655 -1.223 -37.367 1.00 49.45 H new ATOM 0 HE2 TYR A 160 -20.797 -1.537 -33.373 1.00 48.94 H new ATOM 0 HH TYR A 160 -18.893 -1.691 -34.515 1.00 53.79 H new ATOM 2281 N LEU A 161 -25.322 -3.487 -33.632 1.00 21.80 N ANISOU 2281 N LEU A 161 3049 3238 1996 252 -271 -37 N ATOM 2282 CA LEU A 161 -24.872 -4.572 -32.778 1.00 20.56 C ANISOU 2282 CA LEU A 161 2879 3036 1898 240 -247 -131 C ATOM 2283 C LEU A 161 -25.610 -5.870 -33.067 1.00 21.18 C ANISOU 2283 C LEU A 161 2972 3112 1965 270 -316 -259 C ATOM 2284 O LEU A 161 -24.990 -6.949 -33.142 1.00 21.34 O ANISOU 2284 O LEU A 161 2994 3154 1959 293 -295 -341 O ATOM 2285 CB LEU A 161 -25.044 -4.189 -31.316 1.00 20.60 C ANISOU 2285 CB LEU A 161 2848 2931 2050 186 -234 -114 C ATOM 2286 CG LEU A 161 -24.075 -3.162 -30.779 1.00 22.23 C ANISOU 2286 CG LEU A 161 3030 3119 2297 156 -166 -22 C ATOM 2287 CD1 LEU A 161 -24.402 -2.832 -29.331 1.00 22.27 C ANISOU 2287 CD1 LEU A 161 3006 3022 2434 113 -169 -28 C ATOM 2288 CD2 LEU A 161 -22.636 -3.672 -30.857 1.00 21.75 C ANISOU 2288 CD2 LEU A 161 2965 3104 2195 167 -94 -30 C ATOM 0 H LEU A 161 -25.742 -2.860 -33.220 1.00 21.80 H new ATOM 0 HA LEU A 161 -23.933 -4.722 -32.967 1.00 20.56 H new ATOM 0 HB2 LEU A 161 -25.945 -3.852 -31.193 1.00 20.60 H new ATOM 0 HB3 LEU A 161 -24.966 -4.993 -30.779 1.00 20.60 H new ATOM 0 HG LEU A 161 -24.160 -2.365 -31.325 1.00 22.23 H new ATOM 0 HD11 LEU A 161 -23.773 -2.172 -28.999 1.00 22.27 H new ATOM 0 HD12 LEU A 161 -25.303 -2.476 -29.275 1.00 22.27 H new ATOM 0 HD13 LEU A 161 -24.339 -3.637 -28.793 1.00 22.27 H new ATOM 0 HD21 LEU A 161 -22.034 -2.997 -30.507 1.00 21.75 H new ATOM 0 HD22 LEU A 161 -22.551 -4.483 -30.332 1.00 21.75 H new ATOM 0 HD23 LEU A 161 -22.409 -3.860 -31.781 1.00 21.75 H new ATOM 2300 N ARG A 162 -26.930 -5.791 -33.227 1.00 24.21 N ANISOU 2300 N ARG A 162 3356 3462 2382 272 -402 -279 N ATOM 2301 CA ARG A 162 -27.698 -6.984 -33.587 1.00 24.72 C ANISOU 2301 CA ARG A 162 3425 3516 2452 302 -482 -402 C ATOM 2302 C ARG A 162 -27.160 -7.612 -34.858 1.00 24.21 C ANISOU 2302 C ARG A 162 3399 3565 2233 365 -492 -464 C ATOM 2303 O ARG A 162 -26.889 -8.827 -34.911 1.00 26.68 O ANISOU 2303 O ARG A 162 3709 3877 2551 389 -500 -577 O ATOM 2304 CB ARG A 162 -29.173 -6.599 -33.750 1.00 28.19 C ANISOU 2304 CB ARG A 162 3856 3910 2945 298 -577 -396 C ATOM 2305 CG ARG A 162 -30.057 -7.658 -34.383 1.00 37.75 C ANISOU 2305 CG ARG A 162 5068 5116 4158 336 -681 -517 C ATOM 2306 CD ARG A 162 -31.497 -7.138 -34.566 1.00 47.42 C ANISOU 2306 CD ARG A 162 6278 6294 5444 330 -778 -498 C ATOM 2307 NE ARG A 162 -31.929 -6.357 -33.409 1.00 53.84 N ANISOU 2307 NE ARG A 162 7053 7011 6393 274 -741 -417 N ATOM 2308 CZ ARG A 162 -32.366 -5.094 -33.446 1.00 58.51 C ANISOU 2308 CZ ARG A 162 7643 7595 6994 256 -747 -316 C ATOM 2309 NH1 ARG A 162 -32.470 -4.431 -34.591 1.00 59.19 N ANISOU 2309 NH1 ARG A 162 7761 7764 6964 286 -791 -266 N ATOM 2310 NH2 ARG A 162 -32.721 -4.499 -32.319 1.00 60.25 N ANISOU 2310 NH2 ARG A 162 7826 7724 7343 211 -710 -264 N ATOM 0 H ARG A 162 -27.393 -5.072 -33.134 1.00 24.21 H new ATOM 0 HA ARG A 162 -27.614 -7.643 -32.880 1.00 24.72 H new ATOM 0 HB2 ARG A 162 -29.533 -6.380 -32.876 1.00 28.19 H new ATOM 0 HB3 ARG A 162 -29.224 -5.793 -34.288 1.00 28.19 H new ATOM 0 HG2 ARG A 162 -29.691 -7.917 -35.243 1.00 37.75 H new ATOM 0 HG3 ARG A 162 -30.065 -8.453 -33.827 1.00 37.75 H new ATOM 0 HD2 ARG A 162 -31.547 -6.591 -35.365 1.00 47.42 H new ATOM 0 HD3 ARG A 162 -32.100 -7.887 -34.697 1.00 47.42 H new ATOM 0 HE ARG A 162 -31.900 -6.742 -32.640 1.00 53.84 H new ATOM 0 HH11 ARG A 162 -32.254 -4.813 -35.330 1.00 59.19 H new ATOM 0 HH12 ARG A 162 -32.753 -3.619 -34.594 1.00 59.19 H new ATOM 0 HH21 ARG A 162 -32.669 -4.924 -31.573 1.00 60.25 H new ATOM 0 HH22 ARG A 162 -33.003 -3.687 -32.332 1.00 60.25 H new ATOM 2324 N ASP A 163 -27.008 -6.817 -35.911 1.00 21.62 N ANISOU 2324 N ASP A 163 3108 3340 1769 398 -490 -394 N ATOM 2325 CA ASP A 163 -26.598 -7.399 -37.188 1.00 25.18 C ANISOU 2325 CA ASP A 163 3602 3915 2051 470 -503 -458 C ATOM 2326 C ASP A 163 -25.198 -8.000 -37.083 1.00 23.21 C ANISOU 2326 C ASP A 163 3350 3704 1764 483 -402 -486 C ATOM 2327 O ASP A 163 -24.915 -9.061 -37.644 1.00 24.00 O ANISOU 2327 O ASP A 163 3468 3854 1799 534 -417 -605 O ATOM 2328 CB ASP A 163 -26.634 -6.348 -38.293 1.00 32.60 C ANISOU 2328 CB ASP A 163 4580 4967 2840 507 -506 -350 C ATOM 2329 CG ASP A 163 -28.034 -5.828 -38.552 1.00 40.07 C ANISOU 2329 CG ASP A 163 5528 5882 3813 504 -618 -330 C ATOM 2330 OD1 ASP A 163 -28.152 -4.713 -39.101 1.00 42.55 O ANISOU 2330 OD1 ASP A 163 5856 6251 4059 511 -615 -204 O ATOM 2331 OD2 ASP A 163 -29.008 -6.527 -38.198 1.00 41.95 O ANISOU 2331 OD2 ASP A 163 5747 6038 4154 493 -708 -433 O ATOM 0 H ASP A 163 -27.132 -5.966 -35.913 1.00 21.62 H new ATOM 0 HA ASP A 163 -27.223 -8.107 -37.410 1.00 25.18 H new ATOM 0 HB2 ASP A 163 -26.057 -5.607 -38.050 1.00 32.60 H new ATOM 0 HB3 ASP A 163 -26.277 -6.730 -39.110 1.00 32.60 H new ATOM 2336 N HIS A 164 -24.299 -7.321 -36.374 1.00 25.18 N ANISOU 2336 N HIS A 164 3575 3928 2064 440 -304 -383 N ATOM 2337 CA HIS A 164 -22.952 -7.856 -36.251 1.00 29.35 C ANISOU 2337 CA HIS A 164 4094 4485 2571 450 -210 -403 C ATOM 2338 C HIS A 164 -22.915 -9.112 -35.388 1.00 25.96 C ANISOU 2338 C HIS A 164 3635 3968 2260 432 -225 -523 C ATOM 2339 O HIS A 164 -22.270 -10.101 -35.758 1.00 25.01 O ANISOU 2339 O HIS A 164 3518 3886 2096 472 -203 -614 O ATOM 2340 CB HIS A 164 -22.025 -6.779 -35.700 1.00 38.02 C ANISOU 2340 CB HIS A 164 5165 5568 3712 407 -114 -262 C ATOM 2341 CG HIS A 164 -21.550 -5.817 -36.750 1.00 52.36 C ANISOU 2341 CG HIS A 164 7001 7495 5397 440 -62 -143 C ATOM 2342 ND1 HIS A 164 -20.310 -5.921 -37.345 1.00 57.87 N ANISOU 2342 ND1 HIS A 164 7701 8283 6003 478 35 -113 N ATOM 2343 CD2 HIS A 164 -22.146 -4.736 -37.310 1.00 57.58 C ANISOU 2343 CD2 HIS A 164 7676 8190 6010 444 -89 -37 C ATOM 2344 CE1 HIS A 164 -20.161 -4.947 -38.223 1.00 59.23 C ANISOU 2344 CE1 HIS A 164 7887 8544 6073 505 71 14 C ATOM 2345 NE2 HIS A 164 -21.260 -4.214 -38.222 1.00 58.63 N ANISOU 2345 NE2 HIS A 164 7819 8436 6022 484 -6 63 N ATOM 0 H HIS A 164 -24.443 -6.575 -35.971 1.00 25.18 H new ATOM 0 HA HIS A 164 -22.645 -8.118 -37.133 1.00 29.35 H new ATOM 0 HB2 HIS A 164 -22.488 -6.287 -35.004 1.00 38.02 H new ATOM 0 HB3 HIS A 164 -21.257 -7.202 -35.286 1.00 38.02 H new ATOM 0 HD2 HIS A 164 -22.994 -4.409 -37.114 1.00 57.58 H new ATOM 0 HE1 HIS A 164 -19.410 -4.801 -38.752 1.00 59.23 H new ATOM 0 HE2 HIS A 164 -21.399 -3.522 -38.713 1.00 58.63 H new ATOM 2353 N PHE A 165 -23.606 -9.109 -34.254 1.00 22.85 N ANISOU 2353 N PHE A 165 3210 3457 2015 379 -260 -522 N ATOM 2354 CA PHE A 165 -23.590 -10.325 -33.418 1.00 21.50 C ANISOU 2354 CA PHE A 165 3005 3202 1961 365 -270 -618 C ATOM 2355 C PHE A 165 -24.318 -11.470 -34.110 1.00 22.27 C ANISOU 2355 C PHE A 165 3110 3305 2048 411 -358 -757 C ATOM 2356 O PHE A 165 -23.875 -12.624 -34.045 1.00 23.55 O ANISOU 2356 O PHE A 165 3253 3450 2246 431 -353 -854 O ATOM 2357 CB PHE A 165 -24.184 -10.043 -32.049 1.00 20.55 C ANISOU 2357 CB PHE A 165 2850 2967 1992 306 -279 -575 C ATOM 2358 CG PHE A 165 -23.288 -9.247 -31.134 1.00 23.59 C ANISOU 2358 CG PHE A 165 3219 3331 2415 264 -198 -478 C ATOM 2359 CD1 PHE A 165 -21.925 -9.491 -31.081 1.00 27.29 C ANISOU 2359 CD1 PHE A 165 3679 3832 2858 270 -123 -471 C ATOM 2360 CD2 PHE A 165 -23.811 -8.277 -30.333 1.00 24.65 C ANISOU 2360 CD2 PHE A 165 3341 3408 2618 222 -202 -402 C ATOM 2361 CE1 PHE A 165 -21.123 -8.751 -30.231 1.00 27.79 C ANISOU 2361 CE1 PHE A 165 3723 3868 2970 232 -63 -388 C ATOM 2362 CE2 PHE A 165 -23.020 -7.544 -29.496 1.00 24.58 C ANISOU 2362 CE2 PHE A 165 3315 3375 2649 188 -142 -328 C ATOM 2363 CZ PHE A 165 -21.671 -7.783 -29.458 1.00 25.93 C ANISOU 2363 CZ PHE A 165 3477 3576 2798 193 -77 -322 C ATOM 0 H PHE A 165 -24.072 -8.452 -33.953 1.00 22.85 H new ATOM 0 HA PHE A 165 -22.667 -10.596 -33.293 1.00 21.50 H new ATOM 0 HB2 PHE A 165 -25.019 -9.563 -32.163 1.00 20.55 H new ATOM 0 HB3 PHE A 165 -24.398 -10.887 -31.621 1.00 20.55 H new ATOM 0 HD1 PHE A 165 -21.550 -10.152 -31.617 1.00 27.29 H new ATOM 0 HD2 PHE A 165 -24.726 -8.111 -30.357 1.00 24.65 H new ATOM 0 HE1 PHE A 165 -20.209 -8.918 -30.190 1.00 27.79 H new ATOM 0 HE2 PHE A 165 -23.394 -6.887 -28.955 1.00 24.58 H new ATOM 0 HZ PHE A 165 -21.128 -7.277 -28.898 1.00 25.93 H new ATOM 2373 N THR A 166 -25.432 -11.187 -34.798 1.00 22.48 N ANISOU 2373 N THR A 166 3157 3349 2035 431 -447 -773 N ATOM 2374 CA THR A 166 -26.109 -12.227 -35.553 1.00 24.00 C ANISOU 2374 CA THR A 166 3355 3549 2215 481 -545 -914 C ATOM 2375 C THR A 166 -25.196 -12.812 -36.616 1.00 26.58 C ANISOU 2375 C THR A 166 3716 3990 2395 550 -519 -995 C ATOM 2376 O THR A 166 -25.141 -14.038 -36.804 1.00 28.84 O ANISOU 2376 O THR A 166 3986 4256 2717 583 -556 -1134 O ATOM 2377 CB THR A 166 -27.384 -11.703 -36.206 1.00 26.99 C ANISOU 2377 CB THR A 166 3753 3940 2561 496 -649 -911 C ATOM 2378 OG1 THR A 166 -28.294 -11.287 -35.191 1.00 26.37 O ANISOU 2378 OG1 THR A 166 3636 3747 2638 436 -672 -851 O ATOM 2379 CG2 THR A 166 -28.017 -12.799 -37.059 1.00 31.24 C ANISOU 2379 CG2 THR A 166 4296 4490 3084 554 -763 -1073 C ATOM 0 H THR A 166 -25.800 -10.411 -34.836 1.00 22.48 H new ATOM 0 HA THR A 166 -26.349 -12.925 -34.923 1.00 24.00 H new ATOM 0 HB THR A 166 -27.171 -10.948 -36.776 1.00 26.99 H new ATOM 0 HG1 THR A 166 -28.078 -10.523 -34.916 1.00 26.37 H new ATOM 0 HG21 THR A 166 -28.827 -12.461 -37.472 1.00 31.24 H new ATOM 0 HG22 THR A 166 -27.393 -13.073 -37.749 1.00 31.24 H new ATOM 0 HG23 THR A 166 -28.234 -13.561 -36.499 1.00 31.24 H new ATOM 2387 N GLY A 167 -24.492 -11.948 -37.346 1.00 25.86 N ANISOU 2387 N GLY A 167 3666 4018 2140 576 -454 -910 N ATOM 2388 CA GLY A 167 -23.627 -12.405 -38.413 1.00 27.06 C ANISOU 2388 CA GLY A 167 3854 4295 2133 650 -417 -975 C ATOM 2389 C GLY A 167 -22.448 -13.215 -37.918 1.00 28.19 C ANISOU 2389 C GLY A 167 3965 4413 2332 646 -330 -1021 C ATOM 2390 O GLY A 167 -21.910 -14.028 -38.669 1.00 29.05 O ANISOU 2390 O GLY A 167 4078 4569 2393 692 -312 -1100 O ATOM 0 H GLY A 167 -24.506 -11.095 -37.234 1.00 25.86 H new ATOM 0 HA2 GLY A 167 -24.144 -12.943 -39.033 1.00 27.06 H new ATOM 0 HA3 GLY A 167 -23.300 -11.637 -38.908 1.00 27.06 H new ATOM 2394 N ARG A 168 -22.069 -13.034 -36.666 1.00 25.44 N ANISOU 2394 N ARG A 168 3644 3287 2737 243 112 -233 N ATOM 2395 CA ARG A 168 -20.949 -13.781 -36.064 1.00 26.65 C ANISOU 2395 CA ARG A 168 3672 3463 2993 176 125 -314 C ATOM 2396 C ARG A 168 -21.426 -14.945 -35.198 1.00 25.29 C ANISOU 2396 C ARG A 168 3482 3263 2866 189 -15 -338 C ATOM 2397 O ARG A 168 -20.615 -15.558 -34.484 1.00 25.86 O ANISOU 2397 O ARG A 168 3537 3355 2936 274 -22 -388 O ATOM 2398 CB ARG A 168 -20.065 -12.812 -35.286 1.00 29.60 C ANISOU 2398 CB ARG A 168 3910 3862 3475 77 282 -386 C ATOM 2399 CG ARG A 168 -19.342 -11.813 -36.214 1.00 42.25 C ANISOU 2399 CG ARG A 168 5599 5384 5068 -9 609 -423 C ATOM 2400 CD ARG A 168 -18.575 -10.727 -35.460 1.00 59.36 C ANISOU 2400 CD ARG A 168 7592 7547 7414 -208 867 -611 C ATOM 2401 NE ARG A 168 -17.425 -10.231 -36.228 1.00 74.77 N ANISOU 2401 NE ARG A 168 9539 9434 9436 -373 1281 -811 N ATOM 2402 CZ ARG A 168 -17.256 -8.973 -36.645 1.00 81.47 C ANISOU 2402 CZ ARG A 168 10602 10019 10335 -553 1771 -821 C ATOM 2403 NH1 ARG A 168 -18.157 -8.034 -36.373 1.00 81.53 N ANISOU 2403 NH1 ARG A 168 10856 9828 10293 -531 1853 -619 N ATOM 2404 NH2 ARG A 168 -16.167 -8.651 -37.332 1.00 84.92 N ANISOU 2404 NH2 ARG A 168 11038 10343 10884 -737 2100 -998 N ATOM 0 H ARG A 168 -22.447 -12.477 -36.131 1.00 25.44 H new ATOM 0 HA ARG A 168 -20.426 -14.184 -36.775 1.00 26.65 H new ATOM 0 HB2 ARG A 168 -20.607 -12.324 -34.647 1.00 29.60 H new ATOM 0 HB3 ARG A 168 -19.408 -13.313 -34.777 1.00 29.60 H new ATOM 0 HG2 ARG A 168 -18.725 -12.299 -36.783 1.00 42.25 H new ATOM 0 HG3 ARG A 168 -19.994 -11.393 -36.797 1.00 42.25 H new ATOM 0 HD2 ARG A 168 -19.172 -9.989 -35.261 1.00 59.36 H new ATOM 0 HD3 ARG A 168 -18.268 -11.080 -34.610 1.00 59.36 H new ATOM 0 HE ARG A 168 -16.809 -10.798 -36.426 1.00 74.77 H new ATOM 0 HH11 ARG A 168 -18.862 -8.232 -35.922 1.00 81.53 H new ATOM 0 HH12 ARG A 168 -18.035 -7.228 -36.648 1.00 81.53 H new ATOM 0 HH21 ARG A 168 -15.576 -9.251 -37.506 1.00 84.92 H new ATOM 0 HH22 ARG A 168 -16.053 -7.843 -37.603 1.00 84.92 H new ATOM 2418 N GLY A 169 -22.702 -15.312 -35.283 1.00 26.36 N ANISOU 2418 N GLY A 169 3649 3352 3016 145 -81 -354 N ATOM 2419 CA GLY A 169 -23.161 -16.551 -34.691 1.00 24.49 C ANISOU 2419 CA GLY A 169 3486 2978 2839 95 -50 -417 C ATOM 2420 C GLY A 169 -23.411 -16.479 -33.203 1.00 23.36 C ANISOU 2420 C GLY A 169 3394 2733 2750 76 14 -344 C ATOM 2421 O GLY A 169 -23.406 -17.519 -32.539 1.00 23.39 O ANISOU 2421 O GLY A 169 3607 2542 2738 121 146 -338 O ATOM 0 H GLY A 169 -23.313 -14.855 -35.680 1.00 26.36 H new ATOM 0 HA2 GLY A 169 -23.981 -16.823 -35.132 1.00 24.49 H new ATOM 0 HA3 GLY A 169 -22.503 -17.242 -34.864 1.00 24.49 H new ATOM 2425 N ALA A 170 -23.650 -15.294 -32.674 1.00 21.47 N ANISOU 2425 N ALA A 170 3035 2581 2540 48 -32 -281 N ATOM 2426 CA ALA A 170 -23.908 -15.163 -31.251 1.00 21.49 C ANISOU 2426 CA ALA A 170 3080 2512 2571 65 14 -217 C ATOM 2427 C ALA A 170 -25.251 -15.810 -30.888 1.00 21.12 C ANISOU 2427 C ALA A 170 3115 2292 2618 -101 149 -282 C ATOM 2428 O ALA A 170 -26.179 -15.860 -31.708 1.00 23.11 O ANISOU 2428 O ALA A 170 3233 2601 2946 -256 131 -452 O ATOM 2429 CB ALA A 170 -23.941 -13.699 -30.840 1.00 20.47 C ANISOU 2429 CB ALA A 170 2788 2512 2477 40 -52 -172 C ATOM 0 H ALA A 170 -23.668 -14.557 -33.116 1.00 21.47 H new ATOM 0 HA ALA A 170 -23.190 -15.613 -30.779 1.00 21.49 H new ATOM 0 HB1 ALA A 170 -24.114 -13.634 -29.888 1.00 20.47 H new ATOM 0 HB2 ALA A 170 -23.086 -13.287 -31.042 1.00 20.47 H new ATOM 0 HB3 ALA A 170 -24.643 -13.241 -31.328 1.00 20.47 H new ATOM 2435 N PRO A 171 -25.385 -16.309 -29.653 1.00 19.69 N ANISOU 2435 N PRO A 171 3151 1913 2416 -47 322 -210 N ATOM 2436 CA PRO A 171 -26.646 -16.912 -29.260 1.00 21.72 C ANISOU 2436 CA PRO A 171 3505 1943 2804 -283 588 -324 C ATOM 2437 C PRO A 171 -27.726 -15.847 -29.254 1.00 19.10 C ANISOU 2437 C PRO A 171 2851 1812 2596 -461 467 -433 C ATOM 2438 O PRO A 171 -27.449 -14.649 -29.076 1.00 18.24 O ANISOU 2438 O PRO A 171 2597 1904 2431 -346 248 -312 O ATOM 2439 CB PRO A 171 -26.363 -17.417 -27.837 1.00 28.51 C ANISOU 2439 CB PRO A 171 4770 2533 3528 -70 828 -146 C ATOM 2440 CG PRO A 171 -24.895 -17.314 -27.626 1.00 28.82 C ANISOU 2440 CG PRO A 171 4890 2730 3331 350 620 -15 C ATOM 2441 CD PRO A 171 -24.320 -16.412 -28.626 1.00 22.68 C ANISOU 2441 CD PRO A 171 3717 2287 2614 291 312 -82 C ATOM 0 HA PRO A 171 -26.951 -17.618 -29.851 1.00 21.72 H new ATOM 0 HB2 PRO A 171 -26.842 -16.886 -27.182 1.00 28.51 H new ATOM 0 HB3 PRO A 171 -26.662 -18.334 -27.732 1.00 28.51 H new ATOM 0 HG2 PRO A 171 -24.709 -16.983 -26.733 1.00 28.82 H new ATOM 0 HG3 PRO A 171 -24.486 -18.191 -27.694 1.00 28.82 H new ATOM 0 HD2 PRO A 171 -24.106 -15.546 -28.245 1.00 22.68 H new ATOM 0 HD3 PRO A 171 -23.498 -16.769 -28.998 1.00 22.68 H new ATOM 2449 N PRO A 172 -28.995 -16.256 -29.396 1.00 22.01 N ANISOU 2449 N PRO A 172 3095 2132 3136 -743 644 -724 N ATOM 2450 CA PRO A 172 -30.067 -15.244 -29.444 1.00 21.71 C ANISOU 2450 CA PRO A 172 2711 2371 3167 -827 480 -904 C ATOM 2451 C PRO A 172 -30.114 -14.337 -28.245 1.00 20.88 C ANISOU 2451 C PRO A 172 2647 2264 3024 -746 449 -678 C ATOM 2452 O PRO A 172 -30.370 -13.139 -28.395 1.00 21.65 O ANISOU 2452 O PRO A 172 2544 2615 3066 -643 196 -658 O ATOM 2453 CB PRO A 172 -31.347 -16.096 -29.531 1.00 27.32 C ANISOU 2453 CB PRO A 172 3258 3038 4086 -1140 766 -1339 C ATOM 2454 CG PRO A 172 -30.926 -17.389 -30.115 1.00 29.54 C ANISOU 2454 CG PRO A 172 3713 3118 4393 -1202 977 -1401 C ATOM 2455 CD PRO A 172 -29.509 -17.619 -29.607 1.00 26.49 C ANISOU 2455 CD PRO A 172 3793 2422 3852 -1000 1021 -993 C ATOM 0 HA PRO A 172 -29.937 -14.633 -30.186 1.00 21.71 H new ATOM 0 HB2 PRO A 172 -31.743 -16.222 -28.654 1.00 27.32 H new ATOM 0 HB3 PRO A 172 -32.016 -15.664 -30.085 1.00 27.32 H new ATOM 0 HG2 PRO A 172 -31.517 -18.107 -29.839 1.00 29.54 H new ATOM 0 HG3 PRO A 172 -30.950 -17.359 -31.084 1.00 29.54 H new ATOM 0 HD2 PRO A 172 -29.503 -18.134 -28.785 1.00 26.49 H new ATOM 0 HD3 PRO A 172 -28.973 -18.107 -30.252 1.00 26.49 H new ATOM 2463 N TRP A 173 -29.897 -14.858 -27.036 1.00 22.09 N ANISOU 2463 N TRP A 173 3109 2121 3165 -734 722 -510 N ATOM 2464 CA TRP A 173 -29.982 -14.020 -25.858 1.00 21.43 C ANISOU 2464 CA TRP A 173 3051 2063 3030 -624 682 -334 C ATOM 2465 C TRP A 173 -28.941 -12.892 -25.906 1.00 19.01 C ANISOU 2465 C TRP A 173 2646 1987 2591 -364 338 -136 C ATOM 2466 O TRP A 173 -29.179 -11.797 -25.377 1.00 20.52 O ANISOU 2466 O TRP A 173 2699 2316 2781 -326 207 -85 O ATOM 2467 CB TRP A 173 -29.830 -14.837 -24.580 1.00 23.24 C ANISOU 2467 CB TRP A 173 3727 1929 3173 -523 1051 -176 C ATOM 2468 CG TRP A 173 -28.565 -15.605 -24.495 1.00 21.70 C ANISOU 2468 CG TRP A 173 3900 1584 2759 -189 1087 8 C ATOM 2469 CD1 TRP A 173 -28.370 -16.923 -24.789 1.00 23.05 C ANISOU 2469 CD1 TRP A 173 4437 1432 2890 -190 1406 -14 C ATOM 2470 CD2 TRP A 173 -27.292 -15.094 -24.078 1.00 20.98 C ANISOU 2470 CD2 TRP A 173 3827 1701 2444 234 796 168 C ATOM 2471 NE1 TRP A 173 -27.049 -17.276 -24.589 1.00 22.77 N ANISOU 2471 NE1 TRP A 173 4680 1406 2567 280 1290 164 N ATOM 2472 CE2 TRP A 173 -26.375 -16.157 -24.146 1.00 21.61 C ANISOU 2472 CE2 TRP A 173 4269 1626 2315 538 902 229 C ATOM 2473 CE3 TRP A 173 -26.842 -13.830 -23.652 1.00 23.96 C ANISOU 2473 CE3 TRP A 173 3920 2394 2789 378 480 192 C ATOM 2474 CZ2 TRP A 173 -25.012 -16.006 -23.826 1.00 22.63 C ANISOU 2474 CZ2 TRP A 173 4414 1998 2188 1023 646 255 C ATOM 2475 CZ3 TRP A 173 -25.508 -13.688 -23.328 1.00 22.35 C ANISOU 2475 CZ3 TRP A 173 3710 2392 2389 771 285 183 C ATOM 2476 CH2 TRP A 173 -24.621 -14.757 -23.401 1.00 22.55 C ANISOU 2476 CH2 TRP A 173 4029 2347 2194 1108 342 189 C ATOM 0 H TRP A 173 -29.703 -15.682 -26.885 1.00 22.09 H new ATOM 0 HA TRP A 173 -30.865 -13.619 -25.851 1.00 21.43 H new ATOM 0 HB2 TRP A 173 -29.885 -14.239 -23.818 1.00 23.24 H new ATOM 0 HB3 TRP A 173 -30.576 -15.453 -24.512 1.00 23.24 H new ATOM 0 HD1 TRP A 173 -29.034 -17.504 -25.083 1.00 23.05 H new ATOM 0 HE1 TRP A 173 -26.708 -18.055 -24.718 1.00 22.77 H new ATOM 0 HE3 TRP A 173 -27.428 -13.110 -23.591 1.00 23.96 H new ATOM 0 HZ2 TRP A 173 -24.410 -16.711 -23.898 1.00 22.63 H new ATOM 0 HZ3 TRP A 173 -25.194 -12.857 -23.054 1.00 22.35 H new ATOM 0 HH2 TRP A 173 -23.734 -14.623 -23.154 1.00 22.55 H new ATOM 2487 N MET A 174 -27.804 -13.146 -26.535 1.00 18.79 N ANISOU 2487 N MET A 174 2675 1990 2475 -220 244 -79 N ATOM 2488 CA MET A 174 -26.747 -12.142 -26.663 1.00 18.03 C ANISOU 2488 CA MET A 174 2450 2085 2314 -65 37 -12 C ATOM 2489 C MET A 174 -27.114 -11.109 -27.702 1.00 17.05 C ANISOU 2489 C MET A 174 2146 2106 2228 -159 -86 -57 C ATOM 2490 O MET A 174 -26.897 -9.902 -27.484 1.00 18.39 O ANISOU 2490 O MET A 174 2237 2354 2396 -126 -141 -15 O ATOM 2491 CB MET A 174 -25.432 -12.820 -26.998 1.00 21.13 C ANISOU 2491 CB MET A 174 2937 2486 2607 111 24 -17 C ATOM 2492 CG MET A 174 -24.250 -11.904 -27.080 1.00 21.64 C ANISOU 2492 CG MET A 174 2808 2755 2657 207 -94 -86 C ATOM 2493 SD MET A 174 -22.778 -12.963 -27.075 1.00 26.26 S ANISOU 2493 SD MET A 174 3474 3422 3081 514 -118 -193 S ATOM 2494 CE MET A 174 -21.717 -11.902 -28.006 1.00 25.41 C ANISOU 2494 CE MET A 174 3046 3518 3088 369 -136 -390 C ATOM 0 H MET A 174 -27.619 -13.902 -26.901 1.00 18.79 H new ATOM 0 HA MET A 174 -26.646 -11.679 -25.817 1.00 18.03 H new ATOM 0 HB2 MET A 174 -25.253 -13.498 -26.327 1.00 21.13 H new ATOM 0 HB3 MET A 174 -25.528 -13.279 -27.847 1.00 21.13 H new ATOM 0 HG2 MET A 174 -24.285 -11.366 -27.886 1.00 21.64 H new ATOM 0 HG3 MET A 174 -24.236 -11.290 -26.329 1.00 21.64 H new ATOM 0 HE1 MET A 174 -20.848 -12.321 -28.108 1.00 25.41 H new ATOM 0 HE2 MET A 174 -22.104 -11.744 -28.881 1.00 25.41 H new ATOM 0 HE3 MET A 174 -21.615 -11.057 -27.541 1.00 25.41 H new ATOM 2504 N VAL A 175 -27.694 -11.535 -28.831 1.00 16.97 N ANISOU 2504 N VAL A 175 2106 2124 2218 -226 -103 -169 N ATOM 2505 CA VAL A 175 -28.221 -10.596 -29.819 1.00 19.45 C ANISOU 2505 CA VAL A 175 2344 2595 2453 -152 -223 -222 C ATOM 2506 C VAL A 175 -29.280 -9.697 -29.173 1.00 21.07 C ANISOU 2506 C VAL A 175 2452 2891 2662 -141 -283 -253 C ATOM 2507 O VAL A 175 -29.259 -8.459 -29.319 1.00 24.65 O ANISOU 2507 O VAL A 175 2965 3387 3015 -2 -328 -161 O ATOM 2508 CB VAL A 175 -28.789 -11.354 -31.023 1.00 21.58 C ANISOU 2508 CB VAL A 175 2554 2966 2680 -136 -277 -439 C ATOM 2509 CG1 VAL A 175 -29.401 -10.380 -32.032 1.00 24.73 C ANISOU 2509 CG1 VAL A 175 2942 3580 2873 124 -434 -518 C ATOM 2510 CG2 VAL A 175 -27.719 -12.226 -31.666 1.00 22.28 C ANISOU 2510 CG2 VAL A 175 2755 2956 2755 -136 -219 -394 C ATOM 0 H VAL A 175 -27.790 -12.364 -29.040 1.00 16.97 H new ATOM 0 HA VAL A 175 -27.501 -10.031 -30.139 1.00 19.45 H new ATOM 0 HB VAL A 175 -29.496 -11.941 -30.712 1.00 21.58 H new ATOM 0 HG11 VAL A 175 -29.755 -10.876 -32.787 1.00 24.73 H new ATOM 0 HG12 VAL A 175 -30.117 -9.882 -31.608 1.00 24.73 H new ATOM 0 HG13 VAL A 175 -28.719 -9.764 -32.342 1.00 24.73 H new ATOM 0 HG21 VAL A 175 -28.098 -12.697 -32.425 1.00 22.28 H new ATOM 0 HG22 VAL A 175 -26.984 -11.668 -31.966 1.00 22.28 H new ATOM 0 HG23 VAL A 175 -27.393 -12.869 -31.017 1.00 22.28 H new ATOM 2520 N GLU A 176 -30.221 -10.304 -28.454 1.00 21.60 N ANISOU 2520 N GLU A 176 2410 2954 2845 -291 -223 -398 N ATOM 2521 CA GLU A 176 -31.382 -9.574 -27.957 1.00 21.37 C ANISOU 2521 CA GLU A 176 2226 3070 2824 -286 -288 -514 C ATOM 2522 C GLU A 176 -31.033 -8.627 -26.816 1.00 19.40 C ANISOU 2522 C GLU A 176 2051 2745 2576 -245 -282 -281 C ATOM 2523 O GLU A 176 -31.741 -7.611 -26.612 1.00 19.76 O ANISOU 2523 O GLU A 176 2026 2919 2564 -149 -381 -306 O ATOM 2524 CB GLU A 176 -32.450 -10.557 -27.516 1.00 24.24 C ANISOU 2524 CB GLU A 176 2428 3423 3360 -537 -120 -815 C ATOM 2525 CG GLU A 176 -33.070 -11.349 -28.676 1.00 31.47 C ANISOU 2525 CG GLU A 176 3142 4506 4310 -599 -135 -1222 C ATOM 2526 CD GLU A 176 -33.875 -12.541 -28.212 1.00 42.51 C ANISOU 2526 CD GLU A 176 4497 5749 5906 -872 224 -1460 C ATOM 2527 OE1 GLU A 176 -34.033 -12.725 -26.984 1.00 44.29 O ANISOU 2527 OE1 GLU A 176 4859 5744 6224 -1027 476 -1351 O ATOM 2528 OE2 GLU A 176 -34.345 -13.305 -29.081 1.00 48.16 O ANISOU 2528 OE2 GLU A 176 5062 6570 6666 -905 296 -1771 O ATOM 0 H GLU A 176 -30.205 -11.138 -28.243 1.00 21.60 H new ATOM 0 HA GLU A 176 -31.716 -9.026 -28.684 1.00 21.37 H new ATOM 0 HB2 GLU A 176 -32.064 -11.179 -26.879 1.00 24.24 H new ATOM 0 HB3 GLU A 176 -33.152 -10.074 -27.052 1.00 24.24 H new ATOM 0 HG2 GLU A 176 -33.641 -10.761 -29.194 1.00 31.47 H new ATOM 0 HG3 GLU A 176 -32.364 -11.652 -29.268 1.00 31.47 H new ATOM 2535 N ALA A 177 -29.987 -8.913 -26.059 1.00 17.38 N ANISOU 2535 N ALA A 177 1921 2328 2356 -260 -188 -110 N ATOM 2536 CA ALA A 177 -29.687 -8.115 -24.885 1.00 16.65 C ANISOU 2536 CA ALA A 177 1836 2223 2269 -201 -196 8 C ATOM 2537 C ALA A 177 -29.286 -6.697 -25.274 1.00 15.86 C ANISOU 2537 C ALA A 177 1726 2176 2125 -123 -263 57 C ATOM 2538 O ALA A 177 -29.489 -5.777 -24.479 1.00 16.94 O ANISOU 2538 O ALA A 177 1828 2332 2278 -98 -280 87 O ATOM 2539 CB ALA A 177 -28.580 -8.752 -24.067 1.00 17.56 C ANISOU 2539 CB ALA A 177 2060 2253 2360 -103 -129 77 C ATOM 0 H ALA A 177 -29.441 -9.561 -26.206 1.00 17.38 H new ATOM 0 HA ALA A 177 -30.493 -8.074 -24.347 1.00 16.65 H new ATOM 0 HB1 ALA A 177 -28.396 -8.203 -23.289 1.00 17.56 H new ATOM 0 HB2 ALA A 177 -28.857 -9.636 -23.780 1.00 17.56 H new ATOM 0 HB3 ALA A 177 -27.778 -8.824 -24.608 1.00 17.56 H new ATOM 2545 N CYS A 178 -28.738 -6.516 -26.492 1.00 16.16 N ANISOU 2545 N CYS A 178 1848 2191 2099 -84 -238 61 N ATOM 2546 CA CYS A 178 -28.212 -5.210 -26.912 1.00 17.75 C ANISOU 2546 CA CYS A 178 2174 2312 2256 -34 -128 111 C ATOM 2547 C CYS A 178 -29.306 -4.165 -26.874 1.00 16.43 C ANISOU 2547 C CYS A 178 2095 2174 1975 108 -175 147 C ATOM 2548 O CYS A 178 -29.051 -3.008 -26.525 1.00 17.43 O ANISOU 2548 O CYS A 178 2330 2182 2109 113 -41 193 O ATOM 2549 CB CYS A 178 -27.657 -5.317 -28.346 1.00 20.89 C ANISOU 2549 CB CYS A 178 2747 2638 2551 26 -23 126 C ATOM 2550 SG CYS A 178 -26.286 -6.463 -28.535 1.00 24.24 S ANISOU 2550 SG CYS A 178 3070 3057 3082 -98 30 51 S ATOM 0 H CYS A 178 -28.664 -7.136 -27.083 1.00 16.16 H new ATOM 0 HA CYS A 178 -27.504 -4.947 -26.304 1.00 17.75 H new ATOM 0 HB2 CYS A 178 -28.375 -5.590 -28.938 1.00 20.89 H new ATOM 0 HB3 CYS A 178 -27.370 -4.437 -28.635 1.00 20.89 H new ATOM 0 HG CYS A 178 -26.706 -7.540 -28.856 1.00 24.24 H new ATOM 2556 N ALA A 179 -30.517 -4.527 -27.301 1.00 15.87 N ANISOU 2556 N ALA A 179 1970 2276 1783 245 -345 62 N ATOM 2557 CA ALA A 179 -31.609 -3.600 -27.428 1.00 18.15 C ANISOU 2557 CA ALA A 179 2328 2684 1884 503 -446 25 C ATOM 2558 C ALA A 179 -32.175 -3.138 -26.076 1.00 15.33 C ANISOU 2558 C ALA A 179 1818 2368 1637 414 -491 21 C ATOM 2559 O ALA A 179 -32.969 -2.193 -26.064 1.00 16.43 O ANISOU 2559 O ALA A 179 2041 2592 1611 652 -562 4 O ATOM 2560 CB ALA A 179 -32.735 -4.209 -28.261 1.00 22.99 C ANISOU 2560 CB ALA A 179 2794 3601 2340 708 -656 -233 C ATOM 0 H ALA A 179 -30.717 -5.333 -27.525 1.00 15.87 H new ATOM 0 HA ALA A 179 -31.245 -2.819 -27.873 1.00 18.15 H new ATOM 0 HB1 ALA A 179 -33.463 -3.572 -28.337 1.00 22.99 H new ATOM 0 HB2 ALA A 179 -32.402 -4.426 -29.146 1.00 22.99 H new ATOM 0 HB3 ALA A 179 -33.056 -5.016 -27.830 1.00 22.99 H new ATOM 2566 N ARG A 180 -31.781 -3.766 -25.009 1.00 14.16 N ANISOU 2566 N ARG A 180 1508 2168 1703 162 -448 37 N ATOM 2567 CA ARG A 180 -32.155 -3.378 -23.657 1.00 14.83 C ANISOU 2567 CA ARG A 180 1486 2272 1876 101 -462 53 C ATOM 2568 C ARG A 180 -31.187 -2.397 -23.038 1.00 15.13 C ANISOU 2568 C ARG A 180 1604 2171 1973 81 -361 146 C ATOM 2569 O ARG A 180 -31.406 -1.977 -21.883 1.00 16.18 O ANISOU 2569 O ARG A 180 1648 2336 2164 69 -389 145 O ATOM 2570 CB ARG A 180 -32.254 -4.605 -22.754 1.00 15.44 C ANISOU 2570 CB ARG A 180 1442 2340 2084 -66 -410 14 C ATOM 2571 CG ARG A 180 -33.285 -5.595 -23.232 1.00 16.36 C ANISOU 2571 CG ARG A 180 1435 2553 2227 -162 -393 -192 C ATOM 2572 CD ARG A 180 -33.713 -6.533 -22.152 1.00 17.96 C ANISOU 2572 CD ARG A 180 1620 2652 2552 -342 -193 -239 C ATOM 2573 NE ARG A 180 -32.595 -7.349 -21.698 1.00 18.82 N ANISOU 2573 NE ARG A 180 1949 2544 2659 -328 -53 -67 N ATOM 2574 CZ ARG A 180 -32.270 -8.534 -22.190 1.00 20.96 C ANISOU 2574 CZ ARG A 180 2335 2679 2952 -405 94 -102 C ATOM 2575 NH1 ARG A 180 -32.929 -9.055 -23.209 1.00 22.45 N ANISOU 2575 NH1 ARG A 180 2391 2930 3210 -560 122 -334 N ATOM 2576 NH2 ARG A 180 -31.240 -9.180 -21.666 1.00 19.87 N ANISOU 2576 NH2 ARG A 180 2439 2376 2734 -267 192 53 N ATOM 0 H ARG A 180 -31.270 -4.457 -25.037 1.00 14.16 H new ATOM 0 HA ARG A 180 -33.018 -2.942 -23.732 1.00 14.83 H new ATOM 0 HB2 ARG A 180 -31.388 -5.041 -22.710 1.00 15.44 H new ATOM 0 HB3 ARG A 180 -32.475 -4.322 -21.853 1.00 15.44 H new ATOM 0 HG2 ARG A 180 -34.059 -5.116 -23.567 1.00 16.36 H new ATOM 0 HG3 ARG A 180 -32.923 -6.103 -23.974 1.00 16.36 H new ATOM 0 HD2 ARG A 180 -34.075 -6.030 -21.406 1.00 17.96 H new ATOM 0 HD3 ARG A 180 -34.424 -7.106 -22.479 1.00 17.96 H new ATOM 0 HE ARG A 180 -32.109 -7.037 -21.061 1.00 18.82 H new ATOM 0 HH11 ARG A 180 -33.582 -8.623 -23.565 1.00 22.45 H new ATOM 0 HH12 ARG A 180 -32.705 -9.826 -23.517 1.00 22.45 H new ATOM 0 HH21 ARG A 180 -30.796 -8.829 -21.018 1.00 19.87 H new ATOM 0 HH22 ARG A 180 -31.015 -9.951 -21.973 1.00 19.87 H new ATOM 2590 N VAL A 181 -30.127 -2.034 -23.736 1.00 15.17 N ANISOU 2590 N VAL A 181 1746 2032 1987 54 -209 164 N ATOM 2591 CA VAL A 181 -29.123 -1.087 -23.196 1.00 15.37 C ANISOU 2591 CA VAL A 181 1772 1931 2138 -51 -25 99 C ATOM 2592 C VAL A 181 -29.361 0.263 -23.853 1.00 16.97 C ANISOU 2592 C VAL A 181 2301 1916 2229 39 190 167 C ATOM 2593 O VAL A 181 -29.469 0.356 -25.072 1.00 19.16 O ANISOU 2593 O VAL A 181 2872 2080 2329 183 296 257 O ATOM 2594 CB VAL A 181 -27.681 -1.559 -23.437 1.00 15.74 C ANISOU 2594 CB VAL A 181 1717 1952 2311 -192 107 -44 C ATOM 2595 CG1 VAL A 181 -26.663 -0.624 -22.756 1.00 15.91 C ANISOU 2595 CG1 VAL A 181 1588 1936 2521 -345 309 -302 C ATOM 2596 CG2 VAL A 181 -27.460 -3.011 -22.939 1.00 16.06 C ANISOU 2596 CG2 VAL A 181 1578 2171 2352 -144 -87 -70 C ATOM 0 H VAL A 181 -29.956 -2.317 -24.530 1.00 15.17 H new ATOM 0 HA VAL A 181 -29.229 -1.028 -22.234 1.00 15.37 H new ATOM 0 HB VAL A 181 -27.540 -1.536 -24.396 1.00 15.74 H new ATOM 0 HG11 VAL A 181 -25.764 -0.946 -22.925 1.00 15.91 H new ATOM 0 HG12 VAL A 181 -26.757 0.273 -23.114 1.00 15.91 H new ATOM 0 HG13 VAL A 181 -26.826 -0.609 -21.800 1.00 15.91 H new ATOM 0 HG21 VAL A 181 -26.542 -3.275 -23.107 1.00 16.06 H new ATOM 0 HG22 VAL A 181 -27.641 -3.058 -21.987 1.00 16.06 H new ATOM 0 HG23 VAL A 181 -28.059 -3.610 -23.411 1.00 16.06 H new ATOM 2606 N ASP A 182 -29.477 1.316 -23.042 1.00 14.80 N ANISOU 2606 N ASP A 182 2044 1566 2015 15 278 128 N ATOM 2607 CA ASP A 182 -29.647 2.650 -23.580 1.00 16.50 C ANISOU 2607 CA ASP A 182 2687 1480 2102 127 581 203 C ATOM 2608 C ASP A 182 -28.547 2.960 -24.589 1.00 20.23 C ANISOU 2608 C ASP A 182 3449 1622 2616 -13 1037 162 C ATOM 2609 O ASP A 182 -27.363 2.757 -24.289 1.00 21.35 O ANISOU 2609 O ASP A 182 3317 1755 3038 -340 1207 -84 O ATOM 2610 CB ASP A 182 -29.593 3.675 -22.456 1.00 19.87 C ANISOU 2610 CB ASP A 182 3045 1827 2678 16 692 91 C ATOM 2611 CG ASP A 182 -30.712 3.561 -21.458 1.00 25.57 C ANISOU 2611 CG ASP A 182 3551 2825 3337 169 317 142 C ATOM 2612 OD1 ASP A 182 -31.728 2.890 -21.753 1.00 27.64 O ANISOU 2612 OD1 ASP A 182 3777 3305 3420 374 33 243 O ATOM 2613 OD2 ASP A 182 -30.587 4.166 -20.371 1.00 27.57 O ANISOU 2613 OD2 ASP A 182 3649 3091 3736 70 336 22 O ATOM 0 H ASP A 182 -29.459 1.272 -22.183 1.00 14.80 H new ATOM 0 HA ASP A 182 -30.509 2.694 -24.022 1.00 16.50 H new ATOM 0 HB2 ASP A 182 -28.747 3.583 -21.990 1.00 19.87 H new ATOM 0 HB3 ASP A 182 -29.608 4.564 -22.843 1.00 19.87 H new ATOM 2618 N PRO A 183 -28.879 3.517 -25.762 1.00 20.66 N ANISOU 2618 N PRO A 183 2096 2579 3175 -398 -470 1427 N ATOM 2619 CA PRO A 183 -27.825 3.831 -26.726 1.00 23.05 C ANISOU 2619 CA PRO A 183 2831 2693 3233 -389 -501 922 C ATOM 2620 C PRO A 183 -26.737 4.729 -26.138 1.00 20.58 C ANISOU 2620 C PRO A 183 2640 2532 2646 -222 -138 636 C ATOM 2621 O PRO A 183 -25.547 4.514 -26.393 1.00 18.62 O ANISOU 2621 O PRO A 183 2594 2202 2276 -224 -117 382 O ATOM 2622 CB PRO A 183 -28.595 4.518 -27.860 1.00 24.66 C ANISOU 2622 CB PRO A 183 3116 2791 3463 -403 -641 931 C ATOM 2623 CG PRO A 183 -29.968 3.892 -27.793 1.00 26.42 C ANISOU 2623 CG PRO A 183 3008 2946 4086 -560 -959 1413 C ATOM 2624 CD PRO A 183 -30.235 3.694 -26.317 1.00 24.13 C ANISOU 2624 CD PRO A 183 2305 2973 3889 -486 -676 1802 C ATOM 0 HA PRO A 183 -27.336 3.045 -27.017 1.00 23.05 H new ATOM 0 HB2 PRO A 183 -28.635 5.479 -27.732 1.00 24.66 H new ATOM 0 HB3 PRO A 183 -28.175 4.363 -28.720 1.00 24.66 H new ATOM 0 HG2 PRO A 183 -30.637 4.467 -28.197 1.00 26.42 H new ATOM 0 HG3 PRO A 183 -29.993 3.048 -28.271 1.00 26.42 H new ATOM 0 HD2 PRO A 183 -30.687 4.459 -25.927 1.00 24.13 H new ATOM 0 HD3 PRO A 183 -30.795 2.919 -26.153 1.00 24.13 H new ATOM 2632 N GLY A 184 -27.116 5.688 -25.295 1.00 20.75 N ANISOU 2632 N GLY A 184 2540 2757 2587 -31 91 704 N ATOM 2633 CA GLY A 184 -26.130 6.568 -24.701 1.00 18.05 C ANISOU 2633 CA GLY A 184 2359 2429 2069 134 236 419 C ATOM 2634 C GLY A 184 -25.162 5.854 -23.796 1.00 16.39 C ANISOU 2634 C GLY A 184 2172 2252 1804 155 271 320 C ATOM 2635 O GLY A 184 -23.998 6.261 -23.690 1.00 16.97 O ANISOU 2635 O GLY A 184 2397 2209 1844 156 260 78 O ATOM 0 H GLY A 184 -27.929 5.840 -25.060 1.00 20.75 H new ATOM 0 HA2 GLY A 184 -25.635 7.012 -25.407 1.00 18.05 H new ATOM 0 HA3 GLY A 184 -26.586 7.259 -24.196 1.00 18.05 H new ATOM 2639 N GLU A 185 -25.611 4.777 -23.115 1.00 15.96 N ANISOU 2639 N GLU A 185 1918 2346 1800 159 285 577 N ATOM 2640 CA GLU A 185 -24.761 4.001 -22.254 1.00 16.34 C ANISOU 2640 CA GLU A 185 1973 2437 1799 179 316 516 C ATOM 2641 C GLU A 185 -23.896 3.044 -23.048 1.00 15.01 C ANISOU 2641 C GLU A 185 1929 2042 1733 -81 153 374 C ATOM 2642 O GLU A 185 -22.765 2.776 -22.642 1.00 15.40 O ANISOU 2642 O GLU A 185 2075 2063 1715 -71 189 189 O ATOM 2643 CB GLU A 185 -25.595 3.241 -21.229 1.00 18.77 C ANISOU 2643 CB GLU A 185 1965 3024 2141 318 408 956 C ATOM 2644 CG GLU A 185 -26.463 4.162 -20.315 1.00 20.90 C ANISOU 2644 CG GLU A 185 2121 3654 2165 798 648 1159 C ATOM 2645 CD GLU A 185 -25.670 4.968 -19.268 1.00 22.53 C ANISOU 2645 CD GLU A 185 2629 3939 1992 1236 722 783 C ATOM 2646 OE1 GLU A 185 -24.418 4.995 -19.344 1.00 21.38 O ANISOU 2646 OE1 GLU A 185 2730 3524 1868 1068 572 385 O ATOM 2647 OE2 GLU A 185 -26.309 5.554 -18.372 1.00 25.89 O ANISOU 2647 OE2 GLU A 185 3065 4566 2205 1700 758 889 O ATOM 0 H GLU A 185 -26.422 4.494 -23.155 1.00 15.96 H new ATOM 0 HA GLU A 185 -24.172 4.614 -21.786 1.00 16.34 H new ATOM 0 HB2 GLU A 185 -26.177 2.620 -21.694 1.00 18.77 H new ATOM 0 HB3 GLU A 185 -25.003 2.712 -20.672 1.00 18.77 H new ATOM 0 HG2 GLU A 185 -26.955 4.781 -20.876 1.00 20.90 H new ATOM 0 HG3 GLU A 185 -27.118 3.614 -19.855 1.00 20.90 H new ATOM 2654 N LEU A 186 -24.370 2.592 -24.211 1.00 15.55 N ANISOU 2654 N LEU A 186 2042 1940 1925 -239 -60 432 N ATOM 2655 CA LEU A 186 -23.470 1.821 -25.087 1.00 15.28 C ANISOU 2655 CA LEU A 186 2252 1710 1844 -292 -229 222 C ATOM 2656 C LEU A 186 -22.302 2.680 -25.543 1.00 15.18 C ANISOU 2656 C LEU A 186 2391 1728 1648 -189 -24 1 C ATOM 2657 O LEU A 186 -21.152 2.242 -25.547 1.00 16.12 O ANISOU 2657 O LEU A 186 2594 1846 1686 -137 27 -106 O ATOM 2658 CB LEU A 186 -24.238 1.273 -26.281 1.00 17.55 C ANISOU 2658 CB LEU A 186 2672 1772 2226 -346 -602 267 C ATOM 2659 CG LEU A 186 -25.257 0.173 -25.926 1.00 17.83 C ANISOU 2659 CG LEU A 186 2500 1651 2622 -526 -987 597 C ATOM 2660 CD1 LEU A 186 -26.173 -0.078 -27.103 1.00 21.22 C ANISOU 2660 CD1 LEU A 186 3064 1778 3221 -587 -1480 650 C ATOM 2661 CD2 LEU A 186 -24.518 -1.092 -25.486 1.00 19.41 C ANISOU 2661 CD2 LEU A 186 2770 1723 2881 -557 -1172 542 C ATOM 0 H LEU A 186 -25.169 2.710 -24.505 1.00 15.55 H new ATOM 0 HA LEU A 186 -23.114 1.073 -24.583 1.00 15.28 H new ATOM 0 HB2 LEU A 186 -24.705 2.004 -26.716 1.00 17.55 H new ATOM 0 HB3 LEU A 186 -23.605 0.918 -26.925 1.00 17.55 H new ATOM 0 HG LEU A 186 -25.812 0.460 -25.184 1.00 17.83 H new ATOM 0 HD11 LEU A 186 -26.812 -0.771 -26.874 1.00 21.22 H new ATOM 0 HD12 LEU A 186 -26.648 0.739 -27.324 1.00 21.22 H new ATOM 0 HD13 LEU A 186 -25.648 -0.363 -27.867 1.00 21.22 H new ATOM 0 HD21 LEU A 186 -25.162 -1.782 -25.263 1.00 19.41 H new ATOM 0 HD22 LEU A 186 -23.949 -1.402 -26.208 1.00 19.41 H new ATOM 0 HD23 LEU A 186 -23.974 -0.895 -24.708 1.00 19.41 H new ATOM 2673 N GLY A 187 -22.579 3.929 -25.905 1.00 14.85 N ANISOU 2673 N GLY A 187 2332 1716 1596 -158 80 12 N ATOM 2674 CA GLY A 187 -21.509 4.808 -26.336 1.00 15.67 C ANISOU 2674 CA GLY A 187 2468 1820 1667 -108 218 -35 C ATOM 2675 C GLY A 187 -20.559 5.149 -25.198 1.00 15.18 C ANISOU 2675 C GLY A 187 2321 1750 1695 -121 269 -91 C ATOM 2676 O GLY A 187 -19.342 5.088 -25.363 1.00 15.61 O ANISOU 2676 O GLY A 187 2342 1796 1792 -122 322 -54 O ATOM 0 H GLY A 187 -23.365 4.278 -25.907 1.00 14.85 H new ATOM 0 HA2 GLY A 187 -21.013 4.385 -27.054 1.00 15.67 H new ATOM 0 HA3 GLY A 187 -21.888 5.625 -26.696 1.00 15.67 H new ATOM 2680 N ALA A 188 -21.098 5.504 -24.037 1.00 14.16 N ANISOU 2680 N ALA A 188 2161 1640 1577 -64 230 -148 N ATOM 2681 CA ALA A 188 -20.278 5.857 -22.890 1.00 15.40 C ANISOU 2681 CA ALA A 188 2336 1739 1776 11 156 -268 C ATOM 2682 C ALA A 188 -19.438 4.668 -22.416 1.00 16.25 C ANISOU 2682 C ALA A 188 2421 1898 1857 -33 192 -291 C ATOM 2683 O ALA A 188 -18.261 4.835 -22.042 1.00 15.53 O ANISOU 2683 O ALA A 188 2316 1705 1880 -62 117 -338 O ATOM 2684 CB ALA A 188 -21.155 6.370 -21.759 1.00 15.69 C ANISOU 2684 CB ALA A 188 2434 1858 1671 279 111 -341 C ATOM 0 H ALA A 188 -21.945 5.546 -23.894 1.00 14.16 H new ATOM 0 HA ALA A 188 -19.668 6.560 -23.162 1.00 15.40 H new ATOM 0 HB1 ALA A 188 -20.600 6.603 -20.999 1.00 15.69 H new ATOM 0 HB2 ALA A 188 -21.641 7.155 -22.057 1.00 15.69 H new ATOM 0 HB3 ALA A 188 -21.785 5.680 -21.499 1.00 15.69 H new ATOM 2690 N ALA A 189 -20.038 3.474 -22.361 1.00 16.13 N ANISOU 2690 N ALA A 189 2375 1999 1756 -52 241 -219 N ATOM 2691 CA ALA A 189 -19.256 2.291 -21.954 1.00 15.68 C ANISOU 2691 CA ALA A 189 2313 1958 1688 -91 238 -241 C ATOM 2692 C ALA A 189 -18.139 2.002 -22.944 1.00 16.47 C ANISOU 2692 C ALA A 189 2466 1994 1797 -127 265 -263 C ATOM 2693 O ALA A 189 -17.028 1.604 -22.555 1.00 15.92 O ANISOU 2693 O ALA A 189 2370 1926 1751 -119 288 -289 O ATOM 2694 CB ALA A 189 -20.193 1.098 -21.822 1.00 15.52 C ANISOU 2694 CB ALA A 189 2222 1990 1685 -135 171 -80 C ATOM 0 H ALA A 189 -20.865 3.326 -22.547 1.00 16.13 H new ATOM 0 HA ALA A 189 -18.837 2.466 -21.097 1.00 15.68 H new ATOM 0 HB1 ALA A 189 -19.686 0.316 -21.554 1.00 15.52 H new ATOM 0 HB2 ALA A 189 -20.868 1.289 -21.153 1.00 15.52 H new ATOM 0 HB3 ALA A 189 -20.623 0.928 -22.675 1.00 15.52 H new ATOM 2700 N THR A 190 -18.378 2.200 -24.243 1.00 16.01 N ANISOU 2700 N THR A 190 2478 1924 1683 -92 282 -210 N ATOM 2701 CA THR A 190 -17.325 1.951 -25.230 1.00 14.47 C ANISOU 2701 CA THR A 190 2329 1786 1384 53 383 -144 C ATOM 2702 C THR A 190 -16.172 2.935 -25.015 1.00 16.50 C ANISOU 2702 C THR A 190 2365 2064 1842 10 497 32 C ATOM 2703 O THR A 190 -15.011 2.538 -24.949 1.00 18.20 O ANISOU 2703 O THR A 190 2480 2349 2084 76 583 146 O ATOM 2704 CB THR A 190 -17.921 2.089 -26.627 1.00 16.80 C ANISOU 2704 CB THR A 190 2776 2103 1503 211 370 -106 C ATOM 2705 OG1 THR A 190 -18.953 1.075 -26.784 1.00 18.93 O ANISOU 2705 OG1 THR A 190 3248 2239 1705 213 90 -244 O ATOM 2706 CG2 THR A 190 -16.876 1.907 -27.679 1.00 15.71 C ANISOU 2706 CG2 THR A 190 2694 2138 1137 542 544 35 C ATOM 0 H THR A 190 -19.126 2.472 -24.568 1.00 16.01 H new ATOM 0 HA THR A 190 -16.971 1.054 -25.129 1.00 14.47 H new ATOM 0 HB THR A 190 -18.294 2.979 -26.729 1.00 16.80 H new ATOM 0 HG1 THR A 190 -19.670 1.350 -26.444 1.00 18.93 H new ATOM 0 HG21 THR A 190 -17.280 1.999 -28.556 1.00 15.71 H new ATOM 0 HG22 THR A 190 -16.185 2.579 -27.569 1.00 15.71 H new ATOM 0 HG23 THR A 190 -16.483 1.024 -27.596 1.00 15.71 H new ATOM 2714 N ARG A 191 -16.484 4.230 -24.855 1.00 14.67 N ANISOU 2714 N ARG A 191 2034 1726 1813 -106 429 91 N ATOM 2715 CA ARG A 191 -15.448 5.206 -24.559 1.00 16.19 C ANISOU 2715 CA ARG A 191 2001 1797 2354 -208 342 300 C ATOM 2716 C ARG A 191 -14.772 4.946 -23.216 1.00 16.36 C ANISOU 2716 C ARG A 191 2009 1693 2514 -276 158 160 C ATOM 2717 O ARG A 191 -13.571 5.260 -23.063 1.00 19.95 O ANISOU 2717 O ARG A 191 2239 2051 3288 -360 57 398 O ATOM 2718 CB ARG A 191 -16.018 6.631 -24.597 1.00 19.32 C ANISOU 2718 CB ARG A 191 2372 1997 2972 -297 154 334 C ATOM 2719 CG ARG A 191 -16.489 7.056 -25.979 1.00 21.66 C ANISOU 2719 CG ARG A 191 2628 2413 3190 -238 329 554 C ATOM 2720 CD ARG A 191 -16.833 8.559 -26.076 1.00 22.51 C ANISOU 2720 CD ARG A 191 2657 2286 3608 -349 110 666 C ATOM 2721 NE ARG A 191 -17.325 8.800 -27.423 1.00 22.17 N ANISOU 2721 NE ARG A 191 2588 2415 3422 -259 326 880 N ATOM 2722 CZ ARG A 191 -18.617 8.735 -27.769 1.00 19.87 C ANISOU 2722 CZ ARG A 191 2512 2173 2863 -190 360 660 C ATOM 2723 NH1 ARG A 191 -19.553 8.530 -26.850 1.00 16.86 N ANISOU 2723 NH1 ARG A 191 2309 1720 2377 -199 235 320 N ATOM 2724 NH2 ARG A 191 -18.962 8.892 -29.039 1.00 20.82 N ANISOU 2724 NH2 ARG A 191 2640 2445 2826 -67 520 848 N ATOM 0 H ARG A 191 -17.280 4.551 -24.914 1.00 14.67 H new ATOM 0 HA ARG A 191 -14.771 5.115 -25.248 1.00 16.19 H new ATOM 0 HB2 ARG A 191 -16.761 6.692 -23.977 1.00 19.32 H new ATOM 0 HB3 ARG A 191 -15.340 7.252 -24.289 1.00 19.32 H new ATOM 0 HG2 ARG A 191 -15.798 6.847 -26.627 1.00 21.66 H new ATOM 0 HG3 ARG A 191 -17.271 6.536 -26.221 1.00 21.66 H new ATOM 0 HD2 ARG A 191 -17.504 8.800 -25.418 1.00 22.51 H new ATOM 0 HD3 ARG A 191 -16.050 9.102 -25.895 1.00 22.51 H new ATOM 0 HE ARG A 191 -16.752 8.996 -28.034 1.00 22.17 H new ATOM 0 HH11 ARG A 191 -19.332 8.438 -26.024 1.00 16.86 H new ATOM 0 HH12 ARG A 191 -20.381 8.490 -27.081 1.00 16.86 H new ATOM 0 HH21 ARG A 191 -18.358 9.034 -29.634 1.00 20.82 H new ATOM 0 HH22 ARG A 191 -19.790 8.851 -29.268 1.00 20.82 H new ATOM 2738 N GLY A 192 -15.518 4.429 -22.242 1.00 15.93 N ANISOU 2738 N GLY A 192 2147 1646 2258 -221 95 -143 N ATOM 2739 CA GLY A 192 -14.940 4.109 -20.947 1.00 15.99 C ANISOU 2739 CA GLY A 192 2191 1581 2302 -198 -66 -290 C ATOM 2740 C GLY A 192 -13.766 3.158 -21.023 1.00 16.58 C ANISOU 2740 C GLY A 192 2141 1736 2424 -238 41 -170 C ATOM 2741 O GLY A 192 -12.915 3.163 -20.144 1.00 16.07 O ANISOU 2741 O GLY A 192 2031 1552 2522 -268 -145 -199 O ATOM 0 H GLY A 192 -16.358 4.258 -22.314 1.00 15.93 H new ATOM 0 HA2 GLY A 192 -14.653 4.930 -20.518 1.00 15.99 H new ATOM 0 HA3 GLY A 192 -15.626 3.719 -20.383 1.00 15.99 H new ATOM 2745 N LEU A 193 -13.710 2.334 -22.081 1.00 16.99 N ANISOU 2745 N LEU A 193 2176 1975 2304 -174 294 -49 N ATOM 2746 CA LEU A 193 -12.596 1.400 -22.241 1.00 18.33 C ANISOU 2746 CA LEU A 193 2261 2262 2442 -93 419 71 C ATOM 2747 C LEU A 193 -11.274 2.103 -22.390 1.00 18.51 C ANISOU 2747 C LEU A 193 1955 2259 2818 -148 411 446 C ATOM 2748 O LEU A 193 -10.206 1.487 -22.204 1.00 19.48 O ANISOU 2748 O LEU A 193 1932 2467 3002 -94 479 599 O ATOM 2749 CB LEU A 193 -12.845 0.501 -23.450 1.00 21.12 C ANISOU 2749 CB LEU A 193 2767 2795 2463 147 606 88 C ATOM 2750 CG LEU A 193 -14.070 -0.389 -23.367 1.00 22.48 C ANISOU 2750 CG LEU A 193 3212 2902 2429 154 472 -186 C ATOM 2751 CD1 LEU A 193 -14.332 -1.061 -24.737 1.00 26.73 C ANISOU 2751 CD1 LEU A 193 3995 3496 2666 450 471 -212 C ATOM 2752 CD2 LEU A 193 -13.945 -1.462 -22.274 1.00 20.98 C ANISOU 2752 CD2 LEU A 193 3063 2661 2248 90 361 -325 C ATOM 0 H LEU A 193 -14.300 2.304 -22.706 1.00 16.99 H new ATOM 0 HA LEU A 193 -12.548 0.865 -21.433 1.00 18.33 H new ATOM 0 HB2 LEU A 193 -12.925 1.061 -24.238 1.00 21.12 H new ATOM 0 HB3 LEU A 193 -12.065 -0.061 -23.580 1.00 21.12 H new ATOM 0 HG LEU A 193 -14.820 0.179 -23.129 1.00 22.48 H new ATOM 0 HD11 LEU A 193 -15.117 -1.628 -24.675 1.00 26.73 H new ATOM 0 HD12 LEU A 193 -14.480 -0.378 -25.410 1.00 26.73 H new ATOM 0 HD13 LEU A 193 -13.564 -1.599 -24.986 1.00 26.73 H new ATOM 0 HD21 LEU A 193 -14.749 -2.004 -22.259 1.00 20.98 H new ATOM 0 HD22 LEU A 193 -13.178 -2.026 -22.460 1.00 20.98 H new ATOM 0 HD23 LEU A 193 -13.829 -1.034 -21.412 1.00 20.98 H new ATOM 2764 N LEU A 194 -11.276 3.398 -22.754 1.00 19.64 N ANISOU 2764 N LEU A 194 1919 2274 3270 -265 300 688 N ATOM 2765 CA LEU A 194 -10.043 4.142 -22.889 1.00 23.81 C ANISOU 2765 CA LEU A 194 2021 2717 4309 -384 193 1207 C ATOM 2766 C LEU A 194 -9.550 4.715 -21.559 1.00 25.03 C ANISOU 2766 C LEU A 194 2146 2458 4906 -615 -341 1089 C ATOM 2767 O LEU A 194 -8.557 5.425 -21.533 1.00 30.91 O ANISOU 2767 O LEU A 194 2613 3065 6068 -673 -603 1451 O ATOM 2768 CB LEU A 194 -10.196 5.274 -23.906 1.00 27.67 C ANISOU 2768 CB LEU A 194 2289 3206 5019 -411 220 1610 C ATOM 2769 CG LEU A 194 -10.699 4.807 -25.287 1.00 31.53 C ANISOU 2769 CG LEU A 194 2875 4094 5012 -84 683 1704 C ATOM 2770 CD1 LEU A 194 -10.880 6.007 -26.254 1.00 35.20 C ANISOU 2770 CD1 LEU A 194 3169 4564 5642 -53 642 2018 C ATOM 2771 CD2 LEU A 194 -9.728 3.799 -25.885 1.00 36.79 C ANISOU 2771 CD2 LEU A 194 3480 5110 5390 292 960 1902 C ATOM 0 H LEU A 194 -11.987 3.850 -22.924 1.00 19.64 H new ATOM 0 HA LEU A 194 -9.378 3.509 -23.203 1.00 23.81 H new ATOM 0 HB2 LEU A 194 -10.813 5.934 -23.553 1.00 27.67 H new ATOM 0 HB3 LEU A 194 -9.340 5.717 -24.016 1.00 27.67 H new ATOM 0 HG LEU A 194 -11.564 4.385 -25.164 1.00 31.53 H new ATOM 0 HD11 LEU A 194 -11.196 5.686 -27.113 1.00 35.20 H new ATOM 0 HD12 LEU A 194 -11.527 6.627 -25.883 1.00 35.20 H new ATOM 0 HD13 LEU A 194 -10.030 6.459 -26.371 1.00 35.20 H new ATOM 0 HD21 LEU A 194 -10.053 3.512 -26.753 1.00 36.79 H new ATOM 0 HD22 LEU A 194 -8.856 4.211 -25.987 1.00 36.79 H new ATOM 0 HD23 LEU A 194 -9.656 3.031 -25.297 1.00 36.79 H new ATOM 2783 N HIS A 195 -10.216 4.350 -20.456 1.00 23.69 N ANISOU 2783 N HIS A 195 2362 2180 4460 -561 -515 531 N ATOM 2784 CA HIS A 195 -9.867 4.838 -19.135 1.00 27.94 C ANISOU 2784 CA HIS A 195 3028 2348 5241 -608 -1064 303 C ATOM 2785 C HIS A 195 -9.498 3.672 -18.224 1.00 33.87 C ANISOU 2785 C HIS A 195 3900 3218 5750 -515 -997 73 C ATOM 2786 O HIS A 195 -10.144 3.462 -17.198 1.00 36.73 O ANISOU 2786 O HIS A 195 4602 3562 5792 -333 -1124 -342 O ATOM 2787 CB HIS A 195 -11.036 5.620 -18.528 1.00 27.62 C ANISOU 2787 CB HIS A 195 3371 2183 4939 -419 -1300 -107 C ATOM 2788 CG HIS A 195 -11.377 6.863 -19.258 1.00 32.55 C ANISOU 2788 CG HIS A 195 3913 2678 5777 -470 -1436 74 C ATOM 2789 ND1 HIS A 195 -10.759 8.072 -18.989 1.00 39.86 N ANISOU 2789 ND1 HIS A 195 4746 3321 7079 -466 -1948 238 N ATOM 2790 CD2 HIS A 195 -12.246 7.100 -20.259 1.00 32.03 C ANISOU 2790 CD2 HIS A 195 3832 2701 5636 -518 -1180 145 C ATOM 2791 CE1 HIS A 195 -11.259 8.998 -19.788 1.00 41.28 C ANISOU 2791 CE1 HIS A 195 4848 3445 7391 -516 -1983 388 C ATOM 2792 NE2 HIS A 195 -12.164 8.436 -20.567 1.00 37.29 N ANISOU 2792 NE2 HIS A 195 4396 3177 6597 -545 -1492 331 N ATOM 0 H HIS A 195 -10.885 3.809 -20.463 1.00 23.69 H new ATOM 0 HA HIS A 195 -9.103 5.430 -19.218 1.00 27.94 H new ATOM 0 HB2 HIS A 195 -11.818 5.046 -18.503 1.00 27.62 H new ATOM 0 HB3 HIS A 195 -10.820 5.845 -17.610 1.00 27.62 H new ATOM 0 HD2 HIS A 195 -12.800 6.474 -20.667 1.00 32.03 H new ATOM 0 HE1 HIS A 195 -11.014 9.895 -19.799 1.00 41.28 H new ATOM 0 HE2 HIS A 195 -12.627 8.840 -21.169 1.00 37.29 H new ATOM 2800 N GLY A 196 -8.479 2.905 -18.599 1.00 34.48 N ANISOU 2800 N GLY A 196 3691 3472 5938 -568 -765 390 N ATOM 2801 CA GLY A 196 -7.871 1.931 -17.711 1.00 31.76 C ANISOU 2801 CA GLY A 196 3402 3173 5493 -518 -790 244 C ATOM 2802 C GLY A 196 -8.015 0.478 -18.129 1.00 26.05 C ANISOU 2802 C GLY A 196 2739 2825 4333 -368 -302 193 C ATOM 2803 O GLY A 196 -7.280 -0.382 -17.601 1.00 28.21 O ANISOU 2803 O GLY A 196 2974 3155 4588 -336 -284 185 O ATOM 0 H GLY A 196 -8.122 2.938 -19.381 1.00 34.48 H new ATOM 0 HA2 GLY A 196 -6.926 2.135 -17.632 1.00 31.76 H new ATOM 0 HA3 GLY A 196 -8.259 2.036 -16.828 1.00 31.76 H new ATOM 2807 N SER A 197 -8.898 0.138 -19.058 1.00 23.15 N ANISOU 2807 N SER A 197 2489 2664 3642 -260 13 150 N ATOM 2808 CA SER A 197 -9.149 -1.240 -19.382 1.00 23.60 C ANISOU 2808 CA SER A 197 2704 2936 3328 -95 267 30 C ATOM 2809 C SER A 197 -7.982 -1.904 -20.103 1.00 24.34 C ANISOU 2809 C SER A 197 2616 3228 3406 88 495 325 C ATOM 2810 O SER A 197 -8.014 -3.133 -20.300 1.00 24.49 O ANISOU 2810 O SER A 197 2824 3360 3119 290 603 183 O ATOM 2811 CB SER A 197 -10.390 -1.370 -20.267 1.00 27.06 C ANISOU 2811 CB SER A 197 3343 3449 3489 -8 390 -80 C ATOM 2812 OG SER A 197 -10.045 -1.313 -21.634 1.00 31.82 O ANISOU 2812 OG SER A 197 3877 4217 3998 187 608 165 O ATOM 0 H SER A 197 -9.362 0.702 -19.512 1.00 23.15 H new ATOM 0 HA SER A 197 -9.282 -1.690 -18.533 1.00 23.60 H new ATOM 0 HB2 SER A 197 -10.840 -2.209 -20.078 1.00 27.06 H new ATOM 0 HB3 SER A 197 -11.016 -0.659 -20.058 1.00 27.06 H new ATOM 0 HG SER A 197 -10.080 -0.517 -21.899 1.00 31.82 H new ATOM 2818 N ASP A 198 -6.952 -1.159 -20.498 1.00 24.05 N ANISOU 2818 N ASP A 198 2197 3236 3706 67 542 789 N ATOM 2819 CA ASP A 198 -5.885 -1.762 -21.291 1.00 27.83 C ANISOU 2819 CA ASP A 198 2447 4031 4097 381 862 1197 C ATOM 2820 C ASP A 198 -4.829 -2.458 -20.442 1.00 28.37 C ANISOU 2820 C ASP A 198 2375 4090 4314 360 793 1253 C ATOM 2821 O ASP A 198 -4.041 -3.222 -20.991 1.00 31.60 O ANISOU 2821 O ASP A 198 2714 4774 4518 705 1052 1485 O ATOM 2822 CB ASP A 198 -5.229 -0.718 -22.202 1.00 33.41 C ANISOU 2822 CB ASP A 198 2779 4838 5076 428 947 1811 C ATOM 2823 CG ASP A 198 -4.559 0.425 -21.444 1.00 38.35 C ANISOU 2823 CG ASP A 198 3075 5121 6374 41 536 2100 C ATOM 2824 OD1 ASP A 198 -4.787 0.580 -20.228 1.00 35.65 O ANISOU 2824 OD1 ASP A 198 2807 4456 6282 -263 166 1768 O ATOM 2825 OD2 ASP A 198 -3.805 1.177 -22.097 1.00 43.91 O ANISOU 2825 OD2 ASP A 198 3500 5847 7336 110 508 2661 O ATOM 0 H ASP A 198 -6.853 -0.323 -20.323 1.00 24.05 H new ATOM 0 HA ASP A 198 -6.304 -2.447 -21.835 1.00 27.83 H new ATOM 0 HB2 ASP A 198 -4.568 -1.157 -22.759 1.00 33.41 H new ATOM 0 HB3 ASP A 198 -5.902 -0.351 -22.796 1.00 33.41 H new ATOM 2830 N ARG A 199 -4.816 -2.249 -19.128 1.00 28.53 N ANISOU 2830 N ARG A 199 2438 3800 4602 41 418 1005 N ATOM 2831 CA ARG A 199 -3.738 -2.770 -18.301 1.00 32.49 C ANISOU 2831 CA ARG A 199 2773 4262 5310 -3 297 1100 C ATOM 2832 C ARG A 199 -3.989 -4.245 -17.996 1.00 22.64 C ANISOU 2832 C ARG A 199 1869 3131 3601 197 430 713 C ATOM 2833 O ARG A 199 -5.136 -4.683 -17.963 1.00 22.98 O ANISOU 2833 O ARG A 199 2278 3139 3315 223 424 321 O ATOM 2834 CB ARG A 199 -3.621 -2.015 -16.977 1.00 48.77 C ANISOU 2834 CB ARG A 199 4843 5918 7770 -320 -248 931 C ATOM 2835 CG ARG A 199 -2.914 -0.680 -17.067 1.00 69.94 C ANISOU 2835 CG ARG A 199 7181 8329 11061 -528 -594 1382 C ATOM 2836 CD ARG A 199 -1.455 -0.841 -17.461 1.00 86.21 C ANISOU 2836 CD ARG A 199 8904 10502 13349 -443 -464 1988 C ATOM 2837 NE ARG A 199 -0.580 -1.184 -16.342 1.00 93.31 N ANISOU 2837 NE ARG A 199 9802 11185 14468 -538 -784 1938 N ATOM 2838 CZ ARG A 199 -0.092 -2.390 -16.074 1.00 93.89 C ANISOU 2838 CZ ARG A 199 9836 11490 14346 -418 -560 1885 C ATOM 2839 NH1 ARG A 199 -0.409 -3.428 -16.839 1.00 90.44 N ANISOU 2839 NH1 ARG A 199 9417 11495 13451 -127 -30 1839 N ATOM 2840 NH2 ARG A 199 0.709 -2.560 -15.035 1.00 96.76 N ANISOU 2840 NH2 ARG A 199 10206 11614 14944 -523 -900 1854 N ATOM 0 H ARG A 199 -5.419 -1.810 -18.700 1.00 28.53 H new ATOM 0 HA ARG A 199 -2.912 -2.656 -18.797 1.00 32.49 H new ATOM 0 HB2 ARG A 199 -4.512 -1.871 -16.621 1.00 48.77 H new ATOM 0 HB3 ARG A 199 -3.149 -2.575 -16.341 1.00 48.77 H new ATOM 0 HG2 ARG A 199 -3.365 -0.118 -17.717 1.00 69.94 H new ATOM 0 HG3 ARG A 199 -2.970 -0.226 -16.212 1.00 69.94 H new ATOM 0 HD2 ARG A 199 -1.385 -1.531 -18.139 1.00 86.21 H new ATOM 0 HD3 ARG A 199 -1.144 -0.015 -17.864 1.00 86.21 H new ATOM 0 HE ARG A 199 -0.361 -0.547 -15.808 1.00 93.31 H new ATOM 0 HH11 ARG A 199 -0.933 -3.322 -17.513 1.00 90.44 H new ATOM 0 HH12 ARG A 199 -0.090 -4.207 -16.661 1.00 90.44 H new ATOM 0 HH21 ARG A 199 0.913 -1.891 -14.535 1.00 96.76 H new ATOM 0 HH22 ARG A 199 1.026 -3.340 -14.860 1.00 96.76 H new ATOM 2854 N ARG A 200 -2.904 -4.968 -17.771 1.00 23.08 N ANISOU 2854 N ARG A 200 1755 3300 3714 318 502 898 N ATOM 2855 CA ARG A 200 -3.030 -6.351 -17.302 1.00 22.78 C ANISOU 2855 CA ARG A 200 2025 3289 3341 462 519 546 C ATOM 2856 C ARG A 200 -3.596 -6.373 -15.879 1.00 23.43 C ANISOU 2856 C ARG A 200 2303 3118 3479 188 192 172 C ATOM 2857 O ARG A 200 -3.525 -5.409 -15.135 1.00 23.83 O ANISOU 2857 O ARG A 200 2268 2973 3813 -25 -88 167 O ATOM 2858 CB ARG A 200 -1.693 -7.067 -17.356 1.00 23.83 C ANISOU 2858 CB ARG A 200 1922 3612 3521 692 671 848 C ATOM 2859 CG ARG A 200 -0.808 -6.779 -16.170 1.00 30.87 C ANISOU 2859 CG ARG A 200 2543 4324 4864 403 388 975 C ATOM 2860 CD ARG A 200 0.656 -7.063 -16.502 1.00 45.39 C ANISOU 2860 CD ARG A 200 3930 6402 6912 611 584 1539 C ATOM 2861 NE ARG A 200 1.501 -6.955 -15.324 1.00 59.70 N ANISOU 2861 NE ARG A 200 5546 7982 9157 325 225 1614 N ATOM 2862 CZ ARG A 200 2.830 -7.077 -15.347 1.00 75.39 C ANISOU 2862 CZ ARG A 200 7303 10020 11324 354 267 2052 C ATOM 2863 NH1 ARG A 200 3.456 -7.305 -16.492 1.00 83.47 N ANISOU 2863 NH1 ARG A 200 8236 11364 12115 685 668 2494 N ATOM 2864 NH2 ARG A 200 3.525 -6.968 -14.224 1.00 79.12 N ANISOU 2864 NH2 ARG A 200 7678 10212 12170 91 -122 2059 N ATOM 0 H ARG A 200 -2.097 -4.690 -17.879 1.00 23.08 H new ATOM 0 HA ARG A 200 -3.643 -6.820 -17.890 1.00 22.78 H new ATOM 0 HB2 ARG A 200 -1.848 -8.023 -17.410 1.00 23.83 H new ATOM 0 HB3 ARG A 200 -1.228 -6.809 -18.167 1.00 23.83 H new ATOM 0 HG2 ARG A 200 -0.909 -5.852 -15.903 1.00 30.87 H new ATOM 0 HG3 ARG A 200 -1.084 -7.323 -15.416 1.00 30.87 H new ATOM 0 HD2 ARG A 200 0.737 -7.953 -16.879 1.00 45.39 H new ATOM 0 HD3 ARG A 200 0.962 -6.440 -17.179 1.00 45.39 H new ATOM 0 HE ARG A 200 1.122 -6.803 -14.567 1.00 59.70 H new ATOM 0 HH11 ARG A 200 3.006 -7.375 -17.222 1.00 83.47 H new ATOM 0 HH12 ARG A 200 4.312 -7.383 -16.506 1.00 83.47 H new ATOM 0 HH21 ARG A 200 3.120 -6.819 -13.480 1.00 79.12 H new ATOM 0 HH22 ARG A 200 4.381 -7.047 -14.239 1.00 79.12 H new ATOM 2878 N THR A 201 -4.152 -7.515 -15.499 1.00 20.44 N ANISOU 2878 N THR A 201 2206 2743 2818 263 187 -111 N ATOM 2879 CA THR A 201 -4.599 -7.723 -14.133 1.00 18.75 C ANISOU 2879 CA THR A 201 2124 2414 2588 130 -29 -336 C ATOM 2880 C THR A 201 -3.583 -8.587 -13.385 1.00 18.89 C ANISOU 2880 C THR A 201 2077 2440 2662 170 -89 -312 C ATOM 2881 O THR A 201 -2.857 -9.369 -13.983 1.00 20.36 O ANISOU 2881 O THR A 201 2206 2725 2804 336 58 -195 O ATOM 2882 CB THR A 201 -5.977 -8.374 -14.053 1.00 19.63 C ANISOU 2882 CB THR A 201 2470 2527 2460 138 -26 -502 C ATOM 2883 OG1 THR A 201 -5.926 -9.724 -14.476 1.00 20.71 O ANISOU 2883 OG1 THR A 201 2725 2659 2483 258 -12 -522 O ATOM 2884 CG2 THR A 201 -6.987 -7.641 -14.930 1.00 21.40 C ANISOU 2884 CG2 THR A 201 2754 2748 2628 114 37 -507 C ATOM 0 H THR A 201 -4.280 -8.186 -16.022 1.00 20.44 H new ATOM 0 HA THR A 201 -4.670 -6.848 -13.721 1.00 18.75 H new ATOM 0 HB THR A 201 -6.254 -8.327 -13.125 1.00 19.63 H new ATOM 0 HG1 THR A 201 -6.097 -10.228 -13.826 1.00 20.71 H new ATOM 0 HG21 THR A 201 -7.852 -8.075 -14.860 1.00 21.40 H new ATOM 0 HG22 THR A 201 -7.063 -6.720 -14.636 1.00 21.40 H new ATOM 0 HG23 THR A 201 -6.689 -7.661 -15.853 1.00 21.40 H new ATOM 2892 N GLU A 202 -3.544 -8.412 -12.067 1.00 21.50 N ANISOU 2892 N GLU A 202 2450 2682 3036 98 -317 -431 N ATOM 2893 CA GLU A 202 -2.604 -9.129 -11.216 1.00 24.48 C ANISOU 2893 CA GLU A 202 2775 3048 3477 125 -423 -420 C ATOM 2894 C GLU A 202 -3.321 -10.167 -10.361 1.00 23.98 C ANISOU 2894 C GLU A 202 2903 3048 3159 193 -423 -553 C ATOM 2895 O GLU A 202 -4.548 -10.154 -10.194 1.00 22.94 O ANISOU 2895 O GLU A 202 2893 2972 2849 213 -384 -597 O ATOM 2896 CB GLU A 202 -1.844 -8.150 -10.317 1.00 26.71 C ANISOU 2896 CB GLU A 202 2971 3145 4034 49 -790 -418 C ATOM 2897 CG GLU A 202 -1.149 -7.010 -11.053 1.00 29.02 C ANISOU 2897 CG GLU A 202 2972 3302 4753 -92 -911 -141 C ATOM 2898 CD GLU A 202 0.023 -7.477 -11.904 1.00 33.77 C ANISOU 2898 CD GLU A 202 3194 4054 5584 -69 -670 280 C ATOM 2899 OE1 GLU A 202 0.533 -8.586 -11.646 1.00 35.12 O ANISOU 2899 OE1 GLU A 202 3371 4344 5628 49 -547 272 O ATOM 2900 OE2 GLU A 202 0.412 -6.748 -12.836 1.00 37.79 O ANISOU 2900 OE2 GLU A 202 3384 4600 6375 -111 -580 667 O ATOM 0 H GLU A 202 -4.063 -7.873 -11.642 1.00 21.50 H new ATOM 0 HA GLU A 202 -1.972 -9.588 -11.791 1.00 24.48 H new ATOM 0 HB2 GLU A 202 -2.465 -7.772 -9.675 1.00 26.71 H new ATOM 0 HB3 GLU A 202 -1.180 -8.644 -9.812 1.00 26.71 H new ATOM 0 HG2 GLU A 202 -1.793 -6.557 -11.620 1.00 29.02 H new ATOM 0 HG3 GLU A 202 -0.833 -6.359 -10.406 1.00 29.02 H new ATOM 2907 N ARG A 203 -2.546 -11.104 -9.827 1.00 23.74 N ANISOU 2907 N ARG A 203 2840 3030 3150 235 -459 -527 N ATOM 2908 CA ARG A 203 -3.062 -12.060 -8.857 1.00 23.17 C ANISOU 2908 CA ARG A 203 2874 3020 2910 293 -494 -546 C ATOM 2909 C ARG A 203 -3.228 -11.369 -7.513 1.00 23.28 C ANISOU 2909 C ARG A 203 2974 3079 2792 411 -667 -630 C ATOM 2910 O ARG A 203 -2.328 -10.665 -7.033 1.00 23.24 O ANISOU 2910 O ARG A 203 2968 2953 2910 433 -912 -723 O ATOM 2911 CB ARG A 203 -2.115 -13.248 -8.733 1.00 21.76 C ANISOU 2911 CB ARG A 203 2648 2822 2799 328 -506 -497 C ATOM 2912 CG ARG A 203 -2.378 -14.147 -7.522 1.00 21.09 C ANISOU 2912 CG ARG A 203 2608 2795 2609 377 -585 -445 C ATOM 2913 CD ARG A 203 -1.558 -15.428 -7.598 1.00 22.26 C ANISOU 2913 CD ARG A 203 2737 2878 2844 405 -617 -402 C ATOM 2914 NE ARG A 203 -2.070 -16.405 -8.552 1.00 23.27 N ANISOU 2914 NE ARG A 203 2966 2879 2997 415 -641 -377 N ATOM 2915 CZ ARG A 203 -3.047 -17.262 -8.300 1.00 23.80 C ANISOU 2915 CZ ARG A 203 3066 2861 3116 344 -779 -228 C ATOM 2916 NH1 ARG A 203 -3.602 -17.304 -7.092 1.00 24.80 N ANISOU 2916 NH1 ARG A 203 3072 3137 3212 309 -768 -12 N ATOM 2917 NH2 ARG A 203 -3.448 -18.102 -9.228 1.00 24.65 N ANISOU 2917 NH2 ARG A 203 3322 2727 3318 360 -978 -243 N ATOM 0 H ARG A 203 -1.713 -11.203 -10.015 1.00 23.74 H new ATOM 0 HA ARG A 203 -3.924 -12.390 -9.155 1.00 23.17 H new ATOM 0 HB2 ARG A 203 -2.179 -13.784 -9.539 1.00 21.76 H new ATOM 0 HB3 ARG A 203 -1.204 -12.917 -8.684 1.00 21.76 H new ATOM 0 HG2 ARG A 203 -2.160 -13.668 -6.707 1.00 21.09 H new ATOM 0 HG3 ARG A 203 -3.322 -14.366 -7.478 1.00 21.09 H new ATOM 0 HD2 ARG A 203 -0.645 -15.203 -7.838 1.00 22.26 H new ATOM 0 HD3 ARG A 203 -1.528 -15.834 -6.718 1.00 22.26 H new ATOM 0 HE ARG A 203 -1.712 -16.426 -9.334 1.00 23.27 H new ATOM 0 HH11 ARG A 203 -3.326 -16.774 -6.473 1.00 24.80 H new ATOM 0 HH12 ARG A 203 -4.237 -17.861 -6.930 1.00 24.80 H new ATOM 0 HH21 ARG A 203 -3.075 -18.097 -10.003 1.00 24.65 H new ATOM 0 HH22 ARG A 203 -4.083 -18.657 -9.060 1.00 24.65 H new ATOM 2931 N GLY A 204 -4.391 -11.559 -6.891 1.00 22.17 N ANISOU 2931 N GLY A 204 2911 3112 2402 551 -588 -554 N ATOM 2932 CA GLY A 204 -4.674 -10.930 -5.607 1.00 23.52 C ANISOU 2932 CA GLY A 204 3240 3419 2278 875 -714 -627 C ATOM 2933 C GLY A 204 -4.056 -11.582 -4.390 1.00 25.75 C ANISOU 2933 C GLY A 204 3574 3789 2420 1075 -827 -611 C ATOM 2934 O GLY A 204 -3.608 -10.888 -3.467 1.00 32.26 O ANISOU 2934 O GLY A 204 4612 4573 3071 1359 -1114 -820 O ATOM 0 H GLY A 204 -5.028 -12.049 -7.198 1.00 22.17 H new ATOM 0 HA2 GLY A 204 -4.371 -10.009 -5.646 1.00 23.52 H new ATOM 0 HA3 GLY A 204 -5.636 -10.907 -5.485 1.00 23.52 H new ATOM 2938 N HIS A 205 -4.038 -12.900 -4.339 1.00 24.45 N ANISOU 2938 N HIS A 205 3256 3702 2330 968 -682 -377 N ATOM 2939 CA AHIS A 205 -3.354 -13.583 -3.251 0.44 27.90 C ANISOU 2939 CA AHIS A 205 3718 4214 2668 1131 -781 -339 C ATOM 2940 CA BHIS A 205 -3.534 -13.654 -3.179 0.56 27.97 C ANISOU 2940 CA BHIS A 205 3718 4267 2642 1158 -749 -292 C ATOM 2941 C HIS A 205 -3.046 -15.009 -3.682 1.00 25.22 C ANISOU 2941 C HIS A 205 3198 3793 2591 875 -702 -144 C ATOM 2942 O HIS A 205 -3.593 -15.513 -4.672 1.00 24.50 O ANISOU 2942 O HIS A 205 3014 3604 2691 659 -616 -21 O ATOM 2943 CB AHIS A 205 -4.159 -13.545 -1.937 0.44 31.94 C ANISOU 2943 CB AHIS A 205 4320 5099 2717 1618 -702 -149 C ATOM 2944 CB BHIS A 205 -4.646 -13.832 -2.131 0.56 31.29 C ANISOU 2944 CB BHIS A 205 4132 5090 2666 1563 -574 27 C ATOM 2945 CG AHIS A 205 -5.557 -14.073 -2.021 0.44 34.23 C ANISOU 2945 CG AHIS A 205 4378 5680 2947 1656 -387 342 C ATOM 2946 CG BHIS A 205 -4.191 -14.469 -0.852 0.56 36.19 C ANISOU 2946 CG BHIS A 205 4787 5880 3084 1841 -599 137 C ATOM 2947 ND1AHIS A 205 -6.638 -13.271 -2.327 0.44 32.82 N ANISOU 2947 ND1AHIS A 205 4198 5639 2634 1779 -236 416 N ATOM 2948 ND1BHIS A 205 -4.062 -15.832 -0.705 0.56 36.44 N ANISOU 2948 ND1BHIS A 205 4592 5969 3286 1696 -536 488 N ATOM 2949 CD2AHIS A 205 -6.063 -15.300 -1.753 0.44 37.92 C ANISOU 2949 CD2AHIS A 205 4560 6309 3541 1588 -239 864 C ATOM 2950 CD2BHIS A 205 -3.854 -13.928 0.345 0.56 41.20 C ANISOU 2950 CD2BHIS A 205 5654 6545 3454 2219 -664 -82 C ATOM 2951 CE1AHIS A 205 -7.747 -13.988 -2.275 0.44 35.31 C ANISOU 2951 CE1AHIS A 205 4195 6166 3056 1730 23 962 C ATOM 2952 CE1BHIS A 205 -3.649 -16.105 0.518 0.56 37.54 C ANISOU 2952 CE1BHIS A 205 4809 6231 3224 1954 -524 499 C ATOM 2953 NE2AHIS A 205 -7.427 -15.224 -1.939 0.44 35.79 N ANISOU 2953 NE2AHIS A 205 4072 6212 3314 1582 0 1250 N ATOM 2954 NE2BHIS A 205 -3.516 -14.968 1.179 0.56 39.88 N ANISOU 2954 NE2BHIS A 205 5396 6522 3234 2298 -599 139 N ATOM 0 H AHIS A 205 -4.411 -13.417 -4.917 0.44 24.45 H new ATOM 0 H BHIS A 205 -4.319 -13.400 -4.980 0.56 24.45 H new ATOM 0 HA AHIS A 205 -2.524 -13.117 -3.063 0.44 27.97 H new ATOM 0 HA BHIS A 205 -2.807 -13.174 -2.753 0.56 27.97 H new ATOM 0 HB2AHIS A 205 -3.678 -14.054 -1.266 0.44 31.29 H new ATOM 0 HB2BHIS A 205 -5.028 -12.964 -1.930 0.56 31.29 H new ATOM 0 HB3AHIS A 205 -4.195 -12.627 -1.625 0.44 31.29 H new ATOM 0 HB3BHIS A 205 -5.355 -14.372 -2.515 0.56 31.29 H new ATOM 0 HD2AHIS A 205 -5.582 -16.052 -1.493 0.44 41.20 H new ATOM 0 HD2BHIS A 205 -3.852 -13.024 0.561 0.56 41.20 H new ATOM 0 HE1AHIS A 205 -8.606 -13.675 -2.446 0.44 37.54 H new ATOM 0 HE1BHIS A 205 -3.480 -16.954 0.858 0.56 37.54 H new ATOM 0 HE2AHIS A 205 -7.980 -15.877 -1.850 0.44 39.88 H new ATOM 0 HE2BHIS A 205 -3.260 -14.891 1.996 0.56 39.88 H new ATOM 2969 N PRO A 206 -2.084 -15.643 -3.020 1.00 27.08 N ANISOU 2969 N PRO A 206 3432 4001 2855 918 -817 -163 N ATOM 2970 CA PRO A 206 -1.574 -16.930 -3.526 1.00 27.20 C ANISOU 2970 CA PRO A 206 3337 3866 3132 716 -818 -62 C ATOM 2971 C PRO A 206 -2.624 -18.029 -3.634 1.00 32.24 C ANISOU 2971 C PRO A 206 3856 4524 3870 630 -769 302 C ATOM 2972 O PRO A 206 -2.527 -18.871 -4.543 1.00 32.34 O ANISOU 2972 O PRO A 206 3872 4284 4132 461 -875 302 O ATOM 2973 CB PRO A 206 -0.483 -17.287 -2.508 1.00 27.92 C ANISOU 2973 CB PRO A 206 3447 3977 3182 840 -958 -112 C ATOM 2974 CG PRO A 206 -0.042 -16.006 -1.973 1.00 28.74 C ANISOU 2974 CG PRO A 206 3688 4078 3152 1000 -1137 -357 C ATOM 2975 CD PRO A 206 -1.218 -15.086 -1.949 1.00 29.43 C ANISOU 2975 CD PRO A 206 3883 4307 2992 1159 -1055 -366 C ATOM 0 HA PRO A 206 -1.258 -16.851 -4.440 1.00 27.20 H new ATOM 0 HB2 PRO A 206 -0.829 -17.861 -1.807 1.00 27.92 H new ATOM 0 HB3 PRO A 206 0.249 -17.764 -2.929 1.00 27.92 H new ATOM 0 HG2 PRO A 206 0.319 -16.118 -1.080 1.00 28.74 H new ATOM 0 HG3 PRO A 206 0.667 -15.636 -2.521 1.00 28.74 H new ATOM 0 HD2 PRO A 206 -1.662 -15.090 -1.087 1.00 29.43 H new ATOM 0 HD3 PRO A 206 -0.962 -14.168 -2.132 1.00 29.43 H new ATOM 2983 N ASP A 207 -3.595 -18.085 -2.728 1.00 41.31 N ANISOU 2983 N ASP A 207 4891 5951 4852 793 -666 664 N ATOM 2984 CA ASP A 207 -4.580 -19.160 -2.727 1.00 49.92 C ANISOU 2984 CA ASP A 207 5738 7040 6191 663 -691 1201 C ATOM 2985 C ASP A 207 -5.708 -18.951 -3.740 1.00 34.81 C ANISOU 2985 C ASP A 207 3743 5001 4482 467 -711 1343 C ATOM 2986 O ASP A 207 -6.533 -19.843 -3.915 1.00 33.63 O ANISOU 2986 O ASP A 207 3366 4721 4690 281 -875 1820 O ATOM 2987 CB ASP A 207 -5.177 -19.310 -1.327 1.00 74.56 C ANISOU 2987 CB ASP A 207 8660 10603 9066 978 -504 1712 C ATOM 2988 CG ASP A 207 -4.156 -19.778 -0.308 1.00 85.92 C ANISOU 2988 CG ASP A 207 10180 12117 10348 1154 -540 1624 C ATOM 2989 OD1 ASP A 207 -3.053 -20.198 -0.720 1.00 85.88 O ANISOU 2989 OD1 ASP A 207 10294 11815 10522 982 -746 1299 O ATOM 2990 OD2 ASP A 207 -4.453 -19.722 0.903 1.00 92.23 O ANISOU 2990 OD2 ASP A 207 10948 13235 10859 1445 -316 1807 O ATOM 0 H ASP A 207 -3.701 -17.506 -2.101 1.00 41.31 H new ATOM 0 HA ASP A 207 -4.110 -19.967 -2.990 1.00 49.92 H new ATOM 0 HB2 ASP A 207 -5.546 -18.459 -1.043 1.00 74.56 H new ATOM 0 HB3 ASP A 207 -5.912 -19.942 -1.358 1.00 74.56 H new ATOM 2995 N GLN A 208 -5.756 -17.805 -4.391 1.00 23.27 N ANISOU 2995 N GLN A 208 2441 3536 2863 489 -614 985 N ATOM 2996 CA GLN A 208 -6.815 -17.558 -5.340 1.00 24.96 C ANISOU 2996 CA GLN A 208 2598 3641 3246 325 -638 1101 C ATOM 2997 C GLN A 208 -6.793 -18.565 -6.483 1.00 25.89 C ANISOU 2997 C GLN A 208 2787 3294 3757 58 -984 1053 C ATOM 2998 O GLN A 208 -5.727 -18.928 -6.975 1.00 27.58 O ANISOU 2998 O GLN A 208 3215 3292 3972 75 -1102 684 O ATOM 2999 CB GLN A 208 -6.693 -16.170 -5.946 1.00 26.40 C ANISOU 2999 CB GLN A 208 2968 3850 3212 387 -508 680 C ATOM 3000 CG GLN A 208 -7.215 -15.104 -5.111 1.00 32.97 C ANISOU 3000 CG GLN A 208 3794 5038 3693 686 -304 741 C ATOM 3001 CD GLN A 208 -7.227 -13.806 -5.879 1.00 29.98 C ANISOU 3001 CD GLN A 208 3586 4578 3225 675 -278 372 C ATOM 3002 OE1 GLN A 208 -6.385 -13.567 -6.746 1.00 29.85 O ANISOU 3002 OE1 GLN A 208 3684 4310 3346 507 -367 41 O ATOM 3003 NE2 GLN A 208 -8.212 -12.976 -5.583 1.00 25.73 N ANISOU 3003 NE2 GLN A 208 3031 4285 2460 899 -136 503 N ATOM 0 H GLN A 208 -5.190 -17.164 -4.298 1.00 23.27 H new ATOM 0 HA GLN A 208 -7.646 -17.640 -4.847 1.00 24.96 H new ATOM 0 HB2 GLN A 208 -5.758 -15.991 -6.133 1.00 26.40 H new ATOM 0 HB3 GLN A 208 -7.159 -16.158 -6.796 1.00 26.40 H new ATOM 0 HG2 GLN A 208 -8.113 -15.323 -4.818 1.00 32.97 H new ATOM 0 HG3 GLN A 208 -6.671 -15.012 -4.313 1.00 32.97 H new ATOM 0 HE21 GLN A 208 -8.779 -13.182 -4.970 1.00 25.73 H new ATOM 0 HE22 GLN A 208 -8.286 -12.229 -6.003 1.00 25.73 H new ATOM 3012 N GLU A 209 -7.966 -18.993 -6.885 1.00 26.03 N ANISOU 3012 N GLU A 209 3089 5291 1512 -952 -195 -90 N ATOM 3013 CA GLU A 209 -8.152 -19.829 -8.066 1.00 29.01 C ANISOU 3013 CA GLU A 209 3607 5279 2137 -816 -225 135 C ATOM 3014 C GLU A 209 -8.587 -18.924 -9.221 1.00 22.93 C ANISOU 3014 C GLU A 209 2699 4325 1689 -508 -56 -157 C ATOM 3015 O GLU A 209 -9.693 -18.348 -9.177 1.00 22.20 O ANISOU 3015 O GLU A 209 2434 4478 1523 -538 103 -455 O ATOM 3016 CB GLU A 209 -9.169 -20.939 -7.804 1.00 50.23 C ANISOU 3016 CB GLU A 209 6397 8115 4573 -1152 -221 340 C ATOM 3017 CG GLU A 209 -9.359 -21.901 -8.971 1.00 72.37 C ANISOU 3017 CG GLU A 209 9370 10536 7591 -1056 -282 563 C ATOM 3018 CD GLU A 209 -10.085 -23.184 -8.583 1.00 90.38 C ANISOU 3018 CD GLU A 209 11791 12807 9742 -1395 -359 809 C ATOM 3019 OE1 GLU A 209 -10.716 -23.220 -7.501 1.00 97.32 O ANISOU 3019 OE1 GLU A 209 12570 14023 10385 -1716 -303 752 O ATOM 3020 OE2 GLU A 209 -10.014 -24.159 -9.363 1.00 93.32 O ANISOU 3020 OE2 GLU A 209 12349 12808 10300 -1339 -485 1022 O ATOM 0 H GLU A 209 -8.699 -18.807 -6.476 1.00 26.03 H new ATOM 0 HA GLU A 209 -7.320 -20.272 -8.295 1.00 29.01 H new ATOM 0 HB2 GLU A 209 -8.888 -21.444 -7.025 1.00 50.23 H new ATOM 0 HB3 GLU A 209 -10.024 -20.536 -7.588 1.00 50.23 H new ATOM 0 HG2 GLU A 209 -9.858 -21.454 -9.672 1.00 72.37 H new ATOM 0 HG3 GLU A 209 -8.491 -22.127 -9.340 1.00 72.37 H new ATOM 3027 N LEU A 210 -7.773 -18.844 -10.251 1.00 18.48 N ANISOU 3027 N LEU A 210 2197 3364 1460 -240 -112 -77 N ATOM 3028 CA LEU A 210 -8.022 -17.999 -11.407 1.00 16.66 C ANISOU 3028 CA LEU A 210 1891 2928 1510 3 -14 -264 C ATOM 3029 C LEU A 210 -8.169 -18.878 -12.631 1.00 16.94 C ANISOU 3029 C LEU A 210 2040 2701 1695 81 -18 -77 C ATOM 3030 O LEU A 210 -7.294 -19.724 -12.904 1.00 18.15 O ANISOU 3030 O LEU A 210 2304 2658 1934 117 -127 130 O ATOM 3031 CB LEU A 210 -6.918 -16.978 -11.627 1.00 15.70 C ANISOU 3031 CB LEU A 210 1731 2634 1600 168 -55 -360 C ATOM 3032 CG LEU A 210 -6.639 -16.067 -10.447 1.00 19.32 C ANISOU 3032 CG LEU A 210 2081 3317 1943 98 -70 -582 C ATOM 3033 CD1 LEU A 210 -5.426 -15.196 -10.735 1.00 20.44 C ANISOU 3033 CD1 LEU A 210 2212 3252 2303 212 -133 -628 C ATOM 3034 CD2 LEU A 210 -7.867 -15.220 -10.119 1.00 21.22 C ANISOU 3034 CD2 LEU A 210 2166 3760 2137 102 32 -943 C ATOM 0 H LEU A 210 -7.039 -19.290 -10.303 1.00 18.48 H new ATOM 0 HA LEU A 210 -8.838 -17.500 -11.246 1.00 16.66 H new ATOM 0 HB2 LEU A 210 -6.101 -17.449 -11.854 1.00 15.70 H new ATOM 0 HB3 LEU A 210 -7.151 -16.430 -12.393 1.00 15.70 H new ATOM 0 HG LEU A 210 -6.442 -16.611 -9.669 1.00 19.32 H new ATOM 0 HD11 LEU A 210 -5.255 -14.617 -9.976 1.00 20.44 H new ATOM 0 HD12 LEU A 210 -4.652 -15.760 -10.892 1.00 20.44 H new ATOM 0 HD13 LEU A 210 -5.596 -14.655 -11.522 1.00 20.44 H new ATOM 0 HD21 LEU A 210 -7.671 -14.644 -9.363 1.00 21.22 H new ATOM 0 HD22 LEU A 210 -8.100 -14.676 -10.888 1.00 21.22 H new ATOM 0 HD23 LEU A 210 -8.611 -15.801 -9.898 1.00 21.22 H new ATOM 3046 N VAL A 211 -9.272 -18.696 -13.358 1.00 17.47 N ANISOU 3046 N VAL A 211 2056 2778 1805 120 80 -190 N ATOM 3047 CA VAL A 211 -9.621 -19.528 -14.498 1.00 15.95 C ANISOU 3047 CA VAL A 211 1953 2402 1706 153 90 -57 C ATOM 3048 C VAL A 211 -9.972 -18.604 -15.672 1.00 14.14 C ANISOU 3048 C VAL A 211 1662 2043 1666 334 134 -193 C ATOM 3049 O VAL A 211 -10.813 -17.712 -15.529 1.00 15.09 O ANISOU 3049 O VAL A 211 1656 2280 1798 384 158 -406 O ATOM 3050 CB VAL A 211 -10.806 -20.462 -14.194 1.00 16.48 C ANISOU 3050 CB VAL A 211 2037 2658 1567 -71 128 -5 C ATOM 3051 CG1 VAL A 211 -11.228 -21.238 -15.416 1.00 15.05 C ANISOU 3051 CG1 VAL A 211 1937 2286 1495 -38 137 82 C ATOM 3052 CG2 VAL A 211 -10.457 -21.394 -13.091 1.00 18.16 C ANISOU 3052 CG2 VAL A 211 2372 2959 1569 -314 25 210 C ATOM 0 H VAL A 211 -9.844 -18.075 -13.196 1.00 17.47 H new ATOM 0 HA VAL A 211 -8.864 -20.094 -14.714 1.00 15.95 H new ATOM 0 HB VAL A 211 -11.555 -19.909 -13.920 1.00 16.48 H new ATOM 0 HG11 VAL A 211 -11.974 -21.815 -15.191 1.00 15.05 H new ATOM 0 HG12 VAL A 211 -11.496 -20.621 -16.115 1.00 15.05 H new ATOM 0 HG13 VAL A 211 -10.485 -21.778 -15.729 1.00 15.05 H new ATOM 0 HG21 VAL A 211 -11.211 -21.977 -12.909 1.00 18.16 H new ATOM 0 HG22 VAL A 211 -9.690 -21.929 -13.350 1.00 18.16 H new ATOM 0 HG23 VAL A 211 -10.242 -20.886 -12.293 1.00 18.16 H new ATOM 3062 N LEU A 212 -9.386 -18.899 -16.824 1.00 14.86 N ANISOU 3062 N LEU A 212 1837 1915 1894 416 121 -82 N ATOM 3063 CA LEU A 212 -9.753 -18.294 -18.085 1.00 16.49 C ANISOU 3063 CA LEU A 212 2040 2013 2214 506 130 -120 C ATOM 3064 C LEU A 212 -10.441 -19.346 -18.949 1.00 15.74 C ANISOU 3064 C LEU A 212 1993 1907 2080 459 164 -52 C ATOM 3065 O LEU A 212 -10.022 -20.503 -18.949 1.00 17.41 O ANISOU 3065 O LEU A 212 2281 2061 2273 405 162 43 O ATOM 3066 CB LEU A 212 -8.516 -17.781 -18.826 1.00 16.57 C ANISOU 3066 CB LEU A 212 2089 1870 2335 549 111 -63 C ATOM 3067 CG LEU A 212 -7.600 -16.872 -17.973 1.00 16.90 C ANISOU 3067 CG LEU A 212 2093 1906 2421 557 69 -117 C ATOM 3068 CD1 LEU A 212 -6.401 -16.433 -18.790 1.00 19.27 C ANISOU 3068 CD1 LEU A 212 2410 2113 2797 526 69 -60 C ATOM 3069 CD2 LEU A 212 -8.326 -15.655 -17.438 1.00 15.19 C ANISOU 3069 CD2 LEU A 212 1823 1695 2254 606 11 -280 C ATOM 0 H LEU A 212 -8.748 -19.472 -16.891 1.00 14.86 H new ATOM 0 HA LEU A 212 -10.345 -17.545 -17.912 1.00 16.49 H new ATOM 0 HB2 LEU A 212 -8.000 -18.541 -19.139 1.00 16.57 H new ATOM 0 HB3 LEU A 212 -8.802 -17.289 -19.612 1.00 16.57 H new ATOM 0 HG LEU A 212 -7.310 -17.395 -17.210 1.00 16.90 H new ATOM 0 HD11 LEU A 212 -5.832 -15.864 -18.249 1.00 19.27 H new ATOM 0 HD12 LEU A 212 -5.900 -17.213 -19.075 1.00 19.27 H new ATOM 0 HD13 LEU A 212 -6.703 -15.941 -19.569 1.00 19.27 H new ATOM 0 HD21 LEU A 212 -7.713 -15.118 -16.912 1.00 15.19 H new ATOM 0 HD22 LEU A 212 -8.663 -15.128 -18.179 1.00 15.19 H new ATOM 0 HD23 LEU A 212 -9.067 -15.939 -16.880 1.00 15.19 H new ATOM 3081 N ILE A 213 -11.456 -18.929 -19.683 1.00 16.96 N ANISOU 3081 N ILE A 213 2104 2090 2250 493 157 -116 N ATOM 3082 CA ILE A 213 -12.226 -19.842 -20.554 1.00 15.85 C ANISOU 3082 CA ILE A 213 1992 1971 2059 430 184 -83 C ATOM 3083 C ILE A 213 -12.282 -19.227 -21.944 1.00 15.90 C ANISOU 3083 C ILE A 213 2024 1895 2122 489 135 -58 C ATOM 3084 O ILE A 213 -12.562 -18.048 -22.067 1.00 17.45 O ANISOU 3084 O ILE A 213 2185 2054 2393 576 36 -94 O ATOM 3085 CB ILE A 213 -13.653 -20.072 -20.012 1.00 16.49 C ANISOU 3085 CB ILE A 213 1956 2270 2039 351 207 -193 C ATOM 3086 CG1 ILE A 213 -13.641 -20.532 -18.571 1.00 16.96 C ANISOU 3086 CG1 ILE A 213 1994 2488 1962 203 249 -195 C ATOM 3087 CG2 ILE A 213 -14.373 -21.104 -20.905 1.00 16.87 C ANISOU 3087 CG2 ILE A 213 2041 2335 2032 247 229 -154 C ATOM 3088 CD1 ILE A 213 -14.517 -19.801 -17.657 1.00 20.86 C ANISOU 3088 CD1 ILE A 213 2284 3270 2374 185 281 -418 C ATOM 0 H ILE A 213 -11.728 -18.113 -19.700 1.00 16.96 H new ATOM 0 HA ILE A 213 -11.789 -20.708 -20.580 1.00 15.85 H new ATOM 0 HB ILE A 213 -14.130 -19.228 -20.035 1.00 16.49 H new ATOM 0 HG12 ILE A 213 -13.889 -21.470 -18.547 1.00 16.96 H new ATOM 0 HG13 ILE A 213 -12.732 -20.470 -18.238 1.00 16.96 H new ATOM 0 HG21 ILE A 213 -15.271 -21.253 -20.569 1.00 16.87 H new ATOM 0 HG22 ILE A 213 -14.420 -20.769 -21.814 1.00 16.87 H new ATOM 0 HG23 ILE A 213 -13.882 -21.940 -20.894 1.00 16.87 H new ATOM 0 HD11 ILE A 213 -14.435 -20.172 -16.764 1.00 20.86 H new ATOM 0 HD12 ILE A 213 -14.262 -18.865 -17.643 1.00 20.86 H new ATOM 0 HD13 ILE A 213 -15.436 -19.880 -17.957 1.00 20.86 H new ATOM 3100 N THR A 214 -12.036 -20.023 -22.997 1.00 13.73 N ANISOU 3100 N THR A 214 1818 1591 1808 427 175 -5 N ATOM 3101 CA THR A 214 -12.299 -19.525 -24.315 1.00 14.63 C ANISOU 3101 CA THR A 214 1959 1711 1891 410 120 34 C ATOM 3102 C THR A 214 -12.540 -20.654 -25.302 1.00 15.66 C ANISOU 3102 C THR A 214 2118 1902 1930 314 182 9 C ATOM 3103 O THR A 214 -12.535 -21.822 -24.941 1.00 15.75 O ANISOU 3103 O THR A 214 2142 1893 1950 279 245 -45 O ATOM 3104 CB THR A 214 -11.174 -18.570 -24.780 1.00 17.27 C ANISOU 3104 CB THR A 214 2351 1971 2241 385 88 121 C ATOM 3105 OG1 THR A 214 -11.624 -17.862 -25.932 1.00 18.18 O ANISOU 3105 OG1 THR A 214 2525 2089 2295 321 -35 222 O ATOM 3106 CG2 THR A 214 -9.940 -19.359 -25.101 1.00 19.23 C ANISOU 3106 CG2 THR A 214 2600 2256 2451 317 218 88 C ATOM 0 H THR A 214 -11.727 -20.825 -22.955 1.00 13.73 H new ATOM 0 HA THR A 214 -13.119 -19.008 -24.281 1.00 14.63 H new ATOM 0 HB THR A 214 -10.959 -17.939 -24.075 1.00 17.27 H new ATOM 0 HG1 THR A 214 -10.963 -17.547 -26.344 1.00 18.18 H new ATOM 0 HG21 THR A 214 -9.237 -18.757 -25.392 1.00 19.23 H new ATOM 0 HG22 THR A 214 -9.647 -19.838 -24.310 1.00 19.23 H new ATOM 0 HG23 THR A 214 -10.136 -19.993 -25.809 1.00 19.23 H new ATOM 3114 N ALA A 215 -12.767 -20.273 -26.547 1.00 15.99 N ANISOU 3114 N ALA A 215 2188 2006 1882 251 130 54 N ATOM 3115 CA ALA A 215 -12.954 -21.227 -27.636 1.00 14.83 C ANISOU 3115 CA ALA A 215 2057 1963 1616 137 190 -12 C ATOM 3116 C ALA A 215 -11.663 -21.925 -27.970 1.00 16.37 C ANISOU 3116 C ALA A 215 2254 2164 1801 94 321 -115 C ATOM 3117 O ALA A 215 -10.624 -21.298 -28.078 1.00 16.58 O ANISOU 3117 O ALA A 215 2272 2215 1812 70 352 -83 O ATOM 3118 CB ALA A 215 -13.465 -20.476 -28.875 1.00 17.41 C ANISOU 3118 CB ALA A 215 2416 2401 1798 44 67 90 C ATOM 0 H ALA A 215 -12.818 -19.450 -26.790 1.00 15.99 H new ATOM 0 HA ALA A 215 -13.598 -21.896 -27.357 1.00 14.83 H new ATOM 0 HB1 ALA A 215 -13.592 -21.103 -29.604 1.00 17.41 H new ATOM 0 HB2 ALA A 215 -14.310 -20.046 -28.668 1.00 17.41 H new ATOM 0 HB3 ALA A 215 -12.816 -19.804 -29.137 1.00 17.41 H new ATOM 3124 N ASP A 216 -11.714 -23.258 -28.184 1.00 17.95 N ANISOU 3124 N ASP A 216 2447 2347 2027 77 386 -278 N ATOM 3125 CA ASP A 216 -10.521 -23.922 -28.651 1.00 17.81 C ANISOU 3125 CA ASP A 216 2378 2351 2038 81 483 -472 C ATOM 3126 C ASP A 216 -10.064 -23.401 -30.010 1.00 19.14 C ANISOU 3126 C ASP A 216 2495 2797 1979 -84 559 -527 C ATOM 3127 O ASP A 216 -8.868 -23.458 -30.313 1.00 22.43 O ANISOU 3127 O ASP A 216 2809 3335 2380 -106 664 -687 O ATOM 3128 CB ASP A 216 -10.708 -25.445 -28.650 1.00 19.80 C ANISOU 3128 CB ASP A 216 2647 2460 2417 116 478 -672 C ATOM 3129 CG ASP A 216 -11.681 -25.968 -29.689 1.00 21.95 C ANISOU 3129 CG ASP A 216 2934 2851 2553 -21 487 -772 C ATOM 3130 OD1 ASP A 216 -12.546 -25.235 -30.187 1.00 22.22 O ANISOU 3130 OD1 ASP A 216 2978 3057 2407 -124 458 -635 O ATOM 3131 OD2 ASP A 216 -11.588 -27.195 -29.997 1.00 24.00 O ANISOU 3131 OD2 ASP A 216 3198 3003 2918 -14 490 -1012 O ATOM 0 H ASP A 216 -12.403 -23.759 -28.066 1.00 17.95 H new ATOM 0 HA ASP A 216 -9.808 -23.712 -28.028 1.00 17.81 H new ATOM 0 HB2 ASP A 216 -9.845 -25.864 -28.794 1.00 19.80 H new ATOM 0 HB3 ASP A 216 -11.014 -25.720 -27.772 1.00 19.80 H new ATOM 3136 N GLY A 217 -10.970 -22.847 -30.814 1.00 20.21 N ANISOU 3136 N GLY A 217 2688 3074 1918 -225 493 -393 N ATOM 3137 CA GLY A 217 -10.657 -22.235 -32.080 1.00 22.53 C ANISOU 3137 CA GLY A 217 2981 3655 1924 -464 516 -352 C ATOM 3138 C GLY A 217 -10.260 -20.766 -32.024 1.00 23.55 C ANISOU 3138 C GLY A 217 3186 3784 1976 -565 417 -66 C ATOM 3139 O GLY A 217 -10.091 -20.140 -33.083 1.00 27.51 O ANISOU 3139 O GLY A 217 3740 4516 2196 -841 382 60 O ATOM 0 H GLY A 217 -11.808 -22.821 -30.622 1.00 20.21 H new ATOM 0 HA2 GLY A 217 -9.933 -22.733 -32.491 1.00 22.53 H new ATOM 0 HA3 GLY A 217 -11.428 -22.323 -32.662 1.00 22.53 H new ATOM 3143 N ASP A 218 -10.082 -20.209 -30.830 1.00 21.02 N ANISOU 3143 N ASP A 218 2887 3217 1882 -390 356 40 N ATOM 3144 CA ASP A 218 -9.761 -18.794 -30.660 1.00 23.23 C ANISOU 3144 CA ASP A 218 3260 3412 2154 -469 221 291 C ATOM 3145 C ASP A 218 -8.558 -18.420 -31.520 1.00 27.61 C ANISOU 3145 C ASP A 218 3797 4230 2465 -780 326 307 C ATOM 3146 O ASP A 218 -7.503 -19.047 -31.432 1.00 28.14 O ANISOU 3146 O ASP A 218 3705 4452 2536 -786 534 62 O ATOM 3147 CB ASP A 218 -9.448 -18.541 -29.182 1.00 20.29 C ANISOU 3147 CB ASP A 218 2857 2799 2052 -243 213 274 C ATOM 3148 CG ASP A 218 -9.444 -17.065 -28.804 1.00 21.51 C ANISOU 3148 CG ASP A 218 3119 2768 2285 -258 18 492 C ATOM 3149 OD1 ASP A 218 -8.915 -16.198 -29.577 1.00 23.51 O ANISOU 3149 OD1 ASP A 218 3473 3076 2385 -516 -61 674 O ATOM 3150 OD2 ASP A 218 -9.988 -16.783 -27.707 1.00 22.61 O ANISOU 3150 OD2 ASP A 218 3244 2712 2636 -37 -69 466 O ATOM 0 H ASP A 218 -10.144 -20.644 -30.091 1.00 21.02 H new ATOM 0 HA ASP A 218 -10.515 -18.250 -30.937 1.00 23.23 H new ATOM 0 HB2 ASP A 218 -10.102 -19.005 -28.636 1.00 20.29 H new ATOM 0 HB3 ASP A 218 -8.581 -18.923 -28.973 1.00 20.29 H new ATOM 3155 N ALA A 219 -8.732 -17.387 -32.355 1.00 29.63 N ANISOU 3155 N ALA A 219 4207 4547 2504 -1057 155 594 N ATOM 3156 CA ALA A 219 -7.645 -16.978 -33.226 1.00 28.92 C ANISOU 3156 CA ALA A 219 4081 4730 2176 -1409 234 608 C ATOM 3157 C ALA A 219 -6.489 -16.339 -32.468 1.00 27.15 C ANISOU 3157 C ALA A 219 3820 4442 2054 -1453 292 626 C ATOM 3158 O ALA A 219 -5.434 -16.125 -33.082 1.00 28.98 O ANISOU 3158 O ALA A 219 3949 4924 2138 -1708 377 541 O ATOM 3159 CB ALA A 219 -8.158 -16.013 -34.294 1.00 30.71 C ANISOU 3159 CB ALA A 219 4471 4938 2259 -1656 -38 894 C ATOM 0 H ALA A 219 -9.455 -16.926 -32.426 1.00 29.63 H new ATOM 0 HA ALA A 219 -7.304 -17.784 -33.644 1.00 28.92 H new ATOM 0 HB1 ALA A 219 -7.424 -15.747 -34.869 1.00 30.71 H new ATOM 0 HB2 ALA A 219 -8.842 -16.451 -34.825 1.00 30.71 H new ATOM 0 HB3 ALA A 219 -8.535 -15.228 -33.867 1.00 30.71 H new ATOM 3165 N ASP A 220 -6.652 -16.063 -31.184 1.00 25.97 N ANISOU 3165 N ASP A 220 3710 3968 2190 -1185 224 672 N ATOM 3166 CA ASP A 220 -5.597 -15.437 -30.390 1.00 28.89 C ANISOU 3166 CA ASP A 220 4036 4260 2679 -1216 257 674 C ATOM 3167 C ASP A 220 -5.552 -16.055 -29.001 1.00 25.95 C ANISOU 3167 C ASP A 220 3535 3696 2629 -810 323 458 C ATOM 3168 O ASP A 220 -5.901 -15.439 -27.994 1.00 23.13 O ANISOU 3168 O ASP A 220 3254 3042 2493 -627 176 539 O ATOM 3169 CB ASP A 220 -5.801 -13.917 -30.316 1.00 33.85 C ANISOU 3169 CB ASP A 220 4913 4596 3353 -1375 -43 1028 C ATOM 3170 CG ASP A 220 -4.584 -13.199 -29.739 1.00 40.06 C ANISOU 3170 CG ASP A 220 5657 5363 4201 -1518 -4 1023 C ATOM 3171 OD1 ASP A 220 -3.451 -13.701 -29.921 1.00 43.31 O ANISOU 3171 OD1 ASP A 220 5852 6130 4475 -1663 250 812 O ATOM 3172 OD2 ASP A 220 -4.769 -12.150 -29.100 1.00 42.05 O ANISOU 3172 OD2 ASP A 220 6057 5255 4665 -1448 -240 1168 O ATOM 0 H ASP A 220 -7.373 -16.231 -30.746 1.00 25.97 H new ATOM 0 HA ASP A 220 -4.744 -15.598 -30.822 1.00 28.89 H new ATOM 0 HB2 ASP A 220 -5.986 -13.574 -31.204 1.00 33.85 H new ATOM 0 HB3 ASP A 220 -6.578 -13.723 -29.769 1.00 33.85 H new ATOM 3177 N LEU A 221 -5.106 -17.316 -28.931 1.00 23.50 N ANISOU 3177 N LEU A 221 3025 3560 2345 -675 525 160 N ATOM 3178 CA LEU A 221 -4.964 -17.979 -27.641 1.00 20.98 C ANISOU 3178 CA LEU A 221 2612 3063 2296 -346 542 6 C ATOM 3179 C LEU A 221 -3.713 -17.538 -26.877 1.00 16.76 C ANISOU 3179 C LEU A 221 1961 2554 1852 -357 577 -51 C ATOM 3180 O LEU A 221 -3.661 -17.733 -25.654 1.00 18.15 O ANISOU 3180 O LEU A 221 2114 2552 2229 -126 520 -86 O ATOM 3181 CB LEU A 221 -4.895 -19.498 -27.820 1.00 24.50 C ANISOU 3181 CB LEU A 221 2919 3594 2796 -187 659 -274 C ATOM 3182 CG LEU A 221 -6.190 -20.250 -28.001 1.00 24.74 C ANISOU 3182 CG LEU A 221 3048 3508 2844 -80 607 -266 C ATOM 3183 CD1 LEU A 221 -5.910 -21.724 -28.382 1.00 26.73 C ANISOU 3183 CD1 LEU A 221 3171 3828 3158 20 703 -580 C ATOM 3184 CD2 LEU A 221 -7.002 -20.181 -26.752 1.00 21.58 C ANISOU 3184 CD2 LEU A 221 2742 2838 2618 112 482 -140 C ATOM 0 H LEU A 221 -4.885 -17.794 -29.611 1.00 23.50 H new ATOM 0 HA LEU A 221 -5.746 -17.724 -27.127 1.00 20.98 H new ATOM 0 HB2 LEU A 221 -4.335 -19.681 -28.591 1.00 24.50 H new ATOM 0 HB3 LEU A 221 -4.442 -19.868 -27.046 1.00 24.50 H new ATOM 0 HG LEU A 221 -6.691 -19.837 -28.722 1.00 24.74 H new ATOM 0 HD11 LEU A 221 -6.751 -22.195 -28.495 1.00 26.73 H new ATOM 0 HD12 LEU A 221 -5.409 -21.754 -29.212 1.00 26.73 H new ATOM 0 HD13 LEU A 221 -5.395 -22.148 -27.678 1.00 26.73 H new ATOM 0 HD21 LEU A 221 -7.832 -20.667 -26.878 1.00 21.58 H new ATOM 0 HD22 LEU A 221 -6.504 -20.577 -26.020 1.00 21.58 H new ATOM 0 HD23 LEU A 221 -7.199 -19.254 -26.545 1.00 21.58 H new ATOM 3196 N ALA A 222 -2.748 -16.904 -27.539 1.00 19.86 N ANISOU 3196 N ALA A 222 2283 3193 2072 -664 656 -46 N ATOM 3197 CA ALA A 222 -1.489 -16.538 -26.892 1.00 22.88 C ANISOU 3197 CA ALA A 222 2505 3665 2524 -708 703 -142 C ATOM 3198 C ALA A 222 -1.689 -15.831 -25.556 1.00 22.04 C ANISOU 3198 C ALA A 222 2514 3234 2628 -546 540 -6 C ATOM 3199 O ALA A 222 -1.071 -16.235 -24.564 1.00 22.59 O ANISOU 3199 O ALA A 222 2441 3288 2856 -351 546 -153 O ATOM 3200 CB ALA A 222 -0.659 -15.671 -27.850 1.00 27.65 C ANISOU 3200 CB ALA A 222 3072 4583 2851 -1184 785 -72 C ATOM 0 H ALA A 222 -2.802 -16.676 -28.366 1.00 19.86 H new ATOM 0 HA ALA A 222 -1.012 -17.359 -26.691 1.00 22.88 H new ATOM 0 HB1 ALA A 222 0.177 -15.427 -27.423 1.00 27.65 H new ATOM 0 HB2 ALA A 222 -0.474 -16.170 -28.661 1.00 27.65 H new ATOM 0 HB3 ALA A 222 -1.155 -14.868 -28.072 1.00 27.65 H new ATOM 3206 N PRO A 223 -2.482 -14.755 -25.455 1.00 23.10 N ANISOU 3206 N PRO A 223 2886 3111 2780 -616 366 239 N ATOM 3207 CA PRO A 223 -2.631 -14.097 -24.151 1.00 19.53 C ANISOU 3207 CA PRO A 223 2494 2396 2531 -454 228 265 C ATOM 3208 C PRO A 223 -3.309 -14.935 -23.109 1.00 17.11 C ANISOU 3208 C PRO A 223 2148 1989 2364 -113 217 153 C ATOM 3209 O PRO A 223 -3.089 -14.724 -21.905 1.00 17.29 O ANISOU 3209 O PRO A 223 2133 1937 2500 4 167 92 O ATOM 3210 CB PRO A 223 -3.446 -12.815 -24.491 1.00 22.13 C ANISOU 3210 CB PRO A 223 3074 2450 2885 -576 4 496 C ATOM 3211 CG PRO A 223 -4.140 -13.142 -25.749 1.00 27.99 C ANISOU 3211 CG PRO A 223 3902 3273 3459 -678 0 614 C ATOM 3212 CD PRO A 223 -3.238 -14.084 -26.524 1.00 27.80 C ANISOU 3212 CD PRO A 223 3690 3647 3225 -840 251 476 C ATOM 0 HA PRO A 223 -1.769 -13.916 -23.745 1.00 19.53 H new ATOM 0 HB2 PRO A 223 -4.076 -12.600 -23.786 1.00 22.13 H new ATOM 0 HB3 PRO A 223 -2.865 -12.045 -24.598 1.00 22.13 H new ATOM 0 HG2 PRO A 223 -4.997 -13.559 -25.569 1.00 27.99 H new ATOM 0 HG3 PRO A 223 -4.317 -12.338 -26.262 1.00 27.99 H new ATOM 0 HD2 PRO A 223 -3.747 -14.715 -27.056 1.00 27.80 H new ATOM 0 HD3 PRO A 223 -2.654 -13.605 -27.133 1.00 27.80 H new ATOM 3220 N PHE A 224 -4.108 -15.941 -23.490 1.00 18.36 N ANISOU 3220 N PHE A 224 2311 2173 2491 10 262 123 N ATOM 3221 CA PHE A 224 -4.626 -16.869 -22.513 1.00 16.97 C ANISOU 3221 CA PHE A 224 2105 1938 2405 243 254 44 C ATOM 3222 C PHE A 224 -3.514 -17.742 -21.928 1.00 16.81 C ANISOU 3222 C PHE A 224 1934 2005 2450 333 298 -85 C ATOM 3223 O PHE A 224 -3.441 -17.906 -20.711 1.00 15.94 O ANISOU 3223 O PHE A 224 1813 1838 2407 442 225 -90 O ATOM 3224 CB PHE A 224 -5.714 -17.727 -23.160 1.00 15.86 C ANISOU 3224 CB PHE A 224 2017 1795 2214 293 276 49 C ATOM 3225 CG PHE A 224 -6.983 -16.966 -23.427 1.00 16.60 C ANISOU 3225 CG PHE A 224 2223 1793 2292 285 173 150 C ATOM 3226 CD1 PHE A 224 -7.164 -16.251 -24.617 1.00 19.80 C ANISOU 3226 CD1 PHE A 224 2715 2200 2607 128 114 270 C ATOM 3227 CD2 PHE A 224 -7.983 -16.903 -22.474 1.00 17.68 C ANISOU 3227 CD2 PHE A 224 2361 1862 2496 418 106 113 C ATOM 3228 CE1 PHE A 224 -8.327 -15.510 -24.846 1.00 20.40 C ANISOU 3228 CE1 PHE A 224 2887 2142 2723 168 -62 360 C ATOM 3229 CE2 PHE A 224 -9.138 -16.176 -22.700 1.00 16.75 C ANISOU 3229 CE2 PHE A 224 2280 1671 2411 462 -16 130 C ATOM 3230 CZ PHE A 224 -9.321 -15.487 -23.889 1.00 19.71 C ANISOU 3230 CZ PHE A 224 2751 1979 2758 369 -126 257 C ATOM 0 H PHE A 224 -4.352 -16.092 -24.301 1.00 18.36 H new ATOM 0 HA PHE A 224 -5.010 -16.367 -21.777 1.00 16.97 H new ATOM 0 HB2 PHE A 224 -5.379 -18.090 -23.995 1.00 15.86 H new ATOM 0 HB3 PHE A 224 -5.911 -18.481 -22.582 1.00 15.86 H new ATOM 0 HD1 PHE A 224 -6.499 -16.269 -25.267 1.00 19.80 H new ATOM 0 HD2 PHE A 224 -7.877 -17.356 -21.669 1.00 17.68 H new ATOM 0 HE1 PHE A 224 -8.430 -15.035 -25.639 1.00 20.40 H new ATOM 0 HE2 PHE A 224 -9.799 -16.149 -22.047 1.00 16.75 H new ATOM 0 HZ PHE A 224 -10.107 -15.013 -24.040 1.00 19.71 H new ATOM 3240 N HIS A 225 -2.627 -18.248 -22.766 1.00 18.32 N ANISOU 3240 N HIS A 225 1988 2358 2613 280 395 -210 N ATOM 3241 CA HIS A 225 -1.454 -18.971 -22.264 1.00 18.23 C ANISOU 3241 CA HIS A 225 1783 2425 2720 407 386 -384 C ATOM 3242 C HIS A 225 -0.599 -18.064 -21.389 1.00 18.96 C ANISOU 3242 C HIS A 225 1805 2557 2842 353 337 -365 C ATOM 3243 O HIS A 225 -0.010 -18.510 -20.409 1.00 20.18 O ANISOU 3243 O HIS A 225 1868 2691 3108 503 236 -422 O ATOM 3244 CB HIS A 225 -0.645 -19.541 -23.415 1.00 20.57 C ANISOU 3244 CB HIS A 225 1872 2957 2987 358 516 -624 C ATOM 3245 CG HIS A 225 -1.352 -20.629 -24.176 1.00 22.39 C ANISOU 3245 CG HIS A 225 2141 3143 3222 444 546 -720 C ATOM 3246 ND1 HIS A 225 -1.958 -21.690 -23.555 1.00 22.03 N ANISOU 3246 ND1 HIS A 225 2215 2843 3312 644 405 -676 N ATOM 3247 CD2 HIS A 225 -1.502 -20.830 -25.506 1.00 23.79 C ANISOU 3247 CD2 HIS A 225 2271 3518 3251 302 684 -844 C ATOM 3248 CE1 HIS A 225 -2.455 -22.503 -24.470 1.00 22.96 C ANISOU 3248 CE1 HIS A 225 2366 2960 3396 635 443 -769 C ATOM 3249 NE2 HIS A 225 -2.188 -22.007 -25.662 1.00 23.62 N ANISOU 3249 NE2 HIS A 225 2335 3324 3315 453 614 -897 N ATOM 0 H HIS A 225 -2.677 -18.189 -23.623 1.00 18.32 H new ATOM 0 HA HIS A 225 -1.760 -19.712 -21.718 1.00 18.23 H new ATOM 0 HB2 HIS A 225 -0.420 -18.823 -24.028 1.00 20.57 H new ATOM 0 HB3 HIS A 225 0.191 -19.891 -23.069 1.00 20.57 H new ATOM 0 HD1 HIS A 225 -2.007 -21.808 -22.705 1.00 22.03 H new ATOM 0 HD2 HIS A 225 -1.197 -20.274 -26.186 1.00 23.79 H new ATOM 0 HE1 HIS A 225 -2.916 -23.293 -24.302 1.00 22.96 H new ATOM 3257 N ALA A 226 -0.503 -16.763 -21.732 1.00 17.19 N ANISOU 3257 N ALA A 226 1639 2372 2522 116 370 -272 N ATOM 3258 CA ALA A 226 0.320 -15.874 -20.916 1.00 18.34 C ANISOU 3258 CA ALA A 226 1723 2542 2705 32 316 -278 C ATOM 3259 C ALA A 226 -0.270 -15.736 -19.509 1.00 19.52 C ANISOU 3259 C ALA A 226 1975 2510 2929 194 181 -222 C ATOM 3260 O ALA A 226 0.470 -15.610 -18.543 1.00 21.03 O ANISOU 3260 O ALA A 226 2067 2756 3166 226 114 -284 O ATOM 3261 CB ALA A 226 0.439 -14.511 -21.593 1.00 19.75 C ANISOU 3261 CB ALA A 226 2001 2720 2784 -293 328 -158 C ATOM 0 H ALA A 226 -0.892 -16.397 -22.406 1.00 17.19 H new ATOM 0 HA ALA A 226 1.208 -16.256 -20.831 1.00 18.34 H new ATOM 0 HB1 ALA A 226 0.986 -13.925 -21.047 1.00 19.75 H new ATOM 0 HB2 ALA A 226 0.850 -14.617 -22.465 1.00 19.75 H new ATOM 0 HB3 ALA A 226 -0.444 -14.123 -21.698 1.00 19.75 H new ATOM 3267 N GLY A 227 -1.599 -15.791 -19.378 1.00 19.86 N ANISOU 3267 N GLY A 227 2186 2398 2960 275 144 -135 N ATOM 3268 CA GLY A 227 -2.189 -15.780 -18.047 1.00 19.76 C ANISOU 3268 CA GLY A 227 2223 2327 2959 383 54 -138 C ATOM 3269 C GLY A 227 -1.920 -17.045 -17.261 1.00 20.32 C ANISOU 3269 C GLY A 227 2237 2455 3029 512 -2 -140 C ATOM 3270 O GLY A 227 -1.721 -17.003 -16.047 1.00 20.69 O ANISOU 3270 O GLY A 227 2266 2551 3043 527 -94 -143 O ATOM 0 H GLY A 227 -2.158 -15.834 -20.030 1.00 19.86 H new ATOM 0 HA2 GLY A 227 -1.843 -15.020 -17.553 1.00 19.76 H new ATOM 0 HA3 GLY A 227 -3.147 -15.654 -18.126 1.00 19.76 H new ATOM 3274 N GLU A 228 -1.874 -18.199 -17.936 1.00 20.62 N ANISOU 3274 N GLU A 228 2255 2474 3105 594 16 -138 N ATOM 3275 CA GLU A 228 -1.429 -19.413 -17.266 1.00 21.64 C ANISOU 3275 CA GLU A 228 2350 2572 3300 725 -121 -126 C ATOM 3276 C GLU A 228 -0.077 -19.214 -16.616 1.00 22.69 C ANISOU 3276 C GLU A 228 2316 2805 3500 763 -220 -200 C ATOM 3277 O GLU A 228 0.132 -19.572 -15.445 1.00 24.64 O ANISOU 3277 O GLU A 228 2584 3048 3731 806 -397 -123 O ATOM 3278 CB GLU A 228 -1.362 -20.570 -18.276 1.00 23.10 C ANISOU 3278 CB GLU A 228 2507 2685 3584 824 -105 -197 C ATOM 3279 CG GLU A 228 -2.683 -21.088 -18.783 1.00 22.67 C ANISOU 3279 CG GLU A 228 2616 2528 3469 791 -54 -120 C ATOM 3280 CD GLU A 228 -2.484 -22.203 -19.795 1.00 26.52 C ANISOU 3280 CD GLU A 228 3084 2977 4014 834 -27 -220 C ATOM 3281 OE1 GLU A 228 -1.905 -21.943 -20.868 1.00 28.79 O ANISOU 3281 OE1 GLU A 228 3235 3396 4308 816 93 -385 O ATOM 3282 OE2 GLU A 228 -2.836 -23.344 -19.488 1.00 28.21 O ANISOU 3282 OE2 GLU A 228 3402 3042 4275 870 -141 -160 O ATOM 0 H GLU A 228 -2.092 -18.294 -18.763 1.00 20.62 H new ATOM 0 HA GLU A 228 -2.069 -19.628 -16.569 1.00 21.64 H new ATOM 0 HB2 GLU A 228 -0.836 -20.280 -19.037 1.00 23.10 H new ATOM 0 HB3 GLU A 228 -0.883 -21.307 -17.865 1.00 23.10 H new ATOM 0 HG2 GLU A 228 -3.213 -21.414 -18.039 1.00 22.67 H new ATOM 0 HG3 GLU A 228 -3.183 -20.363 -19.191 1.00 22.67 H new ATOM 3289 N ARG A 229 0.885 -18.693 -17.381 1.00 23.13 N ANISOU 3289 N ARG A 229 2191 2992 3606 716 -120 -349 N ATOM 3290 CA ARG A 229 2.248 -18.548 -16.889 1.00 27.19 C ANISOU 3290 CA ARG A 229 2481 3654 4195 746 -204 -471 C ATOM 3291 C ARG A 229 2.368 -17.468 -15.829 1.00 25.36 C ANISOU 3291 C ARG A 229 2286 3475 3874 618 -253 -415 C ATOM 3292 O ARG A 229 3.048 -17.650 -14.811 1.00 27.67 O ANISOU 3292 O ARG A 229 2489 3837 4188 680 -422 -426 O ATOM 3293 CB ARG A 229 3.203 -18.195 -18.037 1.00 30.93 C ANISOU 3293 CB ARG A 229 2715 4344 4691 642 -41 -676 C ATOM 3294 CG ARG A 229 3.122 -19.053 -19.235 1.00 33.94 C ANISOU 3294 CG ARG A 229 3065 4742 5088 690 58 -785 C ATOM 3295 CD ARG A 229 4.309 -18.760 -20.142 1.00 34.19 C ANISOU 3295 CD ARG A 229 2840 5079 5070 535 200 -1014 C ATOM 3296 NE ARG A 229 4.287 -17.411 -20.728 1.00 29.34 N ANISOU 3296 NE ARG A 229 2177 4665 4305 194 387 -985 N ATOM 3297 CZ ARG A 229 3.582 -17.068 -21.792 1.00 25.79 C ANISOU 3297 CZ ARG A 229 1882 4223 3692 -14 524 -884 C ATOM 3298 NH1 ARG A 229 2.753 -17.940 -22.393 1.00 23.46 N ANISOU 3298 NH1 ARG A 229 1683 3830 3402 123 551 -892 N ATOM 3299 NH2 ARG A 229 3.678 -15.835 -22.267 1.00 28.75 N ANISOU 3299 NH2 ARG A 229 2344 4684 3897 -386 600 -750 N ATOM 0 H ARG A 229 0.765 -18.419 -18.187 1.00 23.13 H new ATOM 0 HA ARG A 229 2.486 -19.402 -16.496 1.00 27.19 H new ATOM 0 HB2 ARG A 229 3.032 -17.279 -18.305 1.00 30.93 H new ATOM 0 HB3 ARG A 229 4.112 -18.227 -17.699 1.00 30.93 H new ATOM 0 HG2 ARG A 229 3.121 -19.988 -18.977 1.00 33.94 H new ATOM 0 HG3 ARG A 229 2.291 -18.889 -19.708 1.00 33.94 H new ATOM 0 HD2 ARG A 229 5.128 -18.870 -19.635 1.00 34.19 H new ATOM 0 HD3 ARG A 229 4.328 -19.415 -20.858 1.00 34.19 H new ATOM 0 HE ARG A 229 4.766 -16.804 -20.352 1.00 29.34 H new ATOM 0 HH11 ARG A 229 2.673 -18.739 -22.086 1.00 23.46 H new ATOM 0 HH12 ARG A 229 2.302 -17.698 -23.084 1.00 23.46 H new ATOM 0 HH21 ARG A 229 4.196 -15.266 -21.883 1.00 28.75 H new ATOM 0 HH22 ARG A 229 3.223 -15.604 -22.959 1.00 28.75 H new ATOM 3313 N ARG A 230 1.771 -16.297 -16.090 1.00 21.64 N ANISOU 3313 N ARG A 230 1938 2966 3320 438 -138 -379 N ATOM 3314 CA ARG A 230 2.009 -15.118 -15.279 1.00 23.11 C ANISOU 3314 CA ARG A 230 2132 3182 3466 302 -177 -411 C ATOM 3315 C ARG A 230 1.183 -15.144 -14.008 1.00 23.10 C ANISOU 3315 C ARG A 230 2254 3150 3374 353 -276 -368 C ATOM 3316 O ARG A 230 1.667 -14.724 -12.955 1.00 26.57 O ANISOU 3316 O ARG A 230 2634 3697 3763 304 -369 -430 O ATOM 3317 CB ARG A 230 1.684 -13.850 -16.081 1.00 24.03 C ANISOU 3317 CB ARG A 230 2355 3193 3581 100 -85 -399 C ATOM 3318 CG ARG A 230 2.106 -12.537 -15.414 1.00 25.28 C ANISOU 3318 CG ARG A 230 2520 3326 3758 -68 -150 -473 C ATOM 3319 CD ARG A 230 1.880 -11.362 -16.357 1.00 24.83 C ANISOU 3319 CD ARG A 230 2609 3084 3740 -292 -133 -410 C ATOM 3320 NE ARG A 230 0.479 -11.250 -16.745 1.00 22.22 N ANISOU 3320 NE ARG A 230 2478 2529 3437 -190 -157 -330 N ATOM 3321 CZ ARG A 230 -0.464 -10.729 -15.974 1.00 20.74 C ANISOU 3321 CZ ARG A 230 2385 2185 3311 -75 -251 -419 C ATOM 3322 NH1 ARG A 230 -0.161 -10.248 -14.786 1.00 20.36 N ANISOU 3322 NH1 ARG A 230 2276 2182 3278 -74 -318 -586 N ATOM 3323 NH2 ARG A 230 -1.713 -10.682 -16.415 1.00 21.01 N ANISOU 3323 NH2 ARG A 230 2541 2057 3385 35 -279 -382 N ATOM 0 H ARG A 230 1.222 -16.174 -16.740 1.00 21.64 H new ATOM 0 HA ARG A 230 2.947 -15.114 -15.031 1.00 23.11 H new ATOM 0 HB2 ARG A 230 2.117 -13.911 -16.947 1.00 24.03 H new ATOM 0 HB3 ARG A 230 0.728 -13.822 -16.243 1.00 24.03 H new ATOM 0 HG2 ARG A 230 1.599 -12.405 -14.597 1.00 25.28 H new ATOM 0 HG3 ARG A 230 3.042 -12.582 -15.163 1.00 25.28 H new ATOM 0 HD2 ARG A 230 2.164 -10.541 -15.926 1.00 24.83 H new ATOM 0 HD3 ARG A 230 2.429 -11.471 -17.149 1.00 24.83 H new ATOM 0 HE ARG A 230 0.251 -11.540 -17.522 1.00 22.22 H new ATOM 0 HH11 ARG A 230 0.652 -10.271 -14.507 1.00 20.36 H new ATOM 0 HH12 ARG A 230 -0.776 -9.911 -14.289 1.00 20.36 H new ATOM 0 HH21 ARG A 230 -1.905 -10.988 -17.195 1.00 21.01 H new ATOM 0 HH22 ARG A 230 -2.331 -10.345 -15.921 1.00 21.01 H new ATOM 3337 N LEU A 231 -0.057 -15.625 -14.092 1.00 21.76 N ANISOU 3337 N LEU A 231 2230 2890 3150 414 -246 -286 N ATOM 3338 CA LEU A 231 -0.975 -15.622 -12.970 1.00 23.57 C ANISOU 3338 CA LEU A 231 2540 3179 3234 396 -293 -284 C ATOM 3339 C LEU A 231 -1.175 -17.007 -12.364 1.00 23.35 C ANISOU 3339 C LEU A 231 2564 3205 3103 438 -404 -128 C ATOM 3340 O LEU A 231 -1.848 -17.123 -11.336 1.00 24.22 O ANISOU 3340 O LEU A 231 2732 3452 3018 343 -446 -102 O ATOM 3341 CB LEU A 231 -2.355 -15.078 -13.378 1.00 21.59 C ANISOU 3341 CB LEU A 231 2388 2840 2977 391 -197 -337 C ATOM 3342 CG LEU A 231 -2.363 -13.615 -13.834 1.00 24.60 C ANISOU 3342 CG LEU A 231 2780 3080 3486 345 -182 -464 C ATOM 3343 CD1 LEU A 231 -3.754 -13.208 -14.247 1.00 26.17 C ANISOU 3343 CD1 LEU A 231 3053 3164 3725 405 -160 -524 C ATOM 3344 CD2 LEU A 231 -1.825 -12.716 -12.738 1.00 26.38 C ANISOU 3344 CD2 LEU A 231 2940 3387 3696 272 -252 -635 C ATOM 0 H LEU A 231 -0.386 -15.964 -14.811 1.00 21.76 H new ATOM 0 HA LEU A 231 -0.566 -15.046 -12.306 1.00 23.57 H new ATOM 0 HB2 LEU A 231 -2.706 -15.629 -14.095 1.00 21.59 H new ATOM 0 HB3 LEU A 231 -2.960 -15.172 -12.626 1.00 21.59 H new ATOM 0 HG LEU A 231 -1.782 -13.520 -14.605 1.00 24.60 H new ATOM 0 HD11 LEU A 231 -3.749 -12.281 -14.534 1.00 26.17 H new ATOM 0 HD12 LEU A 231 -4.052 -13.771 -14.979 1.00 26.17 H new ATOM 0 HD13 LEU A 231 -4.358 -13.310 -13.495 1.00 26.17 H new ATOM 0 HD21 LEU A 231 -1.836 -11.794 -13.041 1.00 26.38 H new ATOM 0 HD22 LEU A 231 -2.379 -12.803 -11.947 1.00 26.38 H new ATOM 0 HD23 LEU A 231 -0.915 -12.975 -12.525 1.00 26.38 H new ATOM 3356 N GLY A 232 -0.606 -18.044 -12.966 1.00 23.05 N ANISOU 3356 N GLY A 232 2504 3068 3187 552 -471 -41 N ATOM 3357 CA GLY A 232 -0.976 -19.397 -12.561 1.00 22.10 C ANISOU 3357 CA GLY A 232 2500 2880 3019 582 -625 140 C ATOM 3358 C GLY A 232 -2.448 -19.700 -12.794 1.00 21.11 C ANISOU 3358 C GLY A 232 2522 2718 2779 497 -519 208 C ATOM 3359 O GLY A 232 -3.041 -20.501 -12.052 1.00 21.40 O ANISOU 3359 O GLY A 232 2687 2785 2660 382 -631 374 O ATOM 0 H GLY A 232 -0.020 -17.992 -13.593 1.00 23.05 H new ATOM 0 HA2 GLY A 232 -0.437 -20.036 -13.053 1.00 22.10 H new ATOM 0 HA3 GLY A 232 -0.770 -19.516 -11.621 1.00 22.10 H new ATOM 3363 N ALA A 233 -3.044 -19.100 -13.816 1.00 20.96 N ANISOU 3363 N ALA A 233 2490 2651 2821 518 -330 101 N ATOM 3364 CA ALA A 233 -4.444 -19.345 -14.136 1.00 19.67 C ANISOU 3364 CA ALA A 233 2421 2480 2573 457 -236 128 C ATOM 3365 C ALA A 233 -4.577 -20.668 -14.865 1.00 18.93 C ANISOU 3365 C ALA A 233 2412 2215 2565 509 -285 238 C ATOM 3366 O ALA A 233 -3.622 -21.172 -15.463 1.00 20.95 O ANISOU 3366 O ALA A 233 2619 2346 2997 642 -346 213 O ATOM 3367 CB ALA A 233 -5.002 -18.235 -14.990 1.00 17.71 C ANISOU 3367 CB ALA A 233 2134 2211 2385 483 -91 -10 C ATOM 0 H ALA A 233 -2.652 -18.543 -14.341 1.00 20.96 H new ATOM 0 HA ALA A 233 -4.948 -19.377 -13.308 1.00 19.67 H new ATOM 0 HB1 ALA A 233 -5.933 -18.418 -15.191 1.00 17.71 H new ATOM 0 HB2 ALA A 233 -4.934 -17.394 -14.512 1.00 17.71 H new ATOM 0 HB3 ALA A 233 -4.498 -18.178 -15.817 1.00 17.71 H new ATOM 3373 N HIS A 234 -5.753 -21.257 -14.735 1.00 18.44 N ANISOU 3373 N HIS A 234 2453 2173 2379 391 -269 319 N ATOM 3374 CA HIS A 234 -6.112 -22.487 -15.448 1.00 19.53 C ANISOU 3374 CA HIS A 234 2698 2124 2599 402 -317 404 C ATOM 3375 C HIS A 234 -6.886 -22.113 -16.681 1.00 18.30 C ANISOU 3375 C HIS A 234 2505 1972 2477 433 -139 284 C ATOM 3376 O HIS A 234 -7.758 -21.238 -16.631 1.00 22.10 O ANISOU 3376 O HIS A 234 2935 2606 2855 377 -28 210 O ATOM 3377 CB HIS A 234 -6.926 -23.408 -14.562 1.00 23.64 C ANISOU 3377 CB HIS A 234 3373 2673 2935 174 -431 599 C ATOM 3378 CG HIS A 234 -6.247 -23.751 -13.273 1.00 37.22 C ANISOU 3378 CG HIS A 234 5167 4416 4557 81 -656 778 C ATOM 3379 ND1 HIS A 234 -5.142 -24.573 -13.206 1.00 41.84 N ANISOU 3379 ND1 HIS A 234 5815 4736 5347 226 -924 886 N ATOM 3380 CD2 HIS A 234 -6.500 -23.358 -12.001 1.00 41.68 C ANISOU 3380 CD2 HIS A 234 5734 5267 4834 -143 -675 846 C ATOM 3381 CE1 HIS A 234 -4.751 -24.681 -11.948 1.00 46.36 C ANISOU 3381 CE1 HIS A 234 6454 5401 5760 90 -1128 1068 C ATOM 3382 NE2 HIS A 234 -5.558 -23.955 -11.197 1.00 43.86 N ANISOU 3382 NE2 HIS A 234 6109 5442 5113 -161 -967 1053 N ATOM 0 H HIS A 234 -6.378 -20.956 -14.226 1.00 18.44 H new ATOM 0 HA HIS A 234 -5.306 -22.966 -15.698 1.00 19.53 H new ATOM 0 HB2 HIS A 234 -7.779 -22.988 -14.368 1.00 23.64 H new ATOM 0 HB3 HIS A 234 -7.116 -24.226 -15.047 1.00 23.64 H new ATOM 0 HD2 HIS A 234 -7.183 -22.791 -11.724 1.00 41.68 H new ATOM 0 HE1 HIS A 234 -4.030 -25.183 -11.644 1.00 46.36 H new ATOM 0 HE2 HIS A 234 -5.503 -23.869 -10.343 1.00 43.86 H new ATOM 3390 N LEU A 235 -6.593 -22.771 -17.799 1.00 17.31 N ANISOU 3390 N LEU A 235 2388 1690 2500 530 -133 236 N ATOM 3391 CA LEU A 235 -7.268 -22.461 -19.056 1.00 16.92 C ANISOU 3391 CA LEU A 235 2312 1672 2446 531 11 143 C ATOM 3392 C LEU A 235 -8.246 -23.581 -19.400 1.00 17.28 C ANISOU 3392 C LEU A 235 2461 1636 2468 445 -11 183 C ATOM 3393 O LEU A 235 -7.857 -24.746 -19.502 1.00 21.25 O ANISOU 3393 O LEU A 235 3039 1943 3091 478 -129 198 O ATOM 3394 CB LEU A 235 -6.252 -22.287 -20.192 1.00 19.32 C ANISOU 3394 CB LEU A 235 2518 1959 2865 634 73 10 C ATOM 3395 CG LEU A 235 -6.855 -22.023 -21.586 1.00 19.58 C ANISOU 3395 CG LEU A 235 2543 2057 2839 583 194 -56 C ATOM 3396 CD1 LEU A 235 -7.698 -20.780 -21.629 1.00 17.85 C ANISOU 3396 CD1 LEU A 235 2338 1922 2521 518 227 4 C ATOM 3397 CD2 LEU A 235 -5.782 -21.966 -22.667 1.00 21.40 C ANISOU 3397 CD2 LEU A 235 2657 2367 3107 602 274 -205 C ATOM 0 H LEU A 235 -6.008 -23.399 -17.851 1.00 17.31 H new ATOM 0 HA LEU A 235 -7.752 -21.627 -18.951 1.00 16.92 H new ATOM 0 HB2 LEU A 235 -5.662 -21.551 -19.967 1.00 19.32 H new ATOM 0 HB3 LEU A 235 -5.704 -23.086 -20.240 1.00 19.32 H new ATOM 0 HG LEU A 235 -7.436 -22.778 -21.767 1.00 19.58 H new ATOM 0 HD11 LEU A 235 -8.052 -20.660 -22.524 1.00 17.85 H new ATOM 0 HD12 LEU A 235 -8.432 -20.864 -21.000 1.00 17.85 H new ATOM 0 HD13 LEU A 235 -7.155 -20.012 -21.391 1.00 17.85 H new ATOM 0 HD21 LEU A 235 -6.198 -21.799 -23.527 1.00 21.40 H new ATOM 0 HD22 LEU A 235 -5.157 -21.252 -22.466 1.00 21.40 H new ATOM 0 HD23 LEU A 235 -5.307 -22.811 -22.697 1.00 21.40 H new ATOM 3409 N TRP A 236 -9.504 -23.203 -19.561 1.00 16.98 N ANISOU 3409 N TRP A 236 2415 1735 2302 341 75 177 N ATOM 3410 CA TRP A 236 -10.559 -24.112 -20.002 1.00 16.10 C ANISOU 3410 CA TRP A 236 2370 1603 2143 218 79 190 C ATOM 3411 C TRP A 236 -10.909 -23.773 -21.447 1.00 16.28 C ANISOU 3411 C TRP A 236 2337 1667 2184 274 171 73 C ATOM 3412 O TRP A 236 -11.055 -22.604 -21.788 1.00 16.76 O ANISOU 3412 O TRP A 236 2316 1839 2213 329 219 36 O ATOM 3413 CB TRP A 236 -11.818 -23.947 -19.140 1.00 13.74 C ANISOU 3413 CB TRP A 236 2042 1524 1652 27 110 226 C ATOM 3414 CG TRP A 236 -11.725 -24.290 -17.709 1.00 13.92 C ANISOU 3414 CG TRP A 236 2128 1616 1547 -142 32 358 C ATOM 3415 CD1 TRP A 236 -10.618 -24.742 -17.021 1.00 14.81 C ANISOU 3415 CD1 TRP A 236 2348 1560 1719 -117 -119 496 C ATOM 3416 CD2 TRP A 236 -12.769 -24.215 -16.754 1.00 15.29 C ANISOU 3416 CD2 TRP A 236 2242 2094 1474 -395 82 362 C ATOM 3417 NE1 TRP A 236 -10.937 -24.941 -15.699 1.00 16.70 N ANISOU 3417 NE1 TRP A 236 2641 1972 1735 -369 -182 636 N ATOM 3418 CE2 TRP A 236 -12.258 -24.625 -15.514 1.00 17.00 C ANISOU 3418 CE2 TRP A 236 2566 2333 1560 -566 -34 540 C ATOM 3419 CE3 TRP A 236 -14.119 -23.836 -16.828 1.00 15.74 C ANISOU 3419 CE3 TRP A 236 2132 2458 1393 -508 208 202 C ATOM 3420 CZ2 TRP A 236 -13.025 -24.662 -14.368 1.00 19.17 C ANISOU 3420 CZ2 TRP A 236 2800 2964 1519 -898 2 573 C ATOM 3421 CZ3 TRP A 236 -14.863 -23.883 -15.698 1.00 17.89 C ANISOU 3421 CZ3 TRP A 236 2318 3086 1392 -797 259 180 C ATOM 3422 CH2 TRP A 236 -14.329 -24.275 -14.464 1.00 19.90 C ANISOU 3422 CH2 TRP A 236 2692 3405 1463 -1020 175 365 C ATOM 0 H TRP A 236 -9.777 -22.400 -19.416 1.00 16.98 H new ATOM 0 HA TRP A 236 -10.244 -25.026 -19.921 1.00 16.10 H new ATOM 0 HB2 TRP A 236 -12.105 -23.023 -19.206 1.00 13.74 H new ATOM 0 HB3 TRP A 236 -12.520 -24.491 -19.531 1.00 13.74 H new ATOM 0 HD1 TRP A 236 -9.780 -24.890 -17.396 1.00 14.81 H new ATOM 0 HE1 TRP A 236 -10.397 -25.218 -15.089 1.00 16.70 H new ATOM 0 HE3 TRP A 236 -14.493 -23.560 -17.633 1.00 15.74 H new ATOM 0 HZ2 TRP A 236 -12.665 -24.941 -13.557 1.00 19.17 H new ATOM 0 HZ3 TRP A 236 -15.761 -23.646 -15.743 1.00 17.89 H new ATOM 0 HH2 TRP A 236 -14.867 -24.271 -13.705 1.00 19.90 H new ATOM 3433 N LEU A 237 -11.120 -24.795 -22.280 1.00 17.40 N ANISOU 3433 N LEU A 237 2537 1709 2367 236 162 21 N ATOM 3434 CA LEU A 237 -11.547 -24.601 -23.651 1.00 16.83 C ANISOU 3434 CA LEU A 237 2418 1726 2251 234 237 -84 C ATOM 3435 C LEU A 237 -12.928 -25.199 -23.872 1.00 17.91 C ANISOU 3435 C LEU A 237 2578 1928 2301 80 233 -89 C ATOM 3436 O LEU A 237 -13.306 -26.207 -23.255 1.00 18.91 O ANISOU 3436 O LEU A 237 2796 1952 2436 -53 173 -35 O ATOM 3437 CB LEU A 237 -10.575 -25.227 -24.634 1.00 18.71 C ANISOU 3437 CB LEU A 237 2647 1878 2584 305 257 -237 C ATOM 3438 CG LEU A 237 -9.141 -24.743 -24.493 1.00 21.70 C ANISOU 3438 CG LEU A 237 2947 2253 3046 432 273 -285 C ATOM 3439 CD1 LEU A 237 -8.253 -25.571 -25.424 1.00 27.92 C ANISOU 3439 CD1 LEU A 237 3659 3012 3938 504 301 -540 C ATOM 3440 CD2 LEU A 237 -9.094 -23.288 -24.808 1.00 17.57 C ANISOU 3440 CD2 LEU A 237 2366 1910 2399 398 341 -216 C ATOM 0 H LEU A 237 -11.017 -25.619 -22.058 1.00 17.40 H new ATOM 0 HA LEU A 237 -11.575 -23.644 -23.807 1.00 16.83 H new ATOM 0 HB2 LEU A 237 -10.592 -26.190 -24.520 1.00 18.71 H new ATOM 0 HB3 LEU A 237 -10.880 -25.042 -25.536 1.00 18.71 H new ATOM 0 HG LEU A 237 -8.812 -24.859 -23.588 1.00 21.70 H new ATOM 0 HD11 LEU A 237 -7.333 -25.273 -25.344 1.00 27.92 H new ATOM 0 HD12 LEU A 237 -8.311 -26.508 -25.178 1.00 27.92 H new ATOM 0 HD13 LEU A 237 -8.551 -25.458 -26.340 1.00 27.92 H new ATOM 0 HD21 LEU A 237 -8.183 -22.967 -24.721 1.00 17.57 H new ATOM 0 HD22 LEU A 237 -9.402 -23.143 -25.716 1.00 17.57 H new ATOM 0 HD23 LEU A 237 -9.666 -22.805 -24.192 1.00 17.57 H new ATOM 3452 N VAL A 238 -13.711 -24.540 -24.746 1.00 17.39 N ANISOU 3452 N VAL A 238 2433 2036 2139 68 268 -134 N ATOM 3453 CA VAL A 238 -14.978 -25.086 -25.208 1.00 18.34 C ANISOU 3453 CA VAL A 238 2532 2263 2175 -73 263 -182 C ATOM 3454 C VAL A 238 -14.911 -25.236 -26.724 1.00 19.10 C ANISOU 3454 C VAL A 238 2629 2403 2224 -79 280 -282 C ATOM 3455 O VAL A 238 -14.154 -24.543 -27.411 1.00 19.22 O ANISOU 3455 O VAL A 238 2632 2457 2214 -5 300 -284 O ATOM 3456 CB VAL A 238 -16.186 -24.234 -24.807 1.00 17.92 C ANISOU 3456 CB VAL A 238 2331 2438 2039 -87 246 -186 C ATOM 3457 CG1 VAL A 238 -16.301 -24.175 -23.289 1.00 17.76 C ANISOU 3457 CG1 VAL A 238 2277 2472 1999 -144 263 -148 C ATOM 3458 CG2 VAL A 238 -16.102 -22.826 -25.391 1.00 18.18 C ANISOU 3458 CG2 VAL A 238 2294 2526 2089 81 185 -178 C ATOM 0 H VAL A 238 -13.515 -23.771 -25.079 1.00 17.39 H new ATOM 0 HA VAL A 238 -15.108 -25.946 -24.780 1.00 18.34 H new ATOM 0 HB VAL A 238 -16.981 -24.653 -25.171 1.00 17.92 H new ATOM 0 HG11 VAL A 238 -17.068 -23.634 -23.043 1.00 17.76 H new ATOM 0 HG12 VAL A 238 -16.413 -25.072 -22.938 1.00 17.76 H new ATOM 0 HG13 VAL A 238 -15.496 -23.781 -22.918 1.00 17.76 H new ATOM 0 HG21 VAL A 238 -16.880 -22.315 -25.118 1.00 18.18 H new ATOM 0 HG22 VAL A 238 -15.299 -22.389 -25.067 1.00 18.18 H new ATOM 0 HG23 VAL A 238 -16.073 -22.878 -26.359 1.00 18.18 H new ATOM 3468 N ASP A 239 -15.748 -26.112 -27.263 1.00 19.89 N ANISOU 3468 N ASP A 239 2740 2543 2275 -221 273 -367 N ATOM 3469 CA ASP A 239 -15.745 -26.364 -28.685 1.00 20.28 C ANISOU 3469 CA ASP A 239 2784 2682 2239 -268 292 -497 C ATOM 3470 C ASP A 239 -16.453 -25.205 -29.378 1.00 23.13 C ANISOU 3470 C ASP A 239 3054 3284 2449 -259 232 -423 C ATOM 3471 O ASP A 239 -17.685 -25.074 -29.305 1.00 25.97 O ANISOU 3471 O ASP A 239 3327 3779 2762 -309 164 -415 O ATOM 3472 CB ASP A 239 -16.426 -27.680 -29.018 1.00 21.64 C ANISOU 3472 CB ASP A 239 3003 2800 2417 -435 278 -633 C ATOM 3473 CG ASP A 239 -16.099 -28.139 -30.434 1.00 34.78 C ANISOU 3473 CG ASP A 239 4664 4542 4009 -477 317 -851 C ATOM 3474 OD1 ASP A 239 -15.393 -29.156 -30.606 1.00 45.16 O ANISOU 3474 OD1 ASP A 239 6039 5656 5464 -459 329 -1049 O ATOM 3475 OD2 ASP A 239 -16.531 -27.454 -31.366 1.00 41.59 O ANISOU 3475 OD2 ASP A 239 5455 5672 4675 -526 311 -838 O ATOM 0 H ASP A 239 -16.325 -26.569 -26.818 1.00 19.89 H new ATOM 0 HA ASP A 239 -14.829 -26.432 -28.996 1.00 20.28 H new ATOM 0 HB2 ASP A 239 -16.146 -28.359 -28.384 1.00 21.64 H new ATOM 0 HB3 ASP A 239 -17.386 -27.581 -28.923 1.00 21.64 H new ATOM 3480 N ALA A 240 -15.685 -24.370 -30.065 1.00 21.46 N ANISOU 3480 N ALA A 240 2857 3132 2164 -216 228 -367 N ATOM 3481 CA ALA A 240 -16.209 -23.249 -30.807 1.00 19.96 C ANISOU 3481 CA ALA A 240 2643 3097 1843 -228 92 -237 C ATOM 3482 C ALA A 240 -15.113 -22.681 -31.676 1.00 20.47 C ANISOU 3482 C ALA A 240 2774 3236 1769 -308 116 -172 C ATOM 3483 O ALA A 240 -13.936 -22.692 -31.260 1.00 21.28 O ANISOU 3483 O ALA A 240 2891 3251 1945 -268 229 -204 O ATOM 3484 CB ALA A 240 -16.745 -22.185 -29.855 1.00 18.29 C ANISOU 3484 CB ALA A 240 2372 2816 1761 -69 -35 -121 C ATOM 0 H ALA A 240 -14.830 -24.446 -30.110 1.00 21.46 H new ATOM 0 HA ALA A 240 -16.943 -23.545 -31.367 1.00 19.96 H new ATOM 0 HB1 ALA A 240 -17.094 -21.438 -30.367 1.00 18.29 H new ATOM 0 HB2 ALA A 240 -17.454 -22.564 -29.312 1.00 18.29 H new ATOM 0 HB3 ALA A 240 -16.029 -21.875 -29.279 1.00 18.29 H new ATOM 3490 N PRO A 241 -15.437 -22.181 -32.877 1.00 22.00 N ANISOU 3490 N PRO A 241 2998 3625 1735 -456 2 -77 N ATOM 3491 CA PRO A 241 -14.388 -21.603 -33.734 1.00 25.30 C ANISOU 3491 CA PRO A 241 3483 4188 1940 -639 31 13 C ATOM 3492 C PRO A 241 -14.021 -20.169 -33.376 1.00 28.68 C ANISOU 3492 C PRO A 241 4002 4472 2425 -608 -131 296 C ATOM 3493 O PRO A 241 -12.975 -19.695 -33.833 1.00 34.15 O ANISOU 3493 O PRO A 241 4749 5267 2959 -796 -77 379 O ATOM 3494 CB PRO A 241 -15.002 -21.691 -35.131 1.00 27.28 C ANISOU 3494 CB PRO A 241 3758 4730 1877 -872 -64 37 C ATOM 3495 CG PRO A 241 -16.466 -21.560 -34.881 1.00 27.50 C ANISOU 3495 CG PRO A 241 3751 4678 2019 -734 -280 108 C ATOM 3496 CD PRO A 241 -16.717 -22.278 -33.580 1.00 24.08 C ANISOU 3496 CD PRO A 241 3227 4040 1881 -522 -152 -66 C ATOM 0 HA PRO A 241 -13.547 -22.077 -33.641 1.00 25.30 H new ATOM 0 HB2 PRO A 241 -14.674 -20.985 -35.710 1.00 27.28 H new ATOM 0 HB3 PRO A 241 -14.788 -22.533 -35.562 1.00 27.28 H new ATOM 0 HG2 PRO A 241 -16.728 -20.628 -34.822 1.00 27.50 H new ATOM 0 HG3 PRO A 241 -16.980 -21.954 -35.603 1.00 27.50 H new ATOM 0 HD2 PRO A 241 -17.433 -21.861 -33.075 1.00 24.08 H new ATOM 0 HD3 PRO A 241 -16.974 -23.202 -33.727 1.00 24.08 H new ATOM 3504 N THR A 242 -14.837 -19.467 -32.586 1.00 26.57 N ANISOU 3504 N THR A 242 3731 3987 2375 -396 -331 410 N ATOM 3505 CA THR A 242 -14.577 -18.084 -32.233 1.00 25.14 C ANISOU 3505 CA THR A 242 3645 3600 2308 -339 -538 637 C ATOM 3506 C THR A 242 -15.040 -17.816 -30.808 1.00 23.33 C ANISOU 3506 C THR A 242 3317 3147 2399 -37 -574 537 C ATOM 3507 O THR A 242 -15.841 -18.568 -30.247 1.00 23.31 O ANISOU 3507 O THR A 242 3179 3198 2481 85 -495 352 O ATOM 3508 CB THR A 242 -15.300 -17.125 -33.164 1.00 25.76 C ANISOU 3508 CB THR A 242 3840 3663 2286 -425 -904 901 C ATOM 3509 OG1 THR A 242 -16.710 -17.321 -33.015 1.00 24.77 O ANISOU 3509 OG1 THR A 242 3587 3536 2290 -219 -1064 799 O ATOM 3510 CG2 THR A 242 -14.898 -17.361 -34.619 1.00 26.23 C ANISOU 3510 CG2 THR A 242 4001 4030 1936 -804 -878 1019 C ATOM 0 H THR A 242 -15.557 -19.787 -32.242 1.00 26.57 H new ATOM 0 HA THR A 242 -13.621 -17.938 -32.313 1.00 25.14 H new ATOM 0 HB THR A 242 -15.057 -16.215 -32.932 1.00 25.76 H new ATOM 0 HG1 THR A 242 -17.119 -16.859 -33.585 1.00 24.77 H new ATOM 0 HG21 THR A 242 -15.372 -16.738 -35.191 1.00 26.23 H new ATOM 0 HG22 THR A 242 -13.942 -17.226 -34.717 1.00 26.23 H new ATOM 0 HG23 THR A 242 -15.124 -18.269 -34.874 1.00 26.23 H new ATOM 3518 N ARG A 243 -14.553 -16.702 -30.235 1.00 24.07 N ANISOU 3518 N ARG A 243 4050 2571 2525 121 859 -43 N ATOM 3519 CA ARG A 243 -14.996 -16.308 -28.906 1.00 25.91 C ANISOU 3519 CA ARG A 243 4020 2838 2987 124 646 -62 C ATOM 3520 C ARG A 243 -16.489 -16.079 -28.846 1.00 27.18 C ANISOU 3520 C ARG A 243 4166 3114 3048 -14 406 -74 C ATOM 3521 O ARG A 243 -17.146 -16.457 -27.867 1.00 28.69 O ANISOU 3521 O ARG A 243 4292 3303 3307 -37 300 -145 O ATOM 3522 CB ARG A 243 -14.288 -15.023 -28.454 1.00 25.79 C ANISOU 3522 CB ARG A 243 3735 2808 3258 210 618 69 C ATOM 3523 CG ARG A 243 -12.973 -15.255 -27.825 1.00 26.32 C ANISOU 3523 CG ARG A 243 3676 2777 3548 302 728 139 C ATOM 3524 CD ARG A 243 -12.262 -13.950 -27.463 1.00 24.42 C ANISOU 3524 CD ARG A 243 3199 2509 3571 311 647 284 C ATOM 3525 NE ARG A 243 -10.848 -14.135 -27.625 1.00 25.19 N ANISOU 3525 NE ARG A 243 3169 2533 3870 399 807 486 N ATOM 3526 CZ ARG A 243 -9.930 -13.158 -27.550 1.00 25.51 C ANISOU 3526 CZ ARG A 243 2988 2531 4175 396 767 691 C ATOM 3527 NH1 ARG A 243 -10.290 -11.920 -27.255 1.00 26.68 N ANISOU 3527 NH1 ARG A 243 3072 2674 4391 299 582 659 N ATOM 3528 NH2 ARG A 243 -8.681 -13.446 -27.750 1.00 27.85 N ANISOU 3528 NH2 ARG A 243 3124 2764 4695 487 934 950 N ATOM 0 H ARG A 243 -13.977 -16.176 -30.598 1.00 24.07 H new ATOM 0 HA ARG A 243 -14.769 -17.042 -28.314 1.00 25.91 H new ATOM 0 HB2 ARG A 243 -14.172 -14.441 -29.221 1.00 25.79 H new ATOM 0 HB3 ARG A 243 -14.859 -14.553 -27.826 1.00 25.79 H new ATOM 0 HG2 ARG A 243 -13.090 -15.790 -27.024 1.00 26.32 H new ATOM 0 HG3 ARG A 243 -12.414 -15.768 -28.429 1.00 26.32 H new ATOM 0 HD2 ARG A 243 -12.574 -13.228 -28.031 1.00 24.42 H new ATOM 0 HD3 ARG A 243 -12.466 -13.699 -26.548 1.00 24.42 H new ATOM 0 HE ARG A 243 -10.567 -14.933 -27.782 1.00 25.19 H new ATOM 0 HH11 ARG A 243 -11.117 -11.736 -27.110 1.00 26.68 H new ATOM 0 HH12 ARG A 243 -9.697 -11.299 -27.209 1.00 26.68 H new ATOM 0 HH21 ARG A 243 -8.449 -14.255 -27.928 1.00 27.85 H new ATOM 0 HH22 ARG A 243 -8.085 -12.828 -27.704 1.00 27.85 H new ATOM 3542 N ILE A 244 -17.036 -15.400 -29.851 1.00 27.22 N ANISOU 3542 N ILE A 244 4188 3226 2930 -97 323 56 N ATOM 3543 CA ILE A 244 -18.454 -15.081 -29.829 1.00 27.24 C ANISOU 3543 CA ILE A 244 4083 3345 2922 -222 94 167 C ATOM 3544 C ILE A 244 -19.270 -16.348 -29.871 1.00 26.08 C ANISOU 3544 C ILE A 244 4126 3224 2560 -400 -27 75 C ATOM 3545 O ILE A 244 -20.264 -16.489 -29.161 1.00 23.82 O ANISOU 3545 O ILE A 244 3693 2967 2390 -443 -168 124 O ATOM 3546 CB ILE A 244 -18.822 -14.138 -30.993 1.00 38.27 C ANISOU 3546 CB ILE A 244 5427 4876 4240 -300 10 409 C ATOM 3547 CG1 ILE A 244 -18.430 -12.705 -30.635 1.00 47.85 C ANISOU 3547 CG1 ILE A 244 6360 6035 5785 -128 93 539 C ATOM 3548 CG2 ILE A 244 -20.318 -14.232 -31.287 1.00 38.76 C ANISOU 3548 CG2 ILE A 244 5418 5087 4221 -504 -257 602 C ATOM 3549 CD1 ILE A 244 -18.527 -11.733 -31.790 1.00 56.01 C ANISOU 3549 CD1 ILE A 244 7312 7180 6789 -159 67 806 C ATOM 0 H ILE A 244 -16.609 -15.120 -30.543 1.00 27.22 H new ATOM 0 HA ILE A 244 -18.657 -14.616 -29.002 1.00 27.24 H new ATOM 0 HB ILE A 244 -18.337 -14.403 -31.790 1.00 38.27 H new ATOM 0 HG12 ILE A 244 -19.000 -12.394 -29.914 1.00 47.85 H new ATOM 0 HG13 ILE A 244 -17.520 -12.703 -30.298 1.00 47.85 H new ATOM 0 HG21 ILE A 244 -20.542 -13.637 -32.019 1.00 38.76 H new ATOM 0 HG22 ILE A 244 -20.543 -15.143 -31.531 1.00 38.76 H new ATOM 0 HG23 ILE A 244 -20.820 -13.976 -30.498 1.00 38.76 H new ATOM 0 HD11 ILE A 244 -18.265 -10.848 -31.491 1.00 56.01 H new ATOM 0 HD12 ILE A 244 -17.938 -12.020 -32.505 1.00 56.01 H new ATOM 0 HD13 ILE A 244 -19.441 -11.707 -32.115 1.00 56.01 H new ATOM 3561 N LYS A 245 -18.879 -17.312 -30.722 1.00 26.50 N ANISOU 3561 N LYS A 245 4536 3236 2298 -516 57 -50 N ATOM 3562 CA LYS A 245 -19.618 -18.560 -30.778 1.00 25.70 C ANISOU 3562 CA LYS A 245 4669 3111 1984 -729 -58 -162 C ATOM 3563 C LYS A 245 -19.443 -19.391 -29.522 1.00 22.39 C ANISOU 3563 C LYS A 245 4181 2562 1765 -605 37 -315 C ATOM 3564 O LYS A 245 -20.300 -20.222 -29.205 1.00 23.29 O ANISOU 3564 O LYS A 245 4343 2668 1837 -753 -104 -351 O ATOM 3565 CB LYS A 245 -19.194 -19.345 -32.021 1.00 24.12 C ANISOU 3565 CB LYS A 245 4954 2833 1380 -891 71 -289 C ATOM 3566 CG LYS A 245 -19.815 -18.782 -33.283 1.00 26.98 C ANISOU 3566 CG LYS A 245 5391 3365 1495 -1124 -147 -107 C ATOM 3567 CD LYS A 245 -19.395 -19.486 -34.554 1.00 33.08 C ANISOU 3567 CD LYS A 245 6540 4016 2014 -1234 5 -219 C ATOM 3568 CE LYS A 245 -20.131 -18.894 -35.745 1.00 41.82 C ANISOU 3568 CE LYS A 245 7697 5317 2874 -1501 -265 -23 C ATOM 3569 NZ LYS A 245 -19.323 -18.904 -37.003 1.00 51.98 N ANISOU 3569 NZ LYS A 245 9318 6532 3899 -1498 -37 -86 N ATOM 0 H LYS A 245 -18.207 -17.256 -31.256 1.00 26.50 H new ATOM 0 HA LYS A 245 -20.563 -18.349 -30.835 1.00 25.70 H new ATOM 0 HB2 LYS A 245 -18.227 -19.327 -32.101 1.00 24.12 H new ATOM 0 HB3 LYS A 245 -19.453 -20.274 -31.920 1.00 24.12 H new ATOM 0 HG2 LYS A 245 -20.781 -18.829 -33.204 1.00 26.98 H new ATOM 0 HG3 LYS A 245 -19.582 -17.843 -33.354 1.00 26.98 H new ATOM 0 HD2 LYS A 245 -18.437 -19.398 -34.680 1.00 33.08 H new ATOM 0 HD3 LYS A 245 -19.586 -20.435 -34.485 1.00 33.08 H new ATOM 0 HE2 LYS A 245 -20.951 -19.391 -35.891 1.00 41.82 H new ATOM 0 HE3 LYS A 245 -20.386 -17.981 -35.539 1.00 41.82 H new ATOM 0 HZ1 LYS A 245 -19.800 -18.548 -37.665 1.00 51.98 H new ATOM 0 HZ2 LYS A 245 -18.581 -18.428 -36.883 1.00 51.98 H new ATOM 0 HZ3 LYS A 245 -19.107 -19.742 -37.211 1.00 51.98 H new ATOM 3583 N ALA A 246 -18.353 -19.203 -28.790 1.00 20.72 N ANISOU 3583 N ALA A 246 3839 2255 1778 -362 250 -366 N ATOM 3584 CA ALA A 246 -18.199 -19.903 -27.531 1.00 19.70 C ANISOU 3584 CA ALA A 246 3608 2043 1836 -262 302 -450 C ATOM 3585 C ALA A 246 -19.299 -19.509 -26.536 1.00 17.68 C ANISOU 3585 C ALA A 246 3105 1876 1736 -274 99 -376 C ATOM 3586 O ALA A 246 -19.598 -20.269 -25.628 1.00 19.76 O ANISOU 3586 O ALA A 246 3334 2099 2074 -258 92 -430 O ATOM 3587 CB ALA A 246 -16.824 -19.613 -26.933 1.00 21.70 C ANISOU 3587 CB ALA A 246 3720 2219 2306 -53 492 -427 C ATOM 0 H ALA A 246 -17.702 -18.682 -29.002 1.00 20.72 H new ATOM 0 HA ALA A 246 -18.278 -20.854 -27.706 1.00 19.70 H new ATOM 0 HB1 ALA A 246 -16.731 -20.086 -26.091 1.00 21.70 H new ATOM 0 HB2 ALA A 246 -16.135 -19.909 -27.548 1.00 21.70 H new ATOM 0 HB3 ALA A 246 -16.732 -18.660 -26.780 1.00 21.70 H new ATOM 3593 N ALA A 247 -19.896 -18.336 -26.712 1.00 18.39 N ANISOU 3593 N ALA A 247 3025 2065 1897 -280 -16 -224 N ATOM 3594 CA ALA A 247 -21.006 -17.966 -25.838 1.00 18.69 C ANISOU 3594 CA ALA A 247 2849 2140 2110 -260 -113 -112 C ATOM 3595 C ALA A 247 -22.162 -18.939 -25.945 1.00 18.81 C ANISOU 3595 C ALA A 247 2892 2200 2057 -433 -272 -49 C ATOM 3596 O ALA A 247 -22.977 -19.030 -25.012 1.00 19.37 O ANISOU 3596 O ALA A 247 2798 2265 2298 -384 -290 36 O ATOM 3597 CB ALA A 247 -21.467 -16.547 -26.194 1.00 22.07 C ANISOU 3597 CB ALA A 247 3091 2627 2670 -225 -145 98 C ATOM 0 H ALA A 247 -19.684 -17.756 -27.310 1.00 18.39 H new ATOM 0 HA ALA A 247 -20.696 -17.996 -24.919 1.00 18.69 H new ATOM 0 HB1 ALA A 247 -22.205 -16.292 -25.618 1.00 22.07 H new ATOM 0 HB2 ALA A 247 -20.731 -15.927 -26.070 1.00 22.07 H new ATOM 0 HB3 ALA A 247 -21.757 -16.523 -27.119 1.00 22.07 H new ATOM 3603 N GLY A 248 -22.251 -19.726 -27.023 1.00 19.04 N ANISOU 3603 N GLY A 248 3158 2247 1828 -653 -376 -87 N ATOM 3604 CA GLY A 248 -23.245 -20.774 -27.095 1.00 19.94 C ANISOU 3604 CA GLY A 248 3341 2368 1866 -879 -559 -48 C ATOM 3605 C GLY A 248 -23.007 -21.933 -26.159 1.00 18.49 C ANISOU 3605 C GLY A 248 3228 2050 1747 -809 -436 -226 C ATOM 3606 O GLY A 248 -23.887 -22.793 -26.008 1.00 22.73 O ANISOU 3606 O GLY A 248 3773 2573 2292 -976 -579 -175 O ATOM 0 H GLY A 248 -21.743 -19.662 -27.714 1.00 19.04 H new ATOM 0 HA2 GLY A 248 -24.115 -20.392 -26.902 1.00 19.94 H new ATOM 0 HA3 GLY A 248 -23.278 -21.110 -28.004 1.00 19.94 H new ATOM 3610 N ARG A 249 -21.848 -21.959 -25.492 1.00 19.03 N ANISOU 3610 N ARG A 249 3310 2027 1895 -578 -195 -382 N ATOM 3611 CA ARG A 249 -21.492 -23.036 -24.588 1.00 22.76 C ANISOU 3611 CA ARG A 249 3814 2384 2451 -495 -64 -496 C ATOM 3612 C ARG A 249 -21.517 -22.577 -23.139 1.00 19.48 C ANISOU 3612 C ARG A 249 3142 2008 2252 -298 -22 -435 C ATOM 3613 O ARG A 249 -20.977 -23.266 -22.259 1.00 20.02 O ANISOU 3613 O ARG A 249 3197 2014 2394 -199 90 -490 O ATOM 3614 CB ARG A 249 -20.100 -23.593 -24.924 1.00 33.38 C ANISOU 3614 CB ARG A 249 5309 3617 3757 -388 181 -608 C ATOM 3615 CG ARG A 249 -19.975 -24.361 -26.242 1.00 52.89 C ANISOU 3615 CG ARG A 249 8040 6024 6032 -523 244 -647 C ATOM 3616 CD ARG A 249 -21.258 -25.067 -26.657 1.00 75.36 C ANISOU 3616 CD ARG A 249 11016 8872 8743 -786 40 -639 C ATOM 3617 NE ARG A 249 -21.631 -26.144 -25.747 1.00 98.33 N ANISOU 3617 NE ARG A 249 13864 11704 11794 -774 54 -661 N ATOM 3618 CZ ARG A 249 -22.783 -26.808 -25.802 1.00119.42 C ANISOU 3618 CZ ARG A 249 16580 14366 14428 -995 -141 -622 C ATOM 3619 NH1 ARG A 249 -23.687 -26.503 -26.723 1.00128.99 N ANISOU 3619 NH1 ARG A 249 17874 15670 15467 -1260 -396 -521 N ATOM 3620 NH2 ARG A 249 -23.033 -27.773 -24.930 1.00124.74 N ANISOU 3620 NH2 ARG A 249 17192 14946 15258 -966 -100 -638 N ATOM 0 H ARG A 249 -21.249 -21.345 -25.557 1.00 19.03 H new ATOM 0 HA ARG A 249 -22.153 -23.736 -24.702 1.00 22.76 H new ATOM 0 HB2 ARG A 249 -19.473 -22.853 -24.942 1.00 33.38 H new ATOM 0 HB3 ARG A 249 -19.825 -24.180 -24.203 1.00 33.38 H new ATOM 0 HG2 ARG A 249 -19.712 -23.745 -26.943 1.00 52.89 H new ATOM 0 HG3 ARG A 249 -19.265 -25.017 -26.160 1.00 52.89 H new ATOM 0 HD2 ARG A 249 -21.979 -24.420 -26.698 1.00 75.36 H new ATOM 0 HD3 ARG A 249 -21.149 -25.428 -27.551 1.00 75.36 H new ATOM 0 HE ARG A 249 -21.069 -26.365 -25.134 1.00 98.33 H new ATOM 0 HH11 ARG A 249 -23.530 -25.874 -27.288 1.00128.99 H new ATOM 0 HH12 ARG A 249 -24.430 -26.934 -26.755 1.00128.99 H new ATOM 0 HH21 ARG A 249 -22.451 -27.970 -24.328 1.00124.74 H new ATOM 0 HH22 ARG A 249 -23.777 -28.202 -24.965 1.00124.74 H new ATOM 3634 N LEU A 250 -22.175 -21.455 -22.848 1.00 17.96 N ANISOU 3634 N LEU A 250 2767 1902 2156 -248 -87 -301 N ATOM 3635 CA LEU A 250 -22.088 -20.891 -21.503 1.00 16.79 C ANISOU 3635 CA LEU A 250 2496 1745 2138 -77 11 -290 C ATOM 3636 C LEU A 250 -22.756 -21.785 -20.466 1.00 19.43 C ANISOU 3636 C LEU A 250 2774 2063 2545 -50 32 -252 C ATOM 3637 O LEU A 250 -22.250 -21.932 -19.347 1.00 21.16 O ANISOU 3637 O LEU A 250 3002 2264 2775 51 124 -307 O ATOM 3638 CB LEU A 250 -22.668 -19.473 -21.519 1.00 17.67 C ANISOU 3638 CB LEU A 250 2486 1880 2349 -17 27 -159 C ATOM 3639 CG LEU A 250 -22.493 -18.635 -20.276 1.00 20.31 C ANISOU 3639 CG LEU A 250 2819 2147 2753 128 179 -195 C ATOM 3640 CD1 LEU A 250 -21.040 -18.537 -19.858 1.00 22.49 C ANISOU 3640 CD1 LEU A 250 3212 2397 2938 137 193 -360 C ATOM 3641 CD2 LEU A 250 -23.092 -17.243 -20.543 1.00 21.87 C ANISOU 3641 CD2 LEU A 250 2925 2301 3083 191 262 -53 C ATOM 0 H LEU A 250 -22.666 -21.015 -23.400 1.00 17.96 H new ATOM 0 HA LEU A 250 -21.157 -20.841 -21.237 1.00 16.79 H new ATOM 0 HB2 LEU A 250 -22.268 -18.994 -22.262 1.00 17.67 H new ATOM 0 HB3 LEU A 250 -23.618 -19.540 -21.704 1.00 17.67 H new ATOM 0 HG LEU A 250 -22.958 -19.059 -19.538 1.00 20.31 H new ATOM 0 HD11 LEU A 250 -20.969 -17.992 -19.058 1.00 22.49 H new ATOM 0 HD12 LEU A 250 -20.695 -19.425 -19.676 1.00 22.49 H new ATOM 0 HD13 LEU A 250 -20.524 -18.131 -20.572 1.00 22.49 H new ATOM 0 HD21 LEU A 250 -22.989 -16.689 -19.753 1.00 21.87 H new ATOM 0 HD22 LEU A 250 -22.631 -16.830 -21.290 1.00 21.87 H new ATOM 0 HD23 LEU A 250 -24.035 -17.331 -20.754 1.00 21.87 H new ATOM 3653 N ALA A 251 -23.889 -22.426 -20.808 1.00 21.39 N ANISOU 3653 N ALA A 251 2960 2326 2842 -167 -75 -125 N ATOM 3654 CA ALA A 251 -24.508 -23.336 -19.856 1.00 22.53 C ANISOU 3654 CA ALA A 251 3028 2444 3087 -137 -42 -59 C ATOM 3655 C ALA A 251 -23.583 -24.509 -19.533 1.00 21.39 C ANISOU 3655 C ALA A 251 3010 2231 2885 -131 23 -216 C ATOM 3656 O ALA A 251 -23.452 -24.909 -18.367 1.00 21.90 O ANISOU 3656 O ALA A 251 3024 2292 3005 -18 119 -199 O ATOM 3657 CB ALA A 251 -25.832 -23.865 -20.417 1.00 24.23 C ANISOU 3657 CB ALA A 251 3131 2678 3396 -319 -218 149 C ATOM 0 H ALA A 251 -24.295 -22.346 -21.562 1.00 21.39 H new ATOM 0 HA ALA A 251 -24.676 -22.843 -19.038 1.00 22.53 H new ATOM 0 HB1 ALA A 251 -26.237 -24.470 -19.776 1.00 24.23 H new ATOM 0 HB2 ALA A 251 -26.433 -23.122 -20.584 1.00 24.23 H new ATOM 0 HB3 ALA A 251 -25.666 -24.338 -21.247 1.00 24.23 H new ATOM 3663 N GLU A 252 -22.921 -25.056 -20.551 1.00 22.07 N ANISOU 3663 N GLU A 252 3275 2249 2863 -243 11 -342 N ATOM 3664 CA GLU A 252 -21.965 -26.140 -20.324 1.00 28.67 C ANISOU 3664 CA GLU A 252 4215 2970 3709 -200 157 -441 C ATOM 3665 C GLU A 252 -20.837 -25.675 -19.408 1.00 22.06 C ANISOU 3665 C GLU A 252 3287 2179 2915 -20 263 -430 C ATOM 3666 O GLU A 252 -20.400 -26.425 -18.536 1.00 21.26 O ANISOU 3666 O GLU A 252 3123 2055 2900 55 345 -377 O ATOM 3667 CB GLU A 252 -21.418 -26.623 -21.668 1.00 47.05 C ANISOU 3667 CB GLU A 252 6810 5166 5902 -324 220 -574 C ATOM 3668 CG GLU A 252 -20.304 -27.654 -21.571 1.00 69.82 C ANISOU 3668 CG GLU A 252 9729 7946 8854 -212 441 -586 C ATOM 3669 CD GLU A 252 -19.439 -27.697 -22.819 1.00 86.40 C ANISOU 3669 CD GLU A 252 11982 10010 10835 -221 566 -621 C ATOM 3670 OE1 GLU A 252 -19.997 -27.673 -23.936 1.00 92.38 O ANISOU 3670 OE1 GLU A 252 12930 10761 11408 -390 483 -683 O ATOM 3671 OE2 GLU A 252 -18.201 -27.745 -22.678 1.00 90.95 O ANISOU 3671 OE2 GLU A 252 12498 10552 11506 -76 756 -555 O ATOM 0 H GLU A 252 -23.009 -24.818 -21.373 1.00 22.07 H new ATOM 0 HA GLU A 252 -22.414 -26.879 -19.885 1.00 28.67 H new ATOM 0 HB2 GLU A 252 -22.148 -27.002 -22.182 1.00 47.05 H new ATOM 0 HB3 GLU A 252 -21.090 -25.856 -22.163 1.00 47.05 H new ATOM 0 HG2 GLU A 252 -19.747 -27.453 -20.802 1.00 69.82 H new ATOM 0 HG3 GLU A 252 -20.691 -28.530 -21.419 1.00 69.82 H new ATOM 3678 N VAL A 253 -20.378 -24.430 -19.570 1.00 19.04 N ANISOU 3678 N VAL A 253 2886 1868 2481 19 234 -443 N ATOM 3679 CA VAL A 253 -19.346 -23.898 -18.697 1.00 18.30 C ANISOU 3679 CA VAL A 253 2724 1821 2408 108 260 -410 C ATOM 3680 C VAL A 253 -19.876 -23.785 -17.268 1.00 17.80 C ANISOU 3680 C VAL A 253 2603 1826 2334 148 234 -355 C ATOM 3681 O VAL A 253 -19.160 -24.096 -16.304 1.00 18.39 O ANISOU 3681 O VAL A 253 2641 1940 2408 169 233 -288 O ATOM 3682 CB VAL A 253 -18.825 -22.558 -19.224 1.00 18.84 C ANISOU 3682 CB VAL A 253 2806 1918 2434 105 224 -438 C ATOM 3683 CG1 VAL A 253 -17.935 -21.898 -18.193 1.00 18.63 C ANISOU 3683 CG1 VAL A 253 2732 1937 2408 118 179 -393 C ATOM 3684 CG2 VAL A 253 -18.048 -22.741 -20.502 1.00 20.83 C ANISOU 3684 CG2 VAL A 253 3128 2103 2684 94 305 -459 C ATOM 0 H VAL A 253 -20.653 -23.886 -20.177 1.00 19.04 H new ATOM 0 HA VAL A 253 -18.593 -24.510 -18.686 1.00 18.30 H new ATOM 0 HB VAL A 253 -19.594 -21.994 -19.402 1.00 18.84 H new ATOM 0 HG11 VAL A 253 -17.612 -21.051 -18.539 1.00 18.63 H new ATOM 0 HG12 VAL A 253 -18.441 -21.743 -17.380 1.00 18.63 H new ATOM 0 HG13 VAL A 253 -17.181 -22.476 -17.999 1.00 18.63 H new ATOM 0 HG21 VAL A 253 -17.730 -21.879 -20.814 1.00 20.83 H new ATOM 0 HG22 VAL A 253 -17.291 -23.325 -20.340 1.00 20.83 H new ATOM 0 HG23 VAL A 253 -18.622 -23.136 -21.176 1.00 20.83 H new ATOM 3694 N GLY A 254 -21.134 -23.379 -17.111 1.00 18.10 N ANISOU 3694 N GLY A 254 2631 1876 2370 157 229 -338 N ATOM 3695 CA GLY A 254 -21.733 -23.334 -15.781 1.00 16.09 C ANISOU 3695 CA GLY A 254 2370 1649 2094 222 290 -277 C ATOM 3696 C GLY A 254 -21.730 -24.703 -15.107 1.00 17.24 C ANISOU 3696 C GLY A 254 2456 1805 2288 238 313 -199 C ATOM 3697 O GLY A 254 -21.540 -24.794 -13.888 1.00 16.38 O ANISOU 3697 O GLY A 254 2374 1751 2100 275 346 -147 O ATOM 0 H GLY A 254 -21.651 -23.129 -17.752 1.00 18.10 H new ATOM 0 HA2 GLY A 254 -21.247 -22.702 -15.229 1.00 16.09 H new ATOM 0 HA3 GLY A 254 -22.645 -23.009 -15.848 1.00 16.09 H new ATOM 3701 N ARG A 255 -21.982 -25.772 -15.869 1.00 19.36 N ANISOU 3701 N ARG A 255 2677 2009 2668 190 300 -185 N ATOM 3702 CA ARG A 255 -21.919 -27.096 -15.271 1.00 24.07 C ANISOU 3702 CA ARG A 255 3212 2576 3357 212 353 -100 C ATOM 3703 C ARG A 255 -20.525 -27.412 -14.771 1.00 20.49 C ANISOU 3703 C ARG A 255 2735 2149 2900 248 383 -52 C ATOM 3704 O ARG A 255 -20.358 -28.099 -13.738 1.00 20.41 O ANISOU 3704 O ARG A 255 2642 2186 2926 292 414 88 O ATOM 3705 CB ARG A 255 -22.344 -28.169 -16.292 1.00 37.80 C ANISOU 3705 CB ARG A 255 4982 4176 5206 109 352 -129 C ATOM 3706 CG ARG A 255 -23.815 -28.239 -16.557 1.00 56.60 C ANISOU 3706 CG ARG A 255 7308 6547 7651 20 262 -55 C ATOM 3707 CD ARG A 255 -24.204 -29.651 -16.981 1.00 73.42 C ANISOU 3707 CD ARG A 255 9476 8524 9895 -114 251 -44 C ATOM 3708 NE ARG A 255 -23.415 -30.130 -18.111 1.00 84.99 N ANISOU 3708 NE ARG A 255 11173 9836 11285 -225 295 -221 N ATOM 3709 CZ ARG A 255 -23.558 -29.695 -19.360 1.00 94.96 C ANISOU 3709 CZ ARG A 255 12610 11073 12399 -393 188 -330 C ATOM 3710 NH1 ARG A 255 -24.453 -28.755 -19.646 1.00101.33 N ANISOU 3710 NH1 ARG A 255 13320 12016 13165 -470 -2 -238 N ATOM 3711 NH2 ARG A 255 -22.797 -30.193 -20.324 1.00 96.51 N ANISOU 3711 NH2 ARG A 255 13082 11095 12492 -476 306 -499 N ATOM 0 H ARG A 255 -22.184 -25.750 -16.705 1.00 19.36 H new ATOM 0 HA ARG A 255 -22.529 -27.102 -14.517 1.00 24.07 H new ATOM 0 HB2 ARG A 255 -21.885 -27.999 -17.130 1.00 37.80 H new ATOM 0 HB3 ARG A 255 -22.044 -29.035 -15.975 1.00 37.80 H new ATOM 0 HG2 ARG A 255 -24.307 -27.986 -15.760 1.00 56.60 H new ATOM 0 HG3 ARG A 255 -24.056 -27.607 -17.252 1.00 56.60 H new ATOM 0 HD2 ARG A 255 -24.089 -30.255 -16.230 1.00 73.42 H new ATOM 0 HD3 ARG A 255 -25.145 -29.668 -17.217 1.00 73.42 H new ATOM 0 HE ARG A 255 -22.820 -30.732 -17.960 1.00 84.99 H new ATOM 0 HH11 ARG A 255 -24.944 -28.424 -19.022 1.00101.33 H new ATOM 0 HH12 ARG A 255 -24.541 -28.477 -20.455 1.00101.33 H new ATOM 0 HH21 ARG A 255 -22.212 -30.796 -20.142 1.00 96.51 H new ATOM 0 HH22 ARG A 255 -22.888 -29.913 -21.132 1.00 96.51 H new ATOM 3725 N ARG A 256 -19.497 -26.999 -15.521 1.00 20.97 N ANISOU 3725 N ARG A 256 2831 2184 2954 229 379 -106 N ATOM 3726 CA ARG A 256 -18.125 -27.221 -15.077 1.00 22.02 C ANISOU 3726 CA ARG A 256 2866 2348 3151 256 394 40 C ATOM 3727 C ARG A 256 -17.793 -26.364 -13.867 1.00 22.39 C ANISOU 3727 C ARG A 256 2906 2563 3038 207 242 115 C ATOM 3728 O ARG A 256 -17.083 -26.812 -12.955 1.00 25.59 O ANISOU 3728 O ARG A 256 3201 3056 3465 185 188 322 O ATOM 3729 CB ARG A 256 -17.142 -26.960 -16.225 1.00 21.72 C ANISOU 3729 CB ARG A 256 2848 2222 3185 263 466 15 C ATOM 3730 CG ARG A 256 -15.723 -27.379 -15.935 1.00 21.22 C ANISOU 3730 CG ARG A 256 2607 2153 3303 312 532 268 C ATOM 3731 CD ARG A 256 -14.911 -27.357 -17.208 1.00 18.96 C ANISOU 3731 CD ARG A 256 2355 1713 3135 371 722 265 C ATOM 3732 NE ARG A 256 -13.542 -27.690 -16.943 1.00 18.90 N ANISOU 3732 NE ARG A 256 2111 1690 3381 443 818 598 N ATOM 3733 CZ ARG A 256 -12.573 -27.764 -17.844 1.00 22.80 C ANISOU 3733 CZ ARG A 256 2564 2036 4064 543 1058 720 C ATOM 3734 NH1 ARG A 256 -12.815 -27.431 -19.107 1.00 25.48 N ANISOU 3734 NH1 ARG A 256 3147 2256 4278 551 1196 478 N ATOM 3735 NH2 ARG A 256 -11.368 -28.109 -17.466 1.00 25.24 N ANISOU 3735 NH2 ARG A 256 2578 2351 4662 607 1143 1118 N ATOM 0 H ARG A 256 -19.574 -26.596 -16.277 1.00 20.97 H new ATOM 0 HA ARG A 256 -18.040 -28.149 -14.808 1.00 22.02 H new ATOM 0 HB2 ARG A 256 -17.452 -27.430 -17.015 1.00 21.72 H new ATOM 0 HB3 ARG A 256 -17.152 -26.013 -16.436 1.00 21.72 H new ATOM 0 HG2 ARG A 256 -15.329 -26.782 -15.280 1.00 21.22 H new ATOM 0 HG3 ARG A 256 -15.712 -28.269 -15.550 1.00 21.22 H new ATOM 0 HD2 ARG A 256 -15.284 -27.986 -17.846 1.00 18.96 H new ATOM 0 HD3 ARG A 256 -14.962 -26.478 -17.614 1.00 18.96 H new ATOM 0 HE ARG A 256 -13.331 -27.857 -16.126 1.00 18.90 H new ATOM 0 HH11 ARG A 256 -13.600 -27.168 -19.339 1.00 25.48 H new ATOM 0 HH12 ARG A 256 -12.187 -27.479 -19.692 1.00 25.48 H new ATOM 0 HH21 ARG A 256 -11.211 -28.285 -16.639 1.00 25.24 H new ATOM 0 HH22 ARG A 256 -10.734 -28.159 -18.045 1.00 25.24 H new ATOM 3749 N VAL A 257 -18.297 -25.126 -13.826 1.00 19.28 N ANISOU 3749 N VAL A 257 2652 2201 2473 165 177 -32 N ATOM 3750 CA VAL A 257 -18.136 -24.323 -12.627 1.00 16.87 C ANISOU 3750 CA VAL A 257 2466 1996 1949 81 74 -19 C ATOM 3751 C VAL A 257 -18.775 -25.021 -11.430 1.00 15.66 C ANISOU 3751 C VAL A 257 2335 1907 1707 110 119 75 C ATOM 3752 O VAL A 257 -18.205 -25.073 -10.340 1.00 18.72 O ANISOU 3752 O VAL A 257 2767 2412 1935 12 10 201 O ATOM 3753 CB VAL A 257 -18.721 -22.898 -12.818 1.00 15.02 C ANISOU 3753 CB VAL A 257 2423 1704 1578 63 98 -207 C ATOM 3754 CG1 VAL A 257 -18.730 -22.111 -11.527 1.00 17.83 C ANISOU 3754 CG1 VAL A 257 3029 2090 1655 -38 67 -249 C ATOM 3755 CG2 VAL A 257 -17.929 -22.133 -13.903 1.00 17.12 C ANISOU 3755 CG2 VAL A 257 2655 1928 1924 20 33 -260 C ATOM 0 H VAL A 257 -18.724 -24.746 -14.469 1.00 19.28 H new ATOM 0 HA VAL A 257 -17.186 -24.226 -12.455 1.00 16.87 H new ATOM 0 HB VAL A 257 -19.642 -22.999 -13.105 1.00 15.02 H new ATOM 0 HG11 VAL A 257 -19.101 -21.229 -11.688 1.00 17.83 H new ATOM 0 HG12 VAL A 257 -19.271 -22.574 -10.869 1.00 17.83 H new ATOM 0 HG13 VAL A 257 -17.823 -22.023 -11.195 1.00 17.83 H new ATOM 0 HG21 VAL A 257 -18.304 -21.245 -14.012 1.00 17.12 H new ATOM 0 HG22 VAL A 257 -17.000 -22.060 -13.635 1.00 17.12 H new ATOM 0 HG23 VAL A 257 -17.985 -22.613 -14.744 1.00 17.12 H new ATOM 3765 N ALA A 258 -19.987 -25.557 -11.601 1.00 16.45 N ANISOU 3765 N ALA A 258 2404 1943 1903 222 263 50 N ATOM 3766 CA ALA A 258 -20.643 -26.240 -10.499 1.00 19.24 C ANISOU 3766 CA ALA A 258 2756 2347 2207 275 342 172 C ATOM 3767 C ALA A 258 -19.816 -27.411 -9.996 1.00 20.39 C ANISOU 3767 C ALA A 258 2734 2571 2441 256 283 389 C ATOM 3768 O ALA A 258 -19.820 -27.703 -8.795 1.00 23.17 O ANISOU 3768 O ALA A 258 3120 3038 2646 236 269 535 O ATOM 3769 CB ALA A 258 -22.041 -26.696 -10.952 1.00 22.16 C ANISOU 3769 CB ALA A 258 3042 2620 2759 382 482 177 C ATOM 0 H ALA A 258 -20.434 -25.534 -12.335 1.00 16.45 H new ATOM 0 HA ALA A 258 -20.733 -25.624 -9.755 1.00 19.24 H new ATOM 0 HB1 ALA A 258 -22.485 -27.153 -10.221 1.00 22.16 H new ATOM 0 HB2 ALA A 258 -22.564 -25.923 -11.215 1.00 22.16 H new ATOM 0 HB3 ALA A 258 -21.956 -27.300 -11.706 1.00 22.16 H new ATOM 3775 N GLY A 259 -19.086 -28.062 -10.887 1.00 21.56 N ANISOU 3775 N GLY A 259 2717 2647 2826 267 281 439 N ATOM 3776 CA GLY A 259 -18.203 -29.149 -10.453 1.00 24.01 C ANISOU 3776 CA GLY A 259 2824 2996 3302 279 282 714 C ATOM 3777 C GLY A 259 -17.070 -28.658 -9.581 1.00 26.37 C ANISOU 3777 C GLY A 259 3094 3481 3444 143 75 913 C ATOM 3778 O GLY A 259 -16.697 -29.326 -8.598 1.00 30.53 O ANISOU 3778 O GLY A 259 3493 4137 3970 110 12 1202 O ATOM 0 H GLY A 259 -19.081 -27.900 -11.732 1.00 21.56 H new ATOM 0 HA2 GLY A 259 -18.721 -29.808 -9.965 1.00 24.01 H new ATOM 0 HA3 GLY A 259 -17.838 -29.596 -11.232 1.00 24.01 H new ATOM 3782 N VAL A 260 -16.493 -27.496 -9.927 1.00 26.84 N ANISOU 3782 N VAL A 260 3259 3562 3376 32 -62 800 N ATOM 3783 CA VAL A 260 -15.441 -26.901 -9.118 1.00 29.38 C ANISOU 3783 CA VAL A 260 3587 4056 3521 -181 -331 991 C ATOM 3784 C VAL A 260 -15.983 -26.511 -7.755 1.00 31.27 C ANISOU 3784 C VAL A 260 4103 4431 3349 -316 -435 954 C ATOM 3785 O VAL A 260 -15.325 -26.720 -6.723 1.00 34.05 O ANISOU 3785 O VAL A 260 4426 4969 3542 -499 -652 1231 O ATOM 3786 CB VAL A 260 -14.837 -25.684 -9.859 1.00 32.99 C ANISOU 3786 CB VAL A 260 4124 4464 3947 -281 -440 849 C ATOM 3787 CG1 VAL A 260 -13.875 -24.934 -8.981 1.00 34.27 C ANISOU 3787 CG1 VAL A 260 4352 4788 3883 -578 -775 1020 C ATOM 3788 CG2 VAL A 260 -14.183 -26.129 -11.148 1.00 34.78 C ANISOU 3788 CG2 VAL A 260 4101 4559 4554 -141 -295 935 C ATOM 0 H VAL A 260 -16.703 -27.044 -10.628 1.00 26.84 H new ATOM 0 HA VAL A 260 -14.734 -27.550 -8.978 1.00 29.38 H new ATOM 0 HB VAL A 260 -15.556 -25.071 -10.081 1.00 32.99 H new ATOM 0 HG11 VAL A 260 -13.512 -24.178 -9.469 1.00 34.27 H new ATOM 0 HG12 VAL A 260 -14.339 -24.615 -8.191 1.00 34.27 H new ATOM 0 HG13 VAL A 260 -13.152 -25.524 -8.715 1.00 34.27 H new ATOM 0 HG21 VAL A 260 -13.808 -25.359 -11.604 1.00 34.78 H new ATOM 0 HG22 VAL A 260 -13.476 -26.763 -10.950 1.00 34.78 H new ATOM 0 HG23 VAL A 260 -14.845 -26.551 -11.718 1.00 34.78 H new ATOM 3798 N LEU A 261 -17.178 -25.917 -7.721 1.00 28.86 N ANISOU 3798 N LEU A 261 4080 4030 2856 -239 -269 650 N ATOM 3799 CA LEU A 261 -17.752 -25.479 -6.458 1.00 31.79 C ANISOU 3799 CA LEU A 261 4796 4469 2814 -334 -257 589 C ATOM 3800 C LEU A 261 -18.145 -26.662 -5.582 1.00 31.07 C ANISOU 3800 C LEU A 261 4594 4486 2725 -255 -183 826 C ATOM 3801 O LEU A 261 -18.130 -26.556 -4.356 1.00 35.11 O ANISOU 3801 O LEU A 261 5346 5131 2862 -401 -258 913 O ATOM 3802 CB LEU A 261 -18.965 -24.579 -6.705 1.00 32.32 C ANISOU 3802 CB LEU A 261 5142 4356 2782 -207 4 275 C ATOM 3803 CG LEU A 261 -18.748 -23.350 -7.586 1.00 31.64 C ANISOU 3803 CG LEU A 261 5166 4140 2717 -255 -18 48 C ATOM 3804 CD1 LEU A 261 -20.067 -22.648 -7.857 1.00 32.08 C ANISOU 3804 CD1 LEU A 261 5394 4009 2784 -77 294 -153 C ATOM 3805 CD2 LEU A 261 -17.759 -22.382 -6.985 1.00 32.27 C ANISOU 3805 CD2 LEU A 261 5524 4266 2469 -561 -266 6 C ATOM 0 H LEU A 261 -17.664 -25.762 -8.413 1.00 28.86 H new ATOM 0 HA LEU A 261 -17.072 -24.972 -5.987 1.00 31.79 H new ATOM 0 HB2 LEU A 261 -19.664 -25.118 -7.107 1.00 32.32 H new ATOM 0 HB3 LEU A 261 -19.298 -24.279 -5.845 1.00 32.32 H new ATOM 0 HG LEU A 261 -18.374 -23.665 -8.424 1.00 31.64 H new ATOM 0 HD11 LEU A 261 -19.911 -21.871 -8.417 1.00 32.08 H new ATOM 0 HD12 LEU A 261 -20.671 -23.257 -8.310 1.00 32.08 H new ATOM 0 HD13 LEU A 261 -20.463 -22.367 -7.017 1.00 32.08 H new ATOM 0 HD21 LEU A 261 -17.652 -21.620 -7.575 1.00 32.27 H new ATOM 0 HD22 LEU A 261 -18.085 -22.080 -6.123 1.00 32.27 H new ATOM 0 HD23 LEU A 261 -16.903 -22.823 -6.870 1.00 32.27 H new ATOM 3817 N ALA A 262 -18.502 -27.788 -6.190 1.00 28.62 N ANISOU 3817 N ALA A 262 3959 4106 2808 -47 -33 932 N ATOM 3818 CA ALA A 262 -18.846 -28.986 -5.422 1.00 34.01 C ANISOU 3818 CA ALA A 262 4488 4868 3566 40 50 1190 C ATOM 3819 C ALA A 262 -17.584 -29.598 -4.827 1.00 39.07 C ANISOU 3819 C ALA A 262 4910 5701 4236 -108 -184 1577 C ATOM 3820 O ALA A 262 -17.647 -30.264 -3.786 1.00 44.58 O ANISOU 3820 O ALA A 262 5565 6549 4824 -133 -208 1844 O ATOM 3821 CB ALA A 262 -19.566 -29.997 -6.300 1.00 36.19 C ANISOU 3821 CB ALA A 262 4511 4967 4273 257 267 1183 C ATOM 0 H ALA A 262 -18.552 -27.882 -7.043 1.00 28.62 H new ATOM 0 HA ALA A 262 -19.444 -28.734 -4.701 1.00 34.01 H new ATOM 0 HB1 ALA A 262 -19.786 -30.783 -5.776 1.00 36.19 H new ATOM 0 HB2 ALA A 262 -20.381 -29.602 -6.647 1.00 36.19 H new ATOM 0 HB3 ALA A 262 -18.991 -30.252 -7.038 1.00 36.19 H new TER 3827 ALA A 262 HETATM 3828 CL CL A 301 -18.322 -7.226 -23.383 1.00 21.68 CL HETATM 3829 C1 GOL A 302 -19.581 -17.637 5.423 1.00 52.50 C HETATM 3830 O1 GOL A 302 -20.821 -17.022 5.737 1.00 51.26 O HETATM 3831 C2 GOL A 302 -18.636 -16.538 4.864 1.00 48.29 C HETATM 3832 O2 GOL A 302 -18.203 -15.664 5.842 1.00 48.37 O HETATM 3833 C3 GOL A 302 -17.468 -17.299 4.231 1.00 43.45 C HETATM 3834 O3 GOL A 302 -17.475 -16.956 2.878 1.00 43.84 O HETATM 0 HO3 GOL A 302 -17.438 -17.654 2.412 1.00 43.84 H new HETATM 0 HO2 GOL A 302 -18.806 -15.568 6.419 1.00 48.37 H new HETATM 0 HO1 GOL A 302 -21.351 -17.599 6.041 1.00 51.26 H new HETATM 0 H32 GOL A 302 -16.627 -17.053 4.647 1.00 43.45 H new HETATM 0 H31 GOL A 302 -17.573 -18.256 4.347 1.00 43.45 H new HETATM 0 H2 GOL A 302 -19.096 -15.976 4.221 1.00 48.29 H new HETATM 0 H12 GOL A 302 -19.195 -18.048 6.213 1.00 52.50 H new HETATM 0 H11 GOL A 302 -19.707 -18.342 4.769 1.00 52.50 H new HETATM 3841 S SO4 A 303 -29.802 8.090 -24.382 1.00 66.59 S HETATM 3842 O1 SO4 A 303 -29.025 8.621 -25.512 1.00 68.39 O HETATM 3843 O2 SO4 A 303 -31.229 8.296 -24.632 1.00 65.92 O HETATM 3844 O3 SO4 A 303 -29.411 8.798 -23.163 1.00 68.59 O HETATM 3845 O4 SO4 A 303 -29.544 6.663 -24.233 1.00 64.36 O HETATM 3846 ZN ZN A 304 -33.272 0.000 -30.329 0.50 24.67 ZN HETATM 3847 C1 GOL A 305 -10.393 -9.328 6.039 1.00 45.34 C HETATM 3848 O1 GOL A 305 -9.861 -8.059 6.054 1.00 47.53 O HETATM 3849 C2 GOL A 305 -11.805 -9.234 6.650 1.00 48.92 C HETATM 3850 O2 GOL A 305 -11.791 -9.356 8.025 1.00 51.37 O HETATM 3851 C3 GOL A 305 -12.334 -7.882 6.241 1.00 52.38 C HETATM 3852 O3 GOL A 305 -13.733 -7.991 6.183 1.00 54.11 O HETATM 0 HO3 GOL A 305 -14.063 -7.252 5.958 1.00 54.11 H new HETATM 0 HO2 GOL A 305 -12.576 -9.298 8.320 1.00 51.37 H new HETATM 0 HO1 GOL A 305 -9.087 -8.075 5.727 1.00 47.53 H new HETATM 0 H32 GOL A 305 -12.069 -7.202 6.880 1.00 52.38 H new HETATM 0 H31 GOL A 305 -11.974 -7.618 5.380 1.00 52.38 H new HETATM 0 H2 GOL A 305 -12.364 -9.960 6.331 1.00 48.92 H new HETATM 0 H12 GOL A 305 -10.434 -9.672 5.133 1.00 45.34 H new HETATM 0 H11 GOL A 305 -9.838 -9.938 6.550 1.00 45.34 H new HETATM 3859 C10 MQZ A 306 -17.331 -5.441 -31.674 1.00 58.94 C HETATM 3860 C13 MQZ A 306 -20.046 -5.035 -34.077 1.00 82.77 C HETATM 3861 C15 MQZ A 306 -14.951 -5.428 -30.651 1.00 43.11 C HETATM 3862 C17 MQZ A 306 -12.990 -3.856 -31.178 1.00 43.67 C HETATM 3863 C20 MQZ A 306 -13.569 -1.722 -32.296 1.00 56.52 C HETATM 3864 C21 MQZ A 306 -12.640 -3.604 -33.574 1.00 53.22 C HETATM 3865 C22 MQZ A 306 -12.902 -3.490 -29.584 1.00 34.97 C HETATM 3866 C24 MQZ A 306 -14.174 -2.163 -27.840 1.00 28.86 C HETATM 3867 C28 MQZ A 306 -10.948 -4.945 -28.928 1.00 33.86 C HETATM 3868 C01 MQZ A 306 -20.078 -4.294 -27.561 1.00 29.59 C HETATM 3869 C02 MQZ A 306 -18.963 -3.389 -27.141 1.00 31.58 C HETATM 3870 C03 MQZ A 306 -18.700 -2.191 -28.039 1.00 32.71 C HETATM 3871 C04 MQZ A 306 -17.243 -1.837 -27.799 1.00 31.70 C HETATM 3872 C06 MQZ A 306 -17.600 -4.102 -27.069 1.00 33.64 C HETATM 3873 C07 MQZ A 306 -17.412 -5.221 -28.157 1.00 40.17 C HETATM 3874 C09 MQZ A 306 -16.436 -5.721 -30.540 1.00 47.55 C HETATM 3875 C11 MQZ A 306 -18.770 -5.792 -31.382 1.00 69.75 C HETATM 3876 C18 MQZ A 306 -12.623 -2.891 -32.193 1.00 51.05 C HETATM 3877 C19 MQZ A 306 -11.202 -2.432 -31.870 1.00 49.99 C HETATM 3878 C25 MQZ A 306 -15.204 -3.255 -27.354 1.00 29.93 C HETATM 3879 C29 MQZ A 306 -9.654 -4.410 -28.309 1.00 37.63 C HETATM 3880 C30 MQZ A 306 -9.308 -3.009 -28.822 1.00 42.21 C HETATM 3881 C31 MQZ A 306 -9.836 -4.283 -26.792 1.00 37.81 C HETATM 3882 C32 MQZ A 306 -8.454 -5.343 -28.554 1.00 38.80 C HETATM 3883 C33 MQZ A 306 -11.274 -6.283 -28.232 1.00 34.76 C HETATM 3884 C35 MQZ A 306 -12.583 -7.450 -26.329 1.00 34.57 C HETATM 3885 C36 MQZ A 306 -13.473 -8.535 -26.948 1.00 36.53 C HETATM 3886 C38 MQZ A 306 -15.153 -9.427 -28.469 1.00 45.55 C HETATM 3887 C39 MQZ A 306 -16.574 -9.312 -28.012 1.00 50.25 C HETATM 3888 C41 MQZ A 306 -18.283 -9.125 -26.584 1.00 51.28 C HETATM 3889 C42 MQZ A 306 -18.980 -9.226 -27.741 1.00 54.51 C HETATM 3890 C44 MQZ A 306 -14.943 -9.488 -29.936 1.00 46.98 C HETATM 3891 C45 MQZ A 306 -13.634 -10.230 -30.158 1.00 46.94 C HETATM 3892 C47 MQZ A 306 -12.643 -12.115 -31.136 1.00 49.87 C HETATM 3893 C50 MQZ A 306 -13.209 -6.922 -24.975 1.00 33.13 C HETATM 3894 C51 MQZ A 306 -12.180 -6.128 -24.238 1.00 34.63 C HETATM 3895 C52 MQZ A 306 -11.051 -6.784 -23.702 1.00 35.68 C HETATM 3896 C53 MQZ A 306 -10.059 -6.104 -23.024 1.00 36.04 C HETATM 3897 C54 MQZ A 306 -10.145 -4.727 -22.860 1.00 34.10 C HETATM 3898 C55 MQZ A 306 -11.246 -4.062 -23.392 1.00 35.26 C HETATM 3899 C56 MQZ A 306 -12.235 -4.751 -24.076 1.00 35.72 C HETATM 3900 C57 MQZ A 306 -13.705 -8.053 -24.085 1.00 32.70 C HETATM 3901 N05 MQZ A 306 -16.591 -3.097 -27.390 1.00 30.82 N HETATM 3902 N08 MQZ A 306 -16.755 -4.844 -29.338 1.00 42.86 N HETATM 3903 N16 MQZ A 306 -14.437 -4.251 -31.155 1.00 42.08 N HETATM 3904 N23 MQZ A 306 -13.893 -2.571 -29.177 1.00 30.64 N HETATM 3905 N27 MQZ A 306 -12.068 -4.016 -28.737 1.00 32.68 N HETATM 3906 N34 MQZ A 306 -12.207 -6.274 -27.163 1.00 34.69 N HETATM 3907 N37 MQZ A 306 -14.353 -8.300 -27.956 1.00 41.41 N HETATM 3908 N40 MQZ A 306 -16.891 -9.172 -26.737 1.00 49.68 N HETATM 3909 O14 MQZ A 306 -19.714 -7.591 -33.307 1.00 79.90 O HETATM 3910 O26 MQZ A 306 -14.815 -4.377 -27.038 1.00 31.82 O HETATM 3911 O46 MQZ A 306 -13.773 -11.538 -30.487 1.00 47.48 O HETATM 3912 O48 MQZ A 306 -12.514 -9.749 -30.021 1.00 45.05 O HETATM 3913 O49 MQZ A 306 -13.372 -9.683 -26.547 1.00 33.16 O HETATM 3914 O58 MQZ A 306 -10.727 -7.301 -28.539 1.00 35.96 O HETATM 3915 O59 MQZ A 306 -14.200 -6.281 -30.217 1.00 41.17 O HETATM 3916 O60 MQZ A 306 -17.825 -6.359 -27.975 1.00 42.74 O HETATM 3917 S12 MQZ A 306 -19.547 -6.180 -32.941 1.00 78.16 S HETATM 3918 S43 MQZ A 306 -17.925 -9.386 -29.079 1.00 55.14 S HETATM 3981 O HOH A 401 -24.158 -17.247 0.961 1.00 50.98 O HETATM 3982 O HOH A 402 -15.284 -20.756 -0.301 1.00 58.53 O HETATM 3983 O HOH A 403 -34.803 -10.366 -11.441 1.00 30.24 O HETATM 3984 O HOH A 404 -13.244 8.587 -27.992 1.00 28.69 O HETATM 3985 O HOH A 405 -6.730 -11.551 -28.263 1.00 34.63 O HETATM 3986 O HOH A 406 -13.306 -29.298 -29.827 1.00 24.11 O HETATM 3987 O HOH A 407 -35.348 -9.688 0.865 1.00 37.96 O HETATM 3988 O HOH A 408 -31.170 -11.504 -23.388 1.00 27.22 O HETATM 3989 O HOH A 409 -11.963 -11.008 -25.126 1.00 26.64 O HETATM 3990 O HOH A 410 -31.422 1.366 -0.478 1.00 37.40 O HETATM 3991 O HOH A 411 -35.681 -11.085 -21.950 1.00 38.35 O HETATM 3992 O HOH A 412 -36.510 -7.082 -12.657 1.00 21.86 O HETATM 3993 O HOH A 413 -35.396 -5.998 -9.712 1.00 26.86 O HETATM 3994 O HOH A 414 -32.875 3.695 -5.188 1.00 33.46 O HETATM 3995 O HOH A 415 -32.908 3.706 -2.076 1.00 30.43 O HETATM 3996 O HOH A 416 -4.305 -24.468 -17.752 1.00 25.49 O HETATM 3997 O HOH A 417 -30.880 -6.555 -29.816 1.00 30.56 O HETATM 3998 O HOH A 418 -18.256 -27.033 -20.218 1.00 45.29 O HETATM 3999 O HOH A 419 -7.197 -3.584 -2.316 1.00 41.97 O HETATM 4000 O HOH A 420 -7.454 -3.939 -17.092 1.00 33.58 O HETATM 4001 O HOH A 421 -16.720 -1.438 -1.048 1.00 36.91 O HETATM 4002 O HOH A 422 -24.129 9.245 -26.659 1.00 37.33 O HETATM 4003 O HOH A 423 -20.983 11.477 -29.915 1.00 22.27 O HETATM 4004 O HOH A 424 -2.477 -4.052 -13.129 1.00 40.69 O HETATM 4005 O HOH A 425 -11.603 5.196 -7.767 1.00 44.49 O HETATM 4006 O HOH A 426 -30.064 -23.022 -10.468 1.00 40.91 O HETATM 4007 O HOH A 427 -17.101 -14.232 7.776 1.00 44.03 O HETATM 4008 O HOH A 428 -24.924 -28.589 -13.043 1.00 37.02 O HETATM 4009 O HOH A 429 -26.704 -16.114 -36.280 1.00 42.09 O HETATM 4010 O HOH A 430 -2.508 -9.100 -24.823 1.00 35.79 O HETATM 4011 O HOH A 431 -30.219 -3.339 -19.940 1.00 30.02 O HETATM 4012 O HOH A 432 -23.700 -19.308 -30.597 1.00 30.59 O HETATM 4013 O HOH A 433 -1.262 -22.239 -14.858 1.00 29.96 O HETATM 4014 O HOH A 434 -15.169 -28.093 -22.992 1.00 23.82 O HETATM 4015 O HOH A 435 -24.241 -9.613 -14.070 1.00 16.00 O HETATM 4016 O HOH A 436 -6.059 11.202 -28.624 1.00 43.16 O HETATM 4017 O HOH A 437 0.327 -10.854 -10.259 1.00 29.01 O HETATM 4018 O HOH A 438 -33.628 -15.356 -26.798 1.00 47.63 O HETATM 4019 O HOH A 439 -37.345 -6.370 -21.192 1.00 31.72 O HETATM 4020 O HOH A 440 -9.549 -28.904 -29.691 1.00 27.18 O HETATM 4021 O HOH A 441 -28.583 -25.064 -17.697 1.00 32.96 O HETATM 4022 O HOH A 442 -4.085 2.945 -19.178 1.00 35.61 O HETATM 4023 O HOH A 443 -25.630 -21.775 -23.036 1.00 20.49 O HETATM 4024 O HOH A 444 -13.318 6.962 -35.126 1.00 43.56 O HETATM 4025 O HOH A 445 -3.246 -6.243 -6.532 1.00 38.39 O HETATM 4026 O HOH A 446 -21.967 -27.534 -7.192 1.00 29.23 O HETATM 4027 O HOH A 447 -9.942 -14.143 -30.973 1.00 32.98 O HETATM 4028 O HOH A 448 -17.874 8.645 -11.410 1.00 39.40 O HETATM 4029 O HOH A 449 -18.621 -18.449 -0.956 1.00 32.40 O HETATM 4030 O HOH A 450 -16.817 -18.825 -3.263 1.00 41.87 O HETATM 4031 O HOH A 451 -33.650 -2.125 -31.443 1.00 26.24 O HETATM 4032 O HOH A 452 -17.947 -15.811 -34.876 1.00 25.10 O HETATM 4033 O HOH A 453 -17.421 0.414 -36.116 1.00 49.60 O HETATM 4034 O HOH A 454 -24.248 7.865 -10.509 1.00 44.61 O HETATM 4035 O HOH A 455 -14.719 -25.959 -20.338 1.00 33.99 O HETATM 4036 O HOH A 456 -4.168 -13.805 -19.490 1.00 16.90 O HETATM 4037 O HOH A 457 -16.745 -0.069 -20.408 1.00 23.54 O HETATM 4038 O HOH A 458 -27.526 0.559 -37.954 1.00 34.87 O HETATM 4039 O HOH A 459 -34.355 -6.954 -26.949 1.00 27.66 O HETATM 4040 O HOH A 460 -29.311 0.795 -20.154 1.00 20.90 O HETATM 4041 O HOH A 461 -17.311 -27.966 -25.244 1.00 11.32 O HETATM 4042 O HOH A 462 -13.652 -26.314 -32.435 1.00 37.02 O HETATM 4043 O HOH A 463 -33.272 0.000 -21.640 0.50 25.44 O HETATM 4044 O HOH A 464 -17.995 3.985 -8.023 1.00 18.47 O HETATM 4045 O HOH A 465 1.578 -16.892 -24.711 1.00 22.57 O HETATM 4046 O HOH A 466 -4.475 -5.708 -11.415 1.00 20.91 O HETATM 4047 O HOH A 467 -7.685 1.904 -21.222 1.00 24.45 O HETATM 4048 O HOH A 468 -14.325 0.216 -18.920 1.00 17.78 O HETATM 4049 O HOH A 469 -24.741 -20.251 0.978 1.00 29.01 O HETATM 4050 O HOH A 470 -17.336 -31.976 -8.333 1.00 36.56 O HETATM 4051 O HOH A 471 -17.738 0.420 -4.084 1.00 22.10 O HETATM 4052 O HOH A 472 -7.042 -21.929 -31.681 1.00 29.62 O HETATM 4053 O HOH A 473 -22.297 -21.322 -30.742 1.00 33.90 O HETATM 4054 O HOH A 474 -6.489 -10.980 -12.093 1.00 21.94 O HETATM 4055 O HOH A 475 -11.519 -13.044 3.148 1.00 36.88 O HETATM 4056 O HOH A 476 -9.551 -4.608 -18.555 1.00 25.61 O HETATM 4057 O HOH A 477 -26.636 6.914 -11.288 1.00 21.35 O HETATM 4058 O HOH A 478 -25.088 -8.721 -25.771 1.00 22.14 O HETATM 4059 O HOH A 479 -32.374 -5.975 -15.170 1.00 22.97 O HETATM 4060 O HOH A 480 -30.526 -14.040 -15.065 1.00 17.92 O HETATM 4061 O HOH A 481 -25.451 -27.504 -23.621 1.00 47.76 O HETATM 4062 O HOH A 482 -14.079 9.797 -11.895 1.00 44.49 O HETATM 4063 O HOH A 483 -17.296 9.079 -3.361 1.00 28.15 O HETATM 4064 O HOH A 484 -33.095 -5.517 -17.955 1.00 30.51 O HETATM 4065 O HOH A 485 -20.675 -0.885 0.628 1.00 38.20 O HETATM 4066 O HOH A 486 -18.777 4.707 -36.741 1.00 34.61 O HETATM 4067 O HOH A 487 -23.056 8.629 -24.806 1.00 29.36 O HETATM 4068 O HOH A 488 -30.945 -22.863 -4.480 1.00 47.92 O HETATM 4069 O HOH A 489 2.301 -9.949 -13.320 1.00 31.08 O HETATM 4070 O HOH A 490 -33.272 0.000 -24.367 0.50 21.42 O HETATM 4071 O HOH A 491 -9.013 -17.330 -1.006 1.00 46.92 O HETATM 4072 O HOH A 492 -21.566 9.963 -23.122 1.00 37.33 O HETATM 4073 O HOH A 493 -11.822 -0.854 -5.696 1.00 32.15 O HETATM 4074 O HOH A 494 -25.717 -19.738 -24.805 1.00 20.24 O HETATM 4075 O HOH A 495 -1.530 -0.714 -23.350 1.00 38.20 O HETATM 4076 O HOH A 496 -35.465 -15.761 -28.289 1.00 48.35 O HETATM 4077 O HOH A 497 -26.859 8.392 -27.567 1.00 28.69 O HETATM 4078 O HOH A 498 -20.205 11.061 -7.924 1.00 36.64 O HETATM 4079 O HOH A 499 -9.389 -9.266 -26.993 1.00 36.22 O HETATM 4080 O HOH A 500 -6.069 0.312 -15.146 1.00 48.17 O HETATM 4081 O HOH A 501 -11.710 1.046 -18.707 1.00 25.85 O HETATM 4082 O HOH A 502 -5.263 -7.994 -3.325 1.00 38.22 O HETATM 4083 O HOH A 503 -19.135 -28.916 -18.998 1.00 32.58 O HETATM 4084 O HOH A 504 -22.275 -29.903 -12.672 1.00 23.31 O HETATM 4085 O HOH A 505 -33.942 -10.210 -13.350 1.00 27.66 O HETATM 4086 O HOH A 506 -15.222 -3.336 1.495 1.00 25.73 O HETATM 4087 O HOH A 507 -31.001 -20.787 -16.532 1.00 36.42 O HETATM 4088 O HOH A 508 -32.258 -17.734 -24.147 1.00 30.73 O HETATM 4089 O HOH A 509 -33.479 5.265 -8.593 1.00 23.86 O HETATM 4090 O HOH A 510 -22.729 -2.207 -0.202 1.00 26.59 O HETATM 4091 O HOH A 511 -22.730 9.750 -32.386 1.00 37.00 O HETATM 4092 O HOH A 512 -14.582 1.062 -35.335 1.00 49.13 O HETATM 4093 O HOH A 513 -5.152 -20.290 -10.119 1.00 20.29 O HETATM 4094 O HOH A 514 -10.186 -10.874 3.303 1.00 47.85 O HETATM 4095 O HOH A 515 -6.684 -26.209 -21.686 1.00 44.18 O HETATM 4096 O HOH A 516 -9.977 2.412 -14.436 1.00 23.85 O HETATM 4097 O HOH A 517 0.353 -8.504 -20.101 1.00 21.30 O HETATM 4098 O HOH A 518 -27.172 7.959 -19.743 1.00 33.46 O HETATM 4099 O HOH A 519 -29.945 2.305 -31.161 1.00 33.33 O HETATM 4100 O HOH A 520 5.285 -13.435 -21.950 1.00 47.11 O HETATM 4101 O HOH A 521 -19.464 -2.944 -18.984 1.00 25.40 O HETATM 4102 O HOH A 522 -4.596 -18.997 -31.520 1.00 36.21 O HETATM 4103 O HOH A 523 -6.373 -9.195 -26.993 1.00 34.87 O HETATM 4104 O HOH A 524 -31.621 -0.321 -19.237 1.00 31.89 O HETATM 4105 O HOH A 525 -9.566 -20.572 -3.483 1.00 45.47 O HETATM 4106 O HOH A 526 -18.923 -5.537 -18.810 1.00 25.07 O HETATM 4107 O HOH A 527 -31.219 0.534 -33.952 1.00 27.80 O HETATM 4108 O HOH A 528 -8.950 -27.536 -19.026 1.00 36.10 O HETATM 4109 O HOH A 529 -8.669 -6.650 -0.328 1.00 38.85 O HETATM 4110 O HOH A 530 -3.113 -25.028 -21.877 1.00 34.70 O HETATM 4111 O HOH A 531 -3.305 -5.855 -27.915 1.00 34.92 O HETATM 4112 O HOH A 532 -23.697 9.269 -8.435 1.00 38.66 O HETATM 4113 O HOH A 533 -4.591 4.810 -30.215 1.00 38.57 O HETATM 4114 O HOH A 534 -10.696 -27.567 -21.342 1.00 26.79 O HETATM 4115 O HOH A 535 -3.865 1.145 -25.058 1.00 27.81 O HETATM 4116 O HOH A 536 -21.364 -7.467 -24.344 1.00 34.66 O HETATM 4117 O HOH A 537 -5.810 5.679 -32.600 1.00 39.51 O HETATM 4118 O HOH A 538 -15.939 -9.875 5.538 1.00 49.81 O HETATM 4119 O HOH A 539 -4.722 -2.683 -9.691 1.00 38.12 O HETATM 4120 O HOH A 540 -23.128 7.375 -12.632 1.00 35.04 O HETATM 4121 O HOH A 541 -22.300 -24.248 -4.626 1.00 27.76 O HETATM 4122 O HOH A 542 -15.319 -13.763 -31.751 1.00 30.56 O HETATM 4123 O HOH A 543 -24.250 -24.371 -23.489 1.00 35.90 O HETATM 4124 O HOH A 544 -24.546 2.724 -36.617 1.00 41.57 O HETATM 4125 O HOH A 545 -6.106 -3.927 -14.766 1.00 31.41 O HETATM 4126 O HOH A 546 -9.333 -1.332 -9.755 1.00 22.37 O HETATM 4127 O HOH A 547 -10.932 6.390 -0.093 1.00 28.71 O HETATM 4128 O HOH A 548 -31.443 -17.381 -26.454 1.00 27.34 O HETATM 4129 O HOH A 549 -9.667 -10.302 -23.478 1.00 23.49 O HETATM 4130 O HOH A 550 -11.418 0.117 -8.279 1.00 26.20 O HETATM 4131 O HOH A 551 -33.272 -8.041 0.000 0.50 33.84 O HETATM 4132 O HOH A 552 -9.606 -26.237 -13.272 1.00 39.80 O HETATM 4133 O HOH A 553 -17.207 -11.328 6.739 1.00 48.50 O HETATM 4134 O HOH A 554 -2.302 -17.269 -30.550 1.00 41.87 O HETATM 4135 O HOH A 555 -6.636 -25.185 -29.108 1.00 33.88 O HETATM 4136 O HOH A 556 -19.643 9.081 -23.832 1.00 26.24 O HETATM 4137 O HOH A 557 -16.154 -28.138 -20.420 1.00 32.81 O HETATM 4138 O HOH A 558 2.791 -6.036 -19.309 1.00 50.49 O HETATM 4139 O HOH A 559 -28.113 0.000 0.000 0.50 32.41 O HETATM 4140 O HOH A 560 -7.152 -10.430 -3.398 1.00 35.89 O HETATM 4141 O HOH A 561 -10.352 3.324 -37.636 1.00 53.67 O HETATM 4142 O HOH A 562 -2.547 -23.681 -28.252 1.00 33.85 O HETATM 4143 O HOH A 563 -5.852 3.347 -22.971 1.00 44.18 O HETATM 4144 O HOH A 564 -22.567 -13.113 5.588 1.00 45.05 O HETATM 4145 O HOH A 565 2.839 -14.468 -24.935 1.00 38.55 O HETATM 4146 O HOH A 566 5.816 -19.103 -15.050 1.00 43.24 O HETATM 4147 O HOH A 567 -33.214 -13.090 -14.868 1.00 25.86 O HETATM 4148 O HOH A 568 6.734 -15.633 -19.861 1.00 47.64 O HETATM 4149 O HOH A 569 -7.086 -26.304 -16.825 1.00 41.49 O HETATM 4150 O HOH A 570 0.817 -15.483 -9.974 1.00 35.81 O HETATM 4151 O HOH A 571 -10.256 2.260 -7.598 1.00 44.08 O HETATM 4152 O HOH A 572 -26.820 -27.245 -18.078 1.00 38.61 O HETATM 4153 O HOH A 573 -23.649 -24.841 -7.451 1.00 19.34 O HETATM 4154 O HOH A 574 -34.221 -7.988 -14.771 1.00 36.82 O HETATM 4155 O HOH A 575 -24.929 0.000 0.000 0.50 15.12 O HETATM 4156 O HOH A 576 -6.042 5.045 -19.469 1.00 46.17 O HETATM 4157 O HOH A 577 -20.721 8.585 -12.634 1.00 32.01 O HETATM 4158 O HOH A 578 -8.869 -0.773 -12.033 1.00 34.35 O HETATM 4159 O HOH A 579 -26.134 9.407 -22.345 1.00 41.67 O HETATM 4160 O HOH A 580 -0.823 -23.154 -12.384 1.00 47.22 O HETATM 4161 O HOH A 581 -11.910 -15.644 -32.231 1.00 27.93 O HETATM 4162 O HOH A 582 -4.483 -1.877 -11.625 1.00 39.04 O HETATM 4163 O HOH A 583 -33.272 0.000 -32.443 0.50 54.98 O HETATM 4164 O HOH A 584 -37.667 -10.978 -7.947 1.00 43.42 O HETATM 4165 O HOH A 585 -32.677 -26.914 -19.064 1.00 40.52 O HETATM 4166 O HOH A 586 -21.601 -30.725 -10.189 1.00 31.42 O HETATM 4167 O HOH A 587 -18.450 2.071 -38.007 1.00 46.36 O HETATM 4168 O HOH A 588 4.188 -2.898 -16.608 1.00 44.30 O HETATM 4169 O HOH A 589 -23.009 -29.947 -8.167 1.00 42.06 O HETATM 4170 O HOH A 590 -16.341 -13.583 -34.422 1.00 33.15 O HETATM 4171 O HOH A 591 -26.040 -20.165 -30.359 1.00 44.72 O HETATM 4172 O HOH A 592 -3.686 -8.687 -27.327 1.00 45.05 O HETATM 4173 O HOH A 593 -15.528 -0.932 2.898 1.00 39.59 O HETATM 4174 O HOH A 594 -37.555 -7.358 -10.258 1.00 28.06 O HETATM 4175 O HOH A 595 -34.897 -6.963 -29.650 1.00 44.00 O HETATM 4176 O HOH A 596 -24.137 -20.453 3.825 1.00 47.05 O HETATM 4177 O HOH A 597 -33.400 -10.199 -32.181 1.00 46.11 O HETATM 4178 O HOH A 598 -3.597 -4.722 -9.127 1.00 37.49 O HETATM 4179 O HOH A 599 -28.040 9.078 -8.092 1.00 42.96 O HETATM 4180 O HOH A 600 -22.424 -8.740 -26.282 1.00 27.81 O HETATM 4181 O HOH A 601 0.012 -11.033 -24.133 1.00 42.66 O CONECT 2239 3846 CONECT 3829 3830 3831 3835 3836 CONECT 3830 3829 3837 CONECT 3831 3829 3832 3833 3838 CONECT 3832 3831 CONECT 3833 3831 3834 3839 3840 CONECT 3834 3833 CONECT 3835 3829 CONECT 3836 3829 CONECT 3837 3830 CONECT 3838 3831 CONECT 3839 3833 CONECT 3840 3833 CONECT 3841 3842 3843 3844 3845 CONECT 3842 3841 CONECT 3843 3841 CONECT 3844 3841 CONECT 3845 3841 CONECT 3846 2239 4031 4163 CONECT 3847 3848 3849 3853 3854 CONECT 3848 3847 CONECT 3849 3847 3850 3851 3855 CONECT 3850 3849 CONECT 3851 3849 3852 3856 3857 CONECT 3852 3851 3858 CONECT 3853 3847 CONECT 3854 3847 CONECT 3855 3849 CONECT 3856 3851 CONECT 3857 3851 CONECT 3858 3852 CONECT 3859 3874 3875 3919 3920 CONECT 3860 3917 3921 3922 3923 CONECT 3861 3874 3903 3915 CONECT 3862 3865 3876 3903 3924 CONECT 3863 3876 3925 3926 3927 CONECT 3864 3876 3928 3929 3930 CONECT 3865 3862 3904 3905 CONECT 3866 3878 3904 3931 3932 CONECT 3867 3879 3883 3905 3933 CONECT 3868 3869 3934 3935 3936 CONECT 3869 3868 3870 3872 3937 CONECT 3870 3869 3871 3938 3939 CONECT 3871 3870 3901 3940 3941 CONECT 3872 3869 3873 3901 3942 CONECT 3873 3872 3902 3916 CONECT 3874 3859 3861 3902 3943 CONECT 3875 3859 3917 3944 3945 CONECT 3876 3862 3863 3864 3877 CONECT 3877 3876 3946 3947 3948 CONECT 3878 3866 3901 3910 CONECT 3879 3867 3880 3881 3882 CONECT 3880 3879 3949 3950 3951 CONECT 3881 3879 3952 3953 3954 CONECT 3882 3879 3955 3956 3957 CONECT 3883 3867 3906 3914 CONECT 3884 3885 3893 3906 3958 CONECT 3885 3884 3907 3913 CONECT 3886 3887 3890 3907 3959 CONECT 3887 3886 3908 3918 CONECT 3888 3889 3908 3960 CONECT 3889 3888 3918 3961 CONECT 3890 3886 3891 3962 3963 CONECT 3891 3890 3911 3912 CONECT 3892 3911 3964 3965 3966 CONECT 3893 3884 3894 3900 3967 CONECT 3894 3893 3895 3899 CONECT 3895 3894 3896 3968 CONECT 3896 3895 3897 3969 CONECT 3897 3896 3898 3970 CONECT 3898 3897 3899 3971 CONECT 3899 3894 3898 3972 CONECT 3900 3893 3973 3974 3975 CONECT 3901 3871 3872 3878 CONECT 3902 3873 3874 3976 CONECT 3903 3861 3862 3977 CONECT 3904 3865 3866 3978 CONECT 3905 3865 3867 CONECT 3906 3883 3884 3979 CONECT 3907 3885 3886 3980 CONECT 3908 3887 3888 CONECT 3909 3917 CONECT 3910 3878 CONECT 3911 3891 3892 CONECT 3912 3891 CONECT 3913 3885 CONECT 3914 3883 CONECT 3915 3861 CONECT 3916 3873 CONECT 3917 3860 3875 3909 CONECT 3918 3887 3889 CONECT 3919 3859 CONECT 3920 3859 CONECT 3921 3860 CONECT 3922 3860 CONECT 3923 3860 CONECT 3924 3862 CONECT 3925 3863 CONECT 3926 3863 CONECT 3927 3863 CONECT 3928 3864 CONECT 3929 3864 CONECT 3930 3864 CONECT 3931 3866 CONECT 3932 3866 CONECT 3933 3867 CONECT 3934 3868 CONECT 3935 3868 CONECT 3936 3868 CONECT 3937 3869 CONECT 3938 3870 CONECT 3939 3870 CONECT 3940 3871 CONECT 3941 3871 CONECT 3942 3872 CONECT 3943 3874 CONECT 3944 3875 CONECT 3945 3875 CONECT 3946 3877 CONECT 3947 3877 CONECT 3948 3877 CONECT 3949 3880 CONECT 3950 3880 CONECT 3951 3880 CONECT 3952 3881 CONECT 3953 3881 CONECT 3954 3881 CONECT 3955 3882 CONECT 3956 3882 CONECT 3957 3882 CONECT 3958 3884 CONECT 3959 3886 CONECT 3960 3888 CONECT 3961 3889 CONECT 3962 3890 CONECT 3963 3890 CONECT 3964 3892 CONECT 3965 3892 CONECT 3966 3892 CONECT 3967 3893 CONECT 3968 3895 CONECT 3969 3896 CONECT 3970 3897 CONECT 3971 3898 CONECT 3972 3899 CONECT 3973 3900 CONECT 3974 3900 CONECT 3975 3900 CONECT 3976 3902 CONECT 3977 3903 CONECT 3978 3904 CONECT 3979 3906 CONECT 3980 3907 CONECT 4031 3846 CONECT 4163 3846 END