USER MOD reduce.3.24.130724 H: found=0, std=0, add=2134, rem=0, adj=78 USER MOD reduce.3.24.130724 removed 2120 hydrogens (3 hets) HEADER ONCOPROTEIN 09-APR-18 6G8P TITLE 14-3-3SIGMA IN COMPLEX WITH A P129BETA3P AND L132BETA3L MUTATED YAP TITLE 2 PS127 PHOSPHOPEPTIDE COMPND MOL_ID: 1; COMPND 2 MOLECULE: 14-3-3 PROTEIN SIGMA; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: EPITHELIAL CELL MARKER PROTEIN 1,STRATIFIN; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: TRANSCRIPTIONAL COACTIVATOR YAP1; COMPND 8 CHAIN: P; COMPND 9 FRAGMENT: UNP RESIDUES 124-133; COMPND 0 SYNONYM: YES-ASSOCIATED PROTEIN 1,PROTEIN YORKIE HOMOLOG,YES- COMPND 1 ASSOCIATED PROTEIN YAP65 HOMOLOG; COMPND 2 ENGINEERED: YES; COMPND 3 OTHER_DETAILS: EOE AND B3L ARE BETA3-AMINO ACID MUTATIONS SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: SFN, HME1; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 0 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 1 ORGANISM_COMMON: HUMAN; SOURCE 2 ORGANISM_TAXID: 9606 KEYWDS BETA AMINO ACID, HIPPO PATHWAY, YAP/TAZ, ONCOPROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR S.A.ANDREI,V.THIJSSEN,L.BRUNSVELD,C.OTTMANN,L.G.MILROY REVDAT 1 17-APR-19 6G8P 0 JRNL AUTH V.THIJSSEN,S.A.ANDREI,L.BRUNSVELD,C.OTTMANN,L.G.MILROY JRNL TITL EFFECT OF SINGLE, SYNTHETIC ALPHA-TO-BETA3-AMINO ACID POINT JRNL TITL 2 MUTATIONS ON PHOSPHOPEPTIDE-PROTEIN BINDING JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 41.59 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.360 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 3 NUMBER OF REFLECTIONS : 22861 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.135 REMARK 3 R VALUE (WORKING SET) : 0.133 REMARK 3 FREE R VALUE : 0.159 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.170 REMARK 3 FREE R VALUE TEST SET COUNT : 1181 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 41.6016 - 3.7992 1.00 2866 154 0.1543 0.1566 REMARK 3 2 3.7992 - 3.0158 1.00 2734 145 0.1262 0.1389 REMARK 3 3 3.0158 - 2.6347 1.00 2736 148 0.1410 0.1799 REMARK 3 4 2.6347 - 2.3938 1.00 2699 141 0.1215 0.1506 REMARK 3 5 2.3938 - 2.2222 1.00 2702 132 0.1153 0.1440 REMARK 3 6 2.2222 - 2.0912 1.00 2699 149 0.1200 0.1759 REMARK 3 7 2.0912 - 1.9865 1.00 2645 169 0.1263 0.1714 REMARK 3 8 1.9865 - 1.9000 0.97 2599 143 0.1414 0.1792 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) : 0.140 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 15.160 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 15.47 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 22.03 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 : NULL NULL REMARK 3 ANGLE : NULL NULL REMARK 3 CHIRALITY : NULL NULL REMARK 3 PLANARITY : NULL NULL REMARK 3 DIHEDRAL : NULL NULL 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 -4 THROUGH 70 ) REMARK 3 ORIGIN FOR THE GROUP (A): 28.8215 -10.7776 0.5812 REMARK 3 T TENSOR REMARK 3 T11: 0.0783 T22: 0.0764 REMARK 3 T33: 0.0967 T12: -0.0039 REMARK 3 T13: 0.0012 T23: 0.0093 REMARK 3 L TENSOR REMARK 3 L11: 0.4856 L22: 1.3786 REMARK 3 L33: 1.0288 L12: -0.1810 REMARK 3 L13: 0.4034 L23: -0.5295 REMARK 3 S TENSOR REMARK 3 S11: -0.0569 S12: 0.0001 S13: 0.0376 REMARK 3 S21: 0.0013 S22: 0.0609 S23: 0.0569 REMARK 3 S31: 0.0055 S32: -0.0391 S33: 0.0013 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 71 THROUGH 79 ) REMARK 3 ORIGIN FOR THE GROUP (A): 25.5041 11.6251 -27.8111 REMARK 3 T TENSOR REMARK 3 T11: 0.6001 T22: 0.4321 REMARK 3 T33: 0.4139 T12: 0.0916 REMARK 3 T13: -0.1100 T23: 0.1271 REMARK 3 L TENSOR REMARK 3 L11: 1.8316 L22: 0.2137 REMARK 3 L33: 0.9423 L12: -0.6256 REMARK 3 L13: 0.9043 L23: -0.3287 REMARK 3 S TENSOR REMARK 3 S11: 0.0677 S12: 0.5001 S13: 0.4334 REMARK 3 S21: -0.6687 S22: 0.2401 S23: 0.6798 REMARK 3 S31: -0.3186 S32: -0.5790 S33: -0.0385 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 80 THROUGH 139 ) REMARK 3 ORIGIN FOR THE GROUP (A): 31.3424 -14.8718 -10.3289 REMARK 3 T TENSOR REMARK 3 T11: 0.0763 T22: 0.1030 REMARK 3 T33: 0.0870 T12: -0.0260 REMARK 3 T13: 0.0008 T23: 0.0033 REMARK 3 L TENSOR REMARK 3 L11: 0.4117 L22: 2.1022 REMARK 3 L33: 0.7690 L12: 0.0238 REMARK 3 L13: 0.0549 L23: -0.4702 REMARK 3 S TENSOR REMARK 3 S11: -0.0429 S12: 0.0267 S13: -0.0366 REMARK 3 S21: -0.1863 S22: 0.0381 S23: -0.0974 REMARK 3 S31: 0.0396 S32: 0.0394 S33: 0.0037 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 140 THROUGH 161 ) REMARK 3 ORIGIN FOR THE GROUP (A): 26.1721 -27.0878 -16.0835 REMARK 3 T TENSOR REMARK 3 T11: 0.1087 T22: 0.1115 REMARK 3 T33: 0.0997 T12: 0.0002 REMARK 3 T13: 0.0077 T23: -0.0367 REMARK 3 L TENSOR REMARK 3 L11: 2.3838 L22: 3.2788 REMARK 3 L33: 3.4216 L12: 1.4979 REMARK 3 L13: -1.1330 L23: -2.1009 REMARK 3 S TENSOR REMARK 3 S11: -0.0996 S12: 0.1226 S13: -0.1814 REMARK 3 S21: -0.3221 S22: 0.0032 S23: -0.1690 REMARK 3 S31: 0.1868 S32: 0.1253 S33: 0.0394 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 162 THROUGH 209 ) REMARK 3 ORIGIN FOR THE GROUP (A): 12.4590 -25.9129 -12.2695 REMARK 3 T TENSOR REMARK 3 T11: 0.1112 T22: 0.1468 REMARK 3 T33: 0.1378 T12: -0.0321 REMARK 3 T13: -0.0066 T23: -0.0049 REMARK 3 L TENSOR REMARK 3 L11: 1.1884 L22: 0.4716 REMARK 3 L33: 1.2650 L12: 0.4706 REMARK 3 L13: -0.2113 L23: -0.1722 REMARK 3 S TENSOR REMARK 3 S11: 0.0019 S12: -0.0189 S13: 0.0339 REMARK 3 S21: -0.0387 S22: 0.0452 S23: 0.0853 REMARK 3 S31: 0.0442 S32: -0.1159 S33: -0.0270 REMARK 3 TLS GROUP : 6 REMARK 3 SELECTION: CHAIN 'A' AND (RESID 210 THROUGH 231 ) REMARK 3 ORIGIN FOR THE GROUP (A): 6.8649 -20.6132 -6.4680 REMARK 3 T TENSOR REMARK 3 T11: 0.1308 T22: 0.1894 REMARK 3 T33: 0.1778 T12: 0.0178 REMARK 3 T13: -0.0012 T23: -0.0087 REMARK 3 L TENSOR REMARK 3 L11: 1.5810 L22: 3.8375 REMARK 3 L33: 5.5881 L12: 0.1837 REMARK 3 L13: -0.3516 L23: -3.5505 REMARK 3 S TENSOR REMARK 3 S11: -0.0630 S12: -0.0515 S13: 0.1144 REMARK 3 S21: 0.3180 S22: 0.0365 S23: 0.0878 REMARK 3 S31: -0.4522 S32: -0.4255 S33: -0.0497 REMARK 3 TLS GROUP : 7 REMARK 3 SELECTION: CHAIN 'P' AND (RESID 125 THROUGH 128 ) REMARK 3 ORIGIN FOR THE GROUP (A): 15.3041 -14.3131 -9.8820 REMARK 3 T TENSOR REMARK 3 T11: 0.1294 T22: 0.1906 REMARK 3 T33: 0.2086 T12: -0.0047 REMARK 3 T13: 0.0110 T23: -0.0272 REMARK 3 L TENSOR REMARK 3 L11: 5.1433 L22: 4.0218 REMARK 3 L33: 6.8550 L12: 1.5185 REMARK 3 L13: 0.3352 L23: -1.3507 REMARK 3 S TENSOR REMARK 3 S11: -0.1027 S12: 0.0027 S13: 0.1504 REMARK 3 S21: -0.1414 S22: 0.0167 S23: 0.3723 REMARK 3 S31: -0.4275 S32: -0.5303 S33: 0.0549 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 6G8P COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 09-APR-18. REMARK 100 THE DEPOSITION ID IS D_1200009583. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 18-JUL-16 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 : PETRA III, DESY REMARK 200 BEAMLINE : P11 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0332 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M-F REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : AIMLESS 0.6.2 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 22902 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.900 REMARK 200 RESOLUTION RANGE LOW (A) : 66.080 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.7 REMARK 200 DATA REDUNDANCY : 11.20 REMARK 200 R MERGE (I) : 0.08500 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 21.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.94 REMARK 200 COMPLETENESS FOR SHELL (%) : 95.7 REMARK 200 DATA REDUNDANCY IN SHELL : 8.20 REMARK 200 R MERGE FOR SHELL (I) : 0.18200 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER 2.8.1 REMARK 200 STARTING MODEL: 3MHR REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 52.12 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.57 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.095 M HEPES, PH 7.1, 29% PEG 400, REMARK 280 0.19 M CACL2, 5% GLYCEROL, VAPOR DIFFUSION, SITTING DROP, REMARK 280 TEMPERATURE 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 31.23000 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 31.23000 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 41.01850 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 55.74950 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 41.01850 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 55.74950 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 31.23000 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 41.01850 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 55.74950 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 31.23000 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 41.01850 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 55.74950 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, P REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, P REMARK 350 BIOMT1 2 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A 731 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 734 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 736 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 ACE P 123 REMARK 465 ARG P 124 REMARK 465 ALA P 135 REMARK 465 SER P 136 REMARK 465 B3L P 137 REMARK 465 GLN P 138 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 EOE P 134 O1 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 640 O HOH A 654 1.91 REMARK 500 O HOH P 205 O HOH P 206 1.98 REMARK 500 O HOH A 548 O HOH A 703 1.98 REMARK 500 OE1 GLU A 110 O HOH A 401 2.04 REMARK 500 OD2 ASP A 211 O HOH A 402 2.06 REMARK 500 O HOH A 648 O HOH A 671 2.09 REMARK 500 O HOH A 682 O HOH A 696 2.09 REMARK 500 O HOH A 690 O HOH A 723 2.12 REMARK 500 O HOH A 645 O HOH A 647 2.12 REMARK 500 OG SER A 177 O HOH A 403 2.13 REMARK 500 OE1 GLU A 86 O HOH A 404 2.13 REMARK 500 OE2 GLU A 91 O HOH A 405 2.15 REMARK 500 O HOH A 413 O HOH A 428 2.16 REMARK 500 O HOH A 559 O HOH A 573 2.17 REMARK 500 OD1 ASP A 139 O HOH A 406 2.17 REMARK 500 O HOH A 651 O HOH A 703 2.17 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 O HOH A 603 O HOH A 632 3655 1.99 REMARK 500 O HOH A 646 O HOH A 733 8545 2.08 REMARK 500 O HOH A 520 O HOH A 616 4555 2.13 REMARK 500 O HOH A 658 O HOH A 687 6544 2.17 REMARK 500 O HOH A 654 O HOH A 687 3655 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 ARG A 18 77.97 -104.62 REMARK 500 HIS A 106 37.63 -146.88 REMARK 500 THR A 136 -6.32 -142.29 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 734 DISTANCE = 6.32 ANGSTROMS REMARK 525 HOH A 735 DISTANCE = 6.37 ANGSTROMS REMARK 525 HOH A 736 DISTANCE = 7.62 ANGSTROMS 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 CA A 302 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 2 OE1 REMARK 620 2 HOH A 687 O 124.9 REMARK 620 3 HOH A 640 O 70.4 54.5 REMARK 620 4 HOH A 654 O 73.3 64.0 37.5 REMARK 620 5 HOH A 466 O 71.2 131.8 116.1 83.4 REMARK 620 6 GLU A 2 OE1 0.0 124.9 70.4 73.3 71.2 REMARK 620 7 HOH A 687 O 110.8 55.5 72.3 43.2 76.4 110.8 REMARK 620 8 HOH A 466 O 75.1 77.2 59.9 97.0 144.7 75.1 126.7 REMARK 620 9 HOH A 640 O 140.4 83.5 129.1 102.1 69.2 140.4 59.6 143.4 REMARK 620 N 1 2 3 4 5 6 7 8 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 301 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 188 OE2 REMARK 620 2 HOH A 534 O 71.7 REMARK 620 3 GLU A 35 OE1 60.3 107.0 REMARK 620 4 GLU A 35 OE2 62.6 107.9 2.3 REMARK 620 5 GLU A 110 O 58.6 107.0 2.1 4.3 REMARK 620 6 HOH A 536 O 153.6 86.5 143.4 141.1 145.4 REMARK 620 7 HOH A 614 O 101.2 90.2 53.9 52.0 56.0 93.3 REMARK 620 N 1 2 3 4 5 6 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CA A 301 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CA A 302 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 303 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 6G8I RELATED DB: PDB REMARK 900 SIMILAR STRUCTURE IN SAME STUDY REMARK 900 RELATED ID: 6G6X RELATED DB: PDB REMARK 900 SIMILAR STRUCTURE IN SAME STUDY REMARK 900 RELATED ID: 6G8J RELATED DB: PDB REMARK 900 SIMILAR STRUCTURE IN SAME STUDY REMARK 900 RELATED ID: 6G8K RELATED DB: PDB REMARK 900 SIMILAR STRUCTURE IN SAME STUDY REMARK 900 RELATED ID: 6G8L RELATED DB: PDB REMARK 900 SIMILAR STRUCTURE IN SAME STUDY DBREF 6G8P A 1 231 UNP P31947 1433S_HUMAN 1 231 DBREF 6G8P P 124 138 UNP P46937 YAP1_HUMAN 124 133 SEQADV 6G8P GLY A -4 UNP P31947 EXPRESSION TAG SEQADV 6G8P ALA A -3 UNP P31947 EXPRESSION TAG SEQADV 6G8P MET A -2 UNP P31947 EXPRESSION TAG SEQADV 6G8P GLY A -1 UNP P31947 EXPRESSION TAG SEQADV 6G8P SER A 0 UNP P31947 EXPRESSION TAG SEQADV 6G8P ACE P 123 UNP P46937 ACETYLATION SEQRES 1 A 236 GLY ALA MET GLY SER MET GLU ARG ALA SER LEU ILE GLN SEQRES 2 A 236 LYS ALA LYS LEU ALA GLU GLN ALA GLU ARG TYR GLU ASP SEQRES 3 A 236 MET ALA ALA PHE MET LYS GLY ALA VAL GLU LYS GLY GLU SEQRES 4 A 236 GLU LEU SER CYS GLU GLU ARG ASN LEU LEU SER VAL ALA SEQRES 5 A 236 TYR LYS ASN VAL VAL GLY GLY GLN ARG ALA ALA TRP ARG SEQRES 6 A 236 VAL LEU SER SER ILE GLU GLN LYS SER ASN GLU GLU GLY SEQRES 7 A 236 SER GLU GLU LYS GLY PRO GLU VAL ARG GLU TYR ARG GLU SEQRES 8 A 236 LYS VAL GLU THR GLU LEU GLN GLY VAL CYS ASP THR VAL SEQRES 9 A 236 LEU GLY LEU LEU ASP SER HIS LEU ILE LYS GLU ALA GLY SEQRES 10 A 236 ASP ALA GLU SER ARG VAL PHE TYR LEU LYS MET LYS GLY SEQRES 11 A 236 ASP TYR TYR ARG TYR LEU ALA GLU VAL ALA THR GLY ASP SEQRES 12 A 236 ASP LYS LYS ARG ILE ILE ASP SER ALA ARG SER ALA TYR SEQRES 13 A 236 GLN GLU ALA MET ASP ILE SER LYS LYS GLU MET PRO PRO SEQRES 14 A 236 THR ASN PRO ILE ARG LEU GLY LEU ALA LEU ASN PHE SER SEQRES 15 A 236 VAL PHE HIS TYR GLU ILE ALA ASN SER PRO GLU GLU ALA SEQRES 16 A 236 ILE SER LEU ALA LYS THR THR PHE ASP GLU ALA MET ALA SEQRES 17 A 236 ASP LEU HIS THR LEU SER GLU ASP SER TYR LYS ASP SER SEQRES 18 A 236 THR LEU ILE MET GLN LEU LEU ARG ASP ASN LEU THR LEU SEQRES 19 A 236 TRP THR SEQRES 1 P 11 ACE ARG ALA HIS SEP SER EOE ALA SER B3L GLN MODRES 6G8P SEP P 127 SER MODIFIED RESIDUE MODRES 6G8P EOE P 134 PRO MODIFIED RESIDUE HET SEP P 127 13 HET EOE P 134 16 HET CA A 301 1 HET CA A 302 1 HET CL A 303 1 HETNAM SEP PHOSPHOSERINE HETNAM EOE BETA3-PROLINE HETNAM CA CALCIUM ION HETNAM CL CHLORIDE ION HETSYN SEP PHOSPHONOSERINE FORMUL 2 SEP C3 H8 N O6 P FORMUL 2 EOE C6 H11 N O2 FORMUL 3 CA 2(CA 2+) FORMUL 5 CL CL 1- FORMUL 6 HOH *349(H2 O) HELIX 1 AA1 GLU A 2 ALA A 16 1 15 HELIX 2 AA2 ARG A 18 GLU A 31 1 14 HELIX 3 AA3 SER A 37 ASN A 70 1 34 HELIX 4 AA4 PRO A 79 SER A 105 1 27 HELIX 5 AA5 HIS A 106 ALA A 111 1 6 HELIX 6 AA6 ASP A 113 ALA A 135 1 23 HELIX 7 AA7 ASP A 139 MET A 162 1 24 HELIX 8 AA8 ASN A 166 ILE A 183 1 18 HELIX 9 AA9 SER A 186 ALA A 203 1 18 HELIX 10 AB1 ASP A 204 LEU A 208 5 5 HELIX 11 AB2 SER A 209 THR A 231 1 23 LINK OE1 GLU A 2 CA CA A 302 1555 1555 2.75 LINK OE2 GLU A 188 CA CA A 301 1555 1555 2.39 LINK C HIS P 126 N SEP P 127 1555 1555 1.32 LINK C SEP P 127 N SER P 128 1555 1555 1.33 LINK C SER P 128 N08AEOE P 134 1555 1555 1.43 LINK C SER P 128 N08BEOE P 134 1555 1555 1.43 LINK CA CA A 301 O HOH A 534 1555 1555 2.38 LINK CA CA A 302 O HOH A 687 1555 1555 2.80 LINK CA CA A 302 O HOH A 640 1555 1555 2.94 LINK CA CA A 302 O HOH A 654 1555 1555 3.02 LINK CA CA A 302 O HOH A 466 1555 1555 2.56 LINK OE1 GLU A 2 CA CA A 302 1555 3655 2.20 LINK OE1 GLU A 35 CA CA A 301 1555 6545 2.30 LINK OE2 GLU A 35 CA CA A 301 1555 6545 2.79 LINK O GLU A 110 CA CA A 301 1555 6545 2.32 LINK CA CA A 301 O HOH A 536 1555 6544 2.25 LINK CA CA A 301 O HOH A 614 1555 6544 2.33 LINK CA CA A 302 O HOH A 687 1555 3655 2.88 LINK CA CA A 302 O HOH A 466 1555 3655 2.59 LINK CA CA A 302 O HOH A 640 1555 3655 2.32 LINK CA CA A 302 O HOH A 654 1555 3655 2.37 CISPEP 1 SER A 105 HIS A 106 0 7.99 SITE *** AC1 6 GLU A 35 GLU A 110 GLU A 188 HOH A 534 SITE *** AC1 6 HOH A 536 HOH A 614 SITE *** AC2 5 GLU A 2 HOH A 466 HOH A 640 HOH A 654 SITE *** AC2 5 HOH A 687 SITE *** AC3 3 LYS A 9 HOH A 635 HOH A 693 CRYST1 82.037 111.499 62.460 90.00 90.00 90.00 C 2 2 21 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.012190 0.000000 0.000000 0.00000 SCALE2 0.000000 0.008969 0.000000 0.00000 SCALE3 0.000000 0.000000 0.016010 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: P 127 SEP H2 : P 127 SEP N : P 126 HIS C :(H bumps) USER MOD NoAdj-H: P 127 SEP H : P 127 SEP N : P 126 HIS C :(H bumps) USER MOD Set 1.1: A 122 LYS NZ :NH3+ -169:sc= 1.22 (180deg=0.595) USER MOD Set 1.2: A 175 ASN : amide:sc= 1.29 K(o=4.8,f=-3.8!) USER MOD Set 1.3: P 128 SER OG : rot 98:sc= 2.3 USER MOD Set 2.1: A 226 ASN : amide:sc= 1.57 K(o=1,f=-6.3!) USER MOD Set 2.2: P 126 HIS : no HD1:sc= -0.545 K(o=1,f=-0.27) USER MOD Set 3.1: A 209 SER OG : rot -68:sc= 0.085 USER MOD Set 3.2: A 212 SER OG : rot 149:sc= 0.145 USER MOD Set 4.1: A 202 MET CE A:methyl -151:sc= -1.75! (180deg=-0.575) USER MOD Set 4.2: A 220 MET CE :methyl 162:sc= -1.34 (180deg=-1.12) USER MOD Set 5.1: A 162 MET CE B:methyl 171:sc= -1.4 (180deg=-0.34) USER MOD Set 5.2: A 166 ASN : amide:sc= -0.944 K(o=-2.3,f=-11!) USER MOD Set 6.1: A 106 HIS : no HD1:sc= -0.601 K(o=1.7,f=-9.7!) USER MOD Set 6.2: A 109 LYS NZ :NH3+ -179:sc= 2.34 (180deg=1.02) USER MOD Set 7.1: A 64 SER OG A: rot -97:sc= 0.349 USER MOD Set 7.2: A 68 LYS NZ B:NH3+ 176:sc= 0.221 (180deg=0.217) USER MOD Set 8.1: A 38 CYS SG : rot -27:sc= 1.06 USER MOD Set 8.2: A 42 ASN : amide:sc= 1.5 K(o=2.6,f=1.7) USER MOD Set 9.1: A 1 MET CE :methyl -166:sc= -0.0492 (180deg=-0.357) USER MOD Set 9.2: A 9 LYS NZ :NH3+ -174:sc= 0.21 (180deg=0.201) USER MOD Single : A 0 SER OG : rot 84:sc= 1.39 USER MOD Single : A 5 SER OG : rot 2:sc= 0.538 USER MOD Single : A 8 GLN A: amide:sc= 1.02 K(o=1,f=-0.28) USER MOD Single : A 8 GLN B: amide:sc= 0.062 K(o=0.062,f=-3.3!) USER MOD Single : A -2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -4 GLY N :NH3+ 157:sc= 0.0898 (180deg=0.0335) USER MOD Single : A 11 LYS NZ :NH3+ -174:sc= 1.72 (180deg=1.69) USER MOD Single : A 15 GLN : amide:sc= 1.04 K(o=1,f=-1.8!) USER MOD Single : A 19 TYR OH : rot 180:sc= 0.405 USER MOD Single : A 22 MET CE :methyl -179:sc= -0.09 (180deg=-0.0918) USER MOD Single : A 26 MET CE :methyl -169:sc=-0.00832 (180deg=-0.25) USER MOD Single : A 27 LYS NZ :NH3+ -138:sc= 1.95 (180deg=0.804) USER MOD Single : A 32 LYS NZ :NH3+ -127:sc= 1.18 (180deg=0.231) USER MOD Single : A 37 SER OG : rot 172:sc= 1.15 USER MOD Single : A 45 SER OG : rot 25:sc= 1.83 USER MOD Single : A 48 TYR OH : rot -38:sc= 0.896 USER MOD Single : A 49 LYS NZ :NH3+ -179:sc= 1.53 (180deg=1.53) USER MOD Single : A 50 ASN : amide:sc= 1.94 K(o=1.9,f=1.3) USER MOD Single : A 55 GLN : amide:sc= -1.07 K(o=-1.1,f=-3.6!) USER MOD Single : A 63 SER OG A: rot 159:sc= 1.09 USER MOD Single : A 63 SER OG B: rot 175:sc= 1.21 USER MOD Single : A 64 SER OG C: rot 76:sc= 1.34 USER MOD Single : A 67 GLN : amide:sc= -0.076 X(o=-0.076,f=0) USER MOD Single : A 68 LYS NZ A:NH3+ 180:sc= 0.765 (180deg=0.765) USER MOD Single : A 69 SER OG : rot -68:sc= 2.37 USER MOD Single : A 70 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 74 SER OG : rot -162:sc= 1.03 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ A:NH3+ -124:sc= 1.18 (180deg=-0.463) USER MOD Single : A 87 LYS NZ B:NH3+ 172:sc= 0 (180deg=-0.0319) USER MOD Single : A 90 THR OG1 : rot 78:sc= 0.631 USER MOD Single : A 93 GLN : amide:sc= 1.74 K(o=1.7,f=0.078) USER MOD Single : A 96 CYS SG : rot 75:sc=-0.00491 USER MOD Single : A 98 THR OG1 : rot 81:sc= 0.478 USER MOD Single : A 105 SER OG : rot 112:sc= 1.08 USER MOD Single : A 116 SER OG : rot -23:sc= 0.206 USER MOD Single : A 120 TYR OH : rot -170:sc= 1.2 USER MOD Single : A 123 MET CE A:methyl 158:sc= -0.0725 (180deg=-0.435) USER MOD Single : A 123 MET CE B:methyl 155:sc= -0.382 (180deg=-0.639) USER MOD Single : A 124 LYS NZ :NH3+ 157:sc= 1.21 (180deg=0.722) USER MOD Single : A 127 TYR OH : rot -4:sc= 1.14 USER MOD Single : A 128 TYR OH : rot 30:sc= 1.19 USER MOD Single : A 130 TYR OH : rot -10:sc= 0.428 USER MOD Single : A 136 THR OG1 : rot -138:sc= 0.366 USER MOD Single : A 140 LYS NZ :NH3+ 153:sc= 0.0669 (180deg=0.0194) USER MOD Single : A 141 LYS NZ :NH3+ 162:sc= 0.83 (180deg=0.677) USER MOD Single : A 146 SER OG : rot 77:sc= 1.27 USER MOD Single : A 149 SER OG A: rot 22:sc= 0.00343 USER MOD Single : A 149 SER OG B: rot 78:sc= 0.526 USER MOD Single : A 151 TYR OH : rot -19:sc= 1.49 USER MOD Single : A 152 GLN : amide:sc= 2.04 K(o=2,f=1.3) USER MOD Single : A 155 MET CE :methyl -175:sc= -1.07 (180deg=-1.22) USER MOD Single : A 158 SER OG : rot -41:sc= 0.24 USER MOD Single : A 159 LYS NZ :NH3+ -131:sc= 0.523 (180deg=0) USER MOD Single : A 160 LYS NZ A:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ B:NH3+ -167:sc=-0.00361 (180deg=-0.051) USER MOD Single : A 162 MET CE A:methyl -160:sc= -0.684 (180deg=-0.722) USER MOD Single : A 165 THR OG1 : rot -97:sc= 1.78 USER MOD Single : A 177 SER OG A: rot 178:sc= -0.504! USER MOD Single : A 177 SER OG B: rot 95:sc= 1.27 USER MOD Single : A 180 HIS : no HE2:sc= 1.71 K(o=1.7,f=-1.6) USER MOD Single : A 181 TYR OH : rot 30:sc= 1.1 USER MOD Single : A 185 ASN : amide:sc= -0.159 X(o=-0.16,f=-0.5) USER MOD Single : A 186 SER OG : rot 59:sc= 2.07 USER MOD Single : A 192 SER OG A: rot 73:sc= 1.48 USER MOD Single : A 192 SER OG B: rot -119:sc= 0.884 USER MOD Single : A 195 LYS NZ A:NH3+ -142:sc= 0.159 (180deg=-0.896) USER MOD Single : A 195 LYS NZ B:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 196 THR OG1A: rot 79:sc= 0.989 USER MOD Single : A 196 THR OG1B: rot -79:sc= 1.14 USER MOD Single : A 197 THR OG1 : rot 82:sc= 2.28 USER MOD Single : A 202 MET CE B:methyl -158:sc= -0.083 (180deg=-0.487) USER MOD Single : A 206 HIS : no HD1:sc= -0.0084 X(o=-0.0084,f=-0.15) USER MOD Single : A 207 THR OG1 : rot -71:sc= 1.03 USER MOD Single : A 213 TYR OH A: rot 180:sc= 0 USER MOD Single : A 213 TYR OH B: rot 180:sc= 0 USER MOD Single : A 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 216 SER OG : rot -89:sc= 2.28 USER MOD Single : A 217 THR OG1 : rot -76:sc= 0.52 USER MOD Single : A 221 GLN : amide:sc= 0.285 X(o=0.28,f=-0.045) USER MOD Single : A 228 THR OG1 : rot 74:sc= 0.171 USER MOD Single : A 231 THR OG1 : rot -78:sc= 1.33 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 45.299 -12.885 4.362 1.00 52.35 N ANISOU 1 N GLY A -4 6196 6617 7079 47 -141 254 N ATOM 2 CA GLY A -4 44.119 -11.990 4.200 1.00 40.58 C ANISOU 2 CA GLY A -4 4767 5106 5545 13 -146 227 C ATOM 3 C GLY A -4 43.869 -11.198 5.462 1.00 36.59 C ANISOU 3 C GLY A -4 4312 4555 5038 -15 -236 211 C ATOM 4 O GLY A -4 44.372 -11.557 6.526 1.00 27.93 O ANISOU 4 O GLY A -4 3224 3436 3952 -4 -292 209 O ATOM 0 H1 GLY A -4 45.243 -13.559 3.783 1.00 52.35 H new ATOM 0 H2 GLY A -4 46.045 -12.424 4.209 1.00 52.35 H new ATOM 0 H3 GLY A -4 45.315 -13.208 5.191 1.00 52.35 H new ATOM 0 HA2 GLY A -4 44.267 -11.384 3.457 1.00 40.58 H new ATOM 0 HA3 GLY A -4 43.335 -12.518 3.984 1.00 40.58 H new ATOM 10 N ALA A -3 43.086 -10.122 5.348 1.00 23.05 N ANISOU 10 N ALA A -3 2636 2819 3302 -45 -252 198 N ATOM 11 CA ALA A -3 42.861 -9.243 6.486 1.00 29.07 C ANISOU 11 CA ALA A -3 3459 3531 4056 -64 -337 181 C ATOM 12 C ALA A -3 42.077 -9.928 7.596 1.00 16.68 C ANISOU 12 C ALA A -3 1973 1938 2425 -27 -342 134 C ATOM 13 O ALA A -3 42.100 -9.456 8.738 1.00 25.98 O ANISOU 13 O ALA A -3 3209 3073 3588 -29 -413 120 O ATOM 14 CB ALA A -3 42.132 -7.979 6.035 1.00 36.05 C ANISOU 14 CB ALA A -3 4373 4397 4929 -93 -345 176 C ATOM 0 H ALA A -3 42.682 -9.889 4.626 1.00 23.05 H new ATOM 0 HA ALA A -3 43.730 -9.008 6.847 1.00 29.07 H new ATOM 0 HB1 ALA A -3 41.986 -7.399 6.799 1.00 36.05 H new ATOM 0 HB2 ALA A -3 42.669 -7.514 5.374 1.00 36.05 H new ATOM 0 HB3 ALA A -3 41.277 -8.220 5.645 1.00 36.05 H new ATOM 20 N MET A -2 41.395 -11.029 7.293 1.00 16.35 N ANISOU 20 N MET A -2 1944 1920 2347 6 -270 114 N ATOM 21 CA MET A -2 40.637 -11.782 8.284 1.00 13.19 C ANISOU 21 CA MET A -2 1615 1503 1892 38 -265 81 C ATOM 22 C MET A -2 41.410 -12.968 8.842 1.00 12.50 C ANISOU 22 C MET A -2 1518 1418 1813 62 -276 88 C ATOM 23 O MET A -2 40.856 -13.741 9.632 1.00 12.17 O ANISOU 23 O MET A -2 1535 1363 1727 87 -269 67 O ATOM 24 CB MET A -2 39.322 -12.267 7.665 1.00 11.90 C ANISOU 24 CB MET A -2 1474 1359 1688 51 -190 61 C ATOM 25 CG MET A -2 38.432 -11.130 7.168 1.00 13.66 C ANISOU 25 CG MET A -2 1710 1579 1903 33 -180 54 C ATOM 26 SD MET A -2 37.913 -9.998 8.477 1.00 16.99 S ANISOU 26 SD MET A -2 2209 1955 2292 42 -236 32 S ATOM 27 CE MET A -2 37.001 -8.799 7.495 1.00 27.24 C ANISOU 27 CE MET A -2 3500 3254 3595 26 -215 32 C ATOM 0 H MET A -2 41.360 -11.361 6.501 1.00 16.35 H new ATOM 0 HA MET A -2 40.461 -11.183 9.026 1.00 13.19 H new ATOM 0 HB2 MET A -2 39.520 -12.861 6.924 1.00 11.90 H new ATOM 0 HB3 MET A -2 38.834 -12.787 8.323 1.00 11.90 H new ATOM 0 HG2 MET A -2 38.908 -10.630 6.487 1.00 13.66 H new ATOM 0 HG3 MET A -2 37.645 -11.506 6.744 1.00 13.66 H new ATOM 0 HE1 MET A -2 36.649 -8.106 8.075 1.00 27.24 H new ATOM 0 HE2 MET A -2 37.593 -8.401 6.838 1.00 27.24 H new ATOM 0 HE3 MET A -2 36.268 -9.243 7.041 1.00 27.24 H new ATOM 37 N GLY A -1 42.684 -13.112 8.472 1.00 13.14 N ANISOU 37 N GLY A -1 1524 1514 1953 58 -295 121 N ATOM 38 CA GLY A -1 43.460 -14.271 8.868 1.00 17.56 C ANISOU 38 CA GLY A -1 2065 2077 2529 89 -302 132 C ATOM 39 C GLY A -1 43.711 -14.371 10.356 1.00 13.10 C ANISOU 39 C GLY A -1 1556 1472 1948 95 -382 124 C ATOM 40 O GLY A -1 43.950 -15.473 10.857 1.00 12.83 O ANISOU 40 O GLY A -1 1538 1432 1903 126 -384 122 O ATOM 0 H GLY A -1 43.113 -12.543 7.990 1.00 13.14 H new ATOM 0 HA2 GLY A -1 42.999 -15.072 8.574 1.00 17.56 H new ATOM 0 HA3 GLY A -1 44.313 -14.249 8.407 1.00 17.56 H new ATOM 44 N SER A 0 43.662 -13.252 11.076 1.00 10.42 N ANISOU 44 N SER A 0 1259 1100 1601 67 -452 119 N ATOM 45 CA SER A 0 43.906 -13.267 12.512 1.00 10.77 C ANISOU 45 CA SER A 0 1375 1099 1618 74 -536 109 C ATOM 46 C SER A 0 42.632 -13.451 13.335 1.00 12.14 C ANISOU 46 C SER A 0 1661 1252 1699 98 -510 69 C ATOM 47 O SER A 0 42.725 -13.560 14.561 1.00 11.94 O ANISOU 47 O SER A 0 1713 1189 1633 111 -568 58 O ATOM 48 CB SER A 0 44.613 -11.977 12.946 1.00 11.72 C ANISOU 48 CB SER A 0 1497 1183 1772 33 -640 126 C ATOM 49 OG SER A 0 43.825 -10.844 12.645 1.00 20.44 O ANISOU 49 OG SER A 0 2639 2276 2853 14 -629 107 O ATOM 0 H SER A 0 43.489 -12.475 10.750 1.00 10.42 H new ATOM 0 HA SER A 0 44.473 -14.035 12.684 1.00 10.77 H new ATOM 0 HB2 SER A 0 44.792 -12.007 13.899 1.00 11.72 H new ATOM 0 HB3 SER A 0 45.471 -11.907 12.498 1.00 11.72 H new ATOM 0 HG SER A 0 43.268 -10.718 13.261 1.00 20.44 H new ATOM 55 N MET A 1 41.454 -13.484 12.708 1.00 12.93 N ANISOU 55 N MET A 1 1771 1375 1766 105 -424 50 N ATOM 56 CA MET A 1 40.205 -13.619 13.444 1.00 11.99 C ANISOU 56 CA MET A 1 1742 1245 1569 129 -389 22 C ATOM 57 C MET A 1 39.729 -15.067 13.470 1.00 12.98 C ANISOU 57 C MET A 1 1875 1388 1669 151 -330 24 C ATOM 58 O MET A 1 39.778 -15.772 12.457 1.00 12.41 O ANISOU 58 O MET A 1 1742 1344 1628 149 -282 33 O ATOM 59 CB MET A 1 39.103 -12.742 12.851 1.00 9.61 C ANISOU 59 CB MET A 1 1446 955 1251 123 -339 8 C ATOM 60 CG MET A 1 38.067 -12.323 13.901 1.00 12.65 C ANISOU 60 CG MET A 1 1930 1317 1561 152 -329 -16 C ATOM 61 SD MET A 1 36.614 -11.489 13.233 1.00 16.63 S ANISOU 61 SD MET A 1 2431 1838 2048 160 -258 -28 S ATOM 62 CE MET A 1 37.385 -10.115 12.381 1.00 21.85 C ANISOU 62 CE MET A 1 3048 2484 2770 122 -317 -23 C ATOM 0 H MET A 1 41.361 -13.429 11.855 1.00 12.93 H new ATOM 0 HA MET A 1 40.387 -13.326 14.351 1.00 11.99 H new ATOM 0 HB2 MET A 1 39.500 -11.950 12.457 1.00 9.61 H new ATOM 0 HB3 MET A 1 38.659 -13.223 12.135 1.00 9.61 H new ATOM 0 HG2 MET A 1 37.778 -13.112 14.386 1.00 12.65 H new ATOM 0 HG3 MET A 1 38.495 -11.736 14.544 1.00 12.65 H new ATOM 0 HE1 MET A 1 36.711 -9.455 12.156 1.00 21.85 H new ATOM 0 HE2 MET A 1 38.053 -9.711 12.956 1.00 21.85 H new ATOM 0 HE3 MET A 1 37.809 -10.434 11.569 1.00 21.85 H new ATOM 72 N GLU A 2 39.251 -15.492 14.642 1.00 10.72 N ANISOU 72 N GLU A 2 1672 1081 1320 174 -334 15 N ATOM 73 CA GLU A 2 38.697 -16.830 14.810 1.00 12.86 C ANISOU 73 CA GLU A 2 1962 1362 1562 189 -284 22 C ATOM 74 C GLU A 2 37.590 -17.099 13.800 1.00 13.78 C ANISOU 74 C GLU A 2 2043 1511 1683 179 -200 23 C ATOM 75 O GLU A 2 36.778 -16.224 13.494 1.00 10.11 O ANISOU 75 O GLU A 2 1575 1057 1208 173 -170 15 O ATOM 76 CB GLU A 2 38.128 -16.999 16.217 1.00 9.49 C ANISOU 76 CB GLU A 2 1637 912 1057 211 -289 17 C ATOM 77 CG GLU A 2 39.156 -17.020 17.325 1.00 10.07 C ANISOU 77 CG GLU A 2 1765 947 1114 222 -379 18 C ATOM 78 CD GLU A 2 39.785 -18.373 17.489 1.00 17.56 C ANISOU 78 CD GLU A 2 2703 1889 2078 230 -396 37 C ATOM 79 OE1 GLU A 2 39.646 -19.197 16.564 1.00 16.38 O ANISOU 79 OE1 GLU A 2 2496 1764 1965 225 -346 46 O ATOM 80 OE2 GLU A 2 40.397 -18.623 18.548 1.00 17.90 O ANISOU 80 OE2 GLU A 2 2807 1899 2094 242 -464 42 O ATOM 0 H GLU A 2 39.240 -15.013 15.356 1.00 10.72 H new ATOM 0 HA GLU A 2 39.419 -17.462 14.667 1.00 12.86 H new ATOM 0 HB2 GLU A 2 37.504 -16.277 16.387 1.00 9.49 H new ATOM 0 HB3 GLU A 2 37.621 -17.825 16.249 1.00 9.49 H new ATOM 0 HG2 GLU A 2 39.846 -16.365 17.136 1.00 10.07 H new ATOM 0 HG3 GLU A 2 38.736 -16.757 18.159 1.00 10.07 H new ATOM 87 N ARG A 3 37.536 -18.343 13.323 1.00 12.84 N ANISOU 87 N ARG A 3 1904 1400 1575 179 -170 34 N ATOM 88 CA ARG A 3 36.462 -18.756 12.428 1.00 12.45 C ANISOU 88 CA ARG A 3 1833 1372 1527 164 -106 38 C ATOM 89 C ARG A 3 35.096 -18.453 13.033 1.00 10.95 C ANISOU 89 C ARG A 3 1682 1189 1291 164 -65 43 C ATOM 90 O ARG A 3 34.219 -17.896 12.367 1.00 11.19 O ANISOU 90 O ARG A 3 1683 1240 1330 152 -27 44 O ATOM 91 CB ARG A 3 36.592 -20.249 12.126 1.00 12.31 C ANISOU 91 CB ARG A 3 1817 1345 1515 167 -95 49 C ATOM 92 CG ARG A 3 35.618 -20.756 11.072 1.00 8.99 C ANISOU 92 CG ARG A 3 1377 937 1101 145 -48 54 C ATOM 93 CD ARG A 3 35.750 -22.261 10.907 1.00 12.53 C ANISOU 93 CD ARG A 3 1850 1363 1548 149 -49 62 C ATOM 94 NE ARG A 3 35.022 -22.728 9.737 1.00 12.67 N ANISOU 94 NE ARG A 3 1855 1382 1576 126 -22 64 N ATOM 95 CZ ARG A 3 33.709 -22.945 9.698 1.00 16.03 C ANISOU 95 CZ ARG A 3 2292 1811 1989 94 2 83 C ATOM 96 NH1 ARG A 3 32.963 -22.738 10.773 1.00 12.06 N ANISOU 96 NH1 ARG A 3 1807 1316 1461 88 17 103 N ATOM 97 NH2 ARG A 3 33.141 -23.372 8.576 1.00 14.71 N ANISOU 97 NH2 ARG A 3 2117 1638 1833 70 10 85 N ATOM 0 H ARG A 3 38.109 -18.958 13.506 1.00 12.84 H new ATOM 0 HA ARG A 3 36.537 -18.254 11.602 1.00 12.45 H new ATOM 0 HB2 ARG A 3 37.498 -20.432 11.830 1.00 12.31 H new ATOM 0 HB3 ARG A 3 36.455 -20.748 12.946 1.00 12.31 H new ATOM 0 HG2 ARG A 3 34.710 -20.531 11.328 1.00 8.99 H new ATOM 0 HG3 ARG A 3 35.791 -20.316 10.225 1.00 8.99 H new ATOM 0 HD2 ARG A 3 36.687 -22.499 10.824 1.00 12.53 H new ATOM 0 HD3 ARG A 3 35.413 -22.707 11.700 1.00 12.53 H new ATOM 0 HE ARG A 3 35.472 -22.874 9.019 1.00 12.67 H new ATOM 0 HH11 ARG A 3 33.326 -22.462 11.502 1.00 12.06 H new ATOM 0 HH12 ARG A 3 32.115 -22.880 10.742 1.00 12.06 H new ATOM 0 HH21 ARG A 3 33.621 -23.508 7.876 1.00 14.71 H new ATOM 0 HH22 ARG A 3 32.293 -23.512 8.550 1.00 14.71 H new ATOM 111 N ALA A 4 34.895 -18.823 14.302 1.00 10.93 N ANISOU 111 N ALA A 4 1743 1171 1238 181 -68 51 N ATOM 112 CA ALA A 4 33.589 -18.630 14.924 1.00 11.86 C ANISOU 112 CA ALA A 4 1894 1301 1310 189 -14 65 C ATOM 113 C ALA A 4 33.248 -17.150 15.046 1.00 13.26 C ANISOU 113 C ALA A 4 2079 1485 1474 207 -9 46 C ATOM 114 O ALA A 4 32.080 -16.767 14.922 1.00 11.77 O ANISOU 114 O ALA A 4 1877 1318 1276 212 48 57 O ATOM 115 CB ALA A 4 33.553 -19.303 16.295 1.00 18.46 C ANISOU 115 CB ALA A 4 2808 2120 2086 209 -17 80 C ATOM 0 H ALA A 4 35.491 -19.180 14.808 1.00 10.93 H new ATOM 0 HA ALA A 4 32.920 -19.042 14.355 1.00 11.86 H new ATOM 0 HB1 ALA A 4 32.681 -19.169 16.699 1.00 18.46 H new ATOM 0 HB2 ALA A 4 33.719 -20.253 16.194 1.00 18.46 H new ATOM 0 HB3 ALA A 4 34.236 -18.915 16.864 1.00 18.46 H new ATOM 121 N SER A 5 34.255 -16.308 15.291 1.00 12.23 N ANISOU 121 N SER A 5 1968 1331 1348 216 -72 22 N ATOM 122 CA SER A 5 34.035 -14.867 15.375 1.00 10.59 C ANISOU 122 CA SER A 5 1778 1116 1129 231 -81 2 C ATOM 123 C SER A 5 33.655 -14.287 14.015 1.00 8.53 C ANISOU 123 C SER A 5 1441 879 922 208 -57 1 C ATOM 124 O SER A 5 32.816 -13.382 13.932 1.00 9.90 O ANISOU 124 O SER A 5 1618 1058 1085 224 -28 -5 O ATOM 125 CB SER A 5 35.289 -14.179 15.912 1.00 12.52 C ANISOU 125 CB SER A 5 2063 1321 1373 234 -172 -18 C ATOM 126 OG SER A 5 35.624 -14.664 17.197 1.00 11.51 O ANISOU 126 OG SER A 5 2017 1167 1189 257 -203 -18 O ATOM 0 H SER A 5 35.071 -16.553 15.411 1.00 12.23 H new ATOM 0 HA SER A 5 33.297 -14.707 15.984 1.00 10.59 H new ATOM 0 HB2 SER A 5 36.029 -14.328 15.303 1.00 12.52 H new ATOM 0 HB3 SER A 5 35.144 -13.221 15.952 1.00 12.52 H new ATOM 0 HG SER A 5 35.081 -15.265 17.420 1.00 11.51 H new ATOM 132 N LEU A 6 34.268 -14.792 12.942 1.00 9.52 N ANISOU 132 N LEU A 6 1500 1014 1101 177 -69 8 N ATOM 133 CA LEU A 6 33.904 -14.348 11.600 1.00 11.30 C ANISOU 133 CA LEU A 6 1662 1261 1370 154 -46 10 C ATOM 134 C LEU A 6 32.455 -14.692 11.282 1.00 11.36 C ANISOU 134 C LEU A 6 1653 1293 1369 152 18 26 C ATOM 135 O LEU A 6 31.731 -13.880 10.694 1.00 10.89 O ANISOU 135 O LEU A 6 1569 1246 1325 150 37 27 O ATOM 136 CB LEU A 6 34.841 -14.981 10.570 1.00 10.91 C ANISOU 136 CB LEU A 6 1559 1219 1366 130 -61 16 C ATOM 137 CG LEU A 6 36.284 -14.482 10.603 1.00 9.97 C ANISOU 137 CG LEU A 6 1424 1086 1278 125 -122 12 C ATOM 138 CD1 LEU A 6 37.203 -15.450 9.863 1.00 10.46 C ANISOU 138 CD1 LEU A 6 1440 1159 1376 120 -121 24 C ATOM 139 CD2 LEU A 6 36.367 -13.087 10.004 1.00 11.61 C ANISOU 139 CD2 LEU A 6 1608 1293 1511 109 -139 9 C ATOM 0 H LEU A 6 34.890 -15.386 12.971 1.00 9.52 H new ATOM 0 HA LEU A 6 33.996 -13.383 11.562 1.00 11.30 H new ATOM 0 HB2 LEU A 6 34.844 -15.942 10.705 1.00 10.91 H new ATOM 0 HB3 LEU A 6 34.479 -14.820 9.684 1.00 10.91 H new ATOM 0 HG LEU A 6 36.579 -14.437 11.526 1.00 9.97 H new ATOM 0 HD11 LEU A 6 38.114 -15.119 9.893 1.00 10.46 H new ATOM 0 HD12 LEU A 6 37.162 -16.322 10.286 1.00 10.46 H new ATOM 0 HD13 LEU A 6 36.917 -15.525 8.939 1.00 10.46 H new ATOM 0 HD21 LEU A 6 37.286 -12.778 10.029 1.00 11.61 H new ATOM 0 HD22 LEU A 6 36.059 -13.111 9.084 1.00 11.61 H new ATOM 0 HD23 LEU A 6 35.809 -12.481 10.516 1.00 11.61 H new ATOM 151 N ILE A 7 32.015 -15.895 11.659 1.00 11.07 N ANISOU 151 N ILE A 7 1628 1262 1315 149 46 45 N ATOM 152 CA AILE A 7 30.630 -16.298 11.426 0.68 9.67 C ANISOU 152 CA AILE A 7 1427 1107 1138 139 100 72 C ATOM 153 CA BILE A 7 30.631 -16.274 11.402 0.32 10.71 C ANISOU 153 CA BILE A 7 1559 1240 1272 139 100 72 C ATOM 154 C ILE A 7 29.684 -15.438 12.254 1.00 8.80 C ANISOU 154 C ILE A 7 1340 1008 996 175 139 78 C ATOM 155 O ILE A 7 28.646 -14.972 11.765 1.00 10.63 O ANISOU 155 O ILE A 7 1530 1261 1247 175 173 93 O ATOM 156 CB AILE A 7 30.446 -17.795 11.742 0.68 10.85 C ANISOU 156 CB AILE A 7 1591 1254 1278 123 112 98 C ATOM 157 CB BILE A 7 30.443 -17.783 11.631 0.32 10.83 C ANISOU 157 CB BILE A 7 1584 1252 1279 121 112 97 C ATOM 158 CG1AILE A 7 31.331 -18.673 10.843 0.68 8.06 C ANISOU 158 CG1AILE A 7 1223 885 953 100 78 89 C ATOM 159 CG1BILE A 7 31.089 -18.556 10.477 0.32 12.43 C ANISOU 159 CG1BILE A 7 1761 1444 1516 92 84 91 C ATOM 160 CG2AILE A 7 28.979 -18.183 11.620 0.68 18.17 C ANISOU 160 CG2AILE A 7 2488 2203 2212 105 163 138 C ATOM 161 CG2BILE A 7 28.967 -18.125 11.741 0.32 14.39 C ANISOU 161 CG2BILE A 7 2013 1725 1729 109 165 137 C ATOM 162 CD1AILE A 7 31.107 -18.469 9.364 0.68 7.44 C ANISOU 162 CD1AILE A 7 1097 817 914 74 79 85 C ATOM 163 CD1BILE A 7 31.671 -19.882 10.872 0.32 9.46 C ANISOU 163 CD1BILE A 7 1419 1047 1130 91 66 97 C ATOM 0 H AILE A 7 32.501 -16.488 12.049 0.68 11.07 H new ATOM 0 H BILE A 7 32.492 -16.491 12.055 0.32 11.07 H new ATOM 0 HA AILE A 7 30.416 -16.163 10.490 0.68 10.71 H new ATOM 0 HA BILE A 7 30.415 -16.093 10.474 0.32 10.71 H new ATOM 0 HB AILE A 7 30.728 -17.948 12.657 0.68 10.83 H new ATOM 0 HB BILE A 7 30.872 -18.035 12.464 0.32 10.83 H new ATOM 0 HG12AILE A 7 32.262 -18.492 11.047 0.68 12.43 H new ATOM 0 HG12BILE A 7 30.424 -18.699 9.785 0.32 12.43 H new ATOM 0 HG13AILE A 7 31.170 -19.605 11.059 0.68 12.43 H new ATOM 0 HG13BILE A 7 31.790 -18.010 10.088 0.32 12.43 H new ATOM 0 HG21AILE A 7 28.876 -19.126 11.821 0.68 14.39 H new ATOM 0 HG21BILE A 7 28.866 -19.079 11.885 0.32 14.39 H new ATOM 0 HG22AILE A 7 28.453 -17.660 12.245 0.68 14.39 H new ATOM 0 HG22BILE A 7 28.578 -17.643 12.487 0.32 14.39 H new ATOM 0 HG23AILE A 7 28.672 -18.010 10.716 0.68 14.39 H new ATOM 0 HG23BILE A 7 28.514 -17.872 10.921 0.32 14.39 H new ATOM 0 HD11AILE A 7 31.697 -19.054 8.863 0.68 9.46 H new ATOM 0 HD11BILE A 7 32.060 -20.310 10.093 0.32 9.46 H new ATOM 0 HD12AILE A 7 30.185 -18.676 9.145 0.68 9.46 H new ATOM 0 HD12BILE A 7 32.358 -19.747 11.543 0.32 9.46 H new ATOM 0 HD13AILE A 7 31.294 -17.546 9.132 0.68 9.46 H new ATOM 0 HD13BILE A 7 30.972 -20.447 11.236 0.32 9.46 H new ATOM 186 N AGLN A 8 30.025 -15.216 13.524 0.65 10.94 N ANISOU 186 N AGLN A 8 1678 1262 1214 212 132 67 N ATOM 187 N BGLN A 8 30.024 -15.228 13.532 0.35 10.67 N ANISOU 187 N BGLN A 8 1646 1229 1181 212 132 67 N ATOM 188 CA AGLN A 8 29.209 -14.353 14.371 0.65 10.70 C ANISOU 188 CA AGLN A 8 1686 1237 1140 261 173 67 C ATOM 189 CA BGLN A 8 29.230 -14.347 14.388 0.35 11.23 C ANISOU 189 CA BGLN A 8 1756 1305 1207 261 172 66 C ATOM 190 C AGLN A 8 29.084 -12.956 13.777 0.65 11.91 C ANISOU 190 C AGLN A 8 1824 1386 1316 275 160 44 C ATOM 191 C BGLN A 8 29.084 -12.966 13.764 0.35 11.54 C ANISOU 191 C BGLN A 8 1776 1340 1270 274 160 44 C ATOM 192 O AGLN A 8 27.991 -12.375 13.759 0.65 12.13 O ANISOU 192 O AGLN A 8 1833 1433 1342 304 210 56 O ATOM 193 O BGLN A 8 27.983 -12.404 13.714 0.35 12.31 O ANISOU 193 O BGLN A 8 1853 1456 1367 302 211 57 O ATOM 194 CB AGLN A 8 29.815 -14.287 15.774 0.65 9.50 C ANISOU 194 CB AGLN A 8 1633 1058 919 299 152 50 C ATOM 195 CB BGLN A 8 29.873 -14.227 15.776 0.35 11.27 C ANISOU 195 CB BGLN A 8 1859 1280 1143 300 148 48 C ATOM 196 CG AGLN A 8 28.999 -13.517 16.777 0.65 10.15 C ANISOU 196 CG AGLN A 8 1778 1142 938 363 202 48 C ATOM 197 CG BGLN A 8 29.727 -15.452 16.672 0.35 11.64 C ANISOU 197 CG BGLN A 8 1942 1331 1148 301 175 77 C ATOM 198 CD AGLN A 8 29.678 -13.439 18.129 0.65 20.20 C ANISOU 198 CD AGLN A 8 3166 2378 2131 400 169 28 C ATOM 199 CD BGLN A 8 30.571 -15.360 17.941 0.35 20.58 C ANISOU 199 CD BGLN A 8 3180 2426 2212 333 130 56 C ATOM 200 OE1AGLN A 8 30.729 -14.050 18.346 0.65 19.13 O ANISOU 200 OE1AGLN A 8 3055 2218 1996 374 105 21 O ATOM 201 OE1BGLN A 8 31.492 -16.153 18.149 0.35 19.19 O ANISOU 201 OE1BGLN A 8 3023 2230 2040 312 79 55 O ATOM 202 NE2AGLN A 8 29.086 -12.686 19.046 0.65 14.33 N ANISOU 202 NE2AGLN A 8 2501 1628 1317 467 209 18 N ATOM 203 NE2BGLN A 8 30.252 -14.398 18.797 0.35 24.19 N ANISOU 203 NE2BGLN A 8 3714 2871 2607 389 146 38 N ATOM 0 H AGLN A 8 30.717 -15.552 13.909 0.65 10.67 H new ATOM 0 H BGLN A 8 30.706 -15.584 13.917 0.35 10.67 H new ATOM 0 HA AGLN A 8 28.317 -14.730 14.426 0.65 11.23 H new ATOM 0 HA BGLN A 8 28.347 -14.738 14.480 0.35 11.23 H new ATOM 0 HB2AGLN A 8 29.939 -15.191 16.102 0.65 11.27 H new ATOM 0 HB2BGLN A 8 30.818 -14.038 15.663 0.35 11.27 H new ATOM 0 HB3AGLN A 8 30.695 -13.884 15.714 0.65 11.27 H new ATOM 0 HB3BGLN A 8 29.484 -13.464 16.231 0.35 11.27 H new ATOM 0 HG2AGLN A 8 28.842 -12.620 16.443 0.65 11.64 H new ATOM 0 HG2BGLN A 8 28.794 -15.560 16.916 0.35 11.64 H new ATOM 0 HG3AGLN A 8 28.131 -13.938 16.877 0.65 11.64 H new ATOM 0 HG3BGLN A 8 29.984 -16.244 16.174 0.35 11.64 H new ATOM 0 HE21AGLN A 8 28.354 -12.275 18.858 0.65 24.19 H new ATOM 0 HE21BGLN A 8 29.603 -13.862 18.619 0.35 24.19 H new ATOM 0 HE22AGLN A 8 29.434 -12.609 19.829 0.65 24.19 H new ATOM 0 HE22BGLN A 8 30.694 -14.310 19.529 0.35 24.19 H new ATOM 220 N LYS A 9 30.194 -12.398 13.285 1.00 8.65 N ANISOU 220 N LYS A 9 1412 947 928 255 92 16 N ATOM 221 CA LYS A 9 30.162 -11.054 12.727 1.00 8.61 C ANISOU 221 CA LYS A 9 1398 929 944 263 69 -3 C ATOM 222 C LYS A 9 29.447 -11.016 11.383 1.00 10.57 C ANISOU 222 C LYS A 9 1564 1206 1246 233 95 16 C ATOM 223 O LYS A 9 28.822 -10.004 11.051 1.00 9.78 O ANISOU 223 O LYS A 9 1454 1105 1157 252 104 13 O ATOM 224 CB LYS A 9 31.582 -10.510 12.615 1.00 8.52 C ANISOU 224 CB LYS A 9 1407 883 948 241 -14 -27 C ATOM 225 CG LYS A 9 32.171 -10.158 13.988 1.00 9.49 C ANISOU 225 CG LYS A 9 1627 964 1014 275 -58 -49 C ATOM 226 CD LYS A 9 33.608 -9.676 13.902 1.00 10.77 C ANISOU 226 CD LYS A 9 1798 1091 1204 244 -152 -62 C ATOM 227 CE LYS A 9 34.180 -9.442 15.298 1.00 10.44 C ANISOU 227 CE LYS A 9 1861 1002 1104 272 -211 -81 C ATOM 228 NZ LYS A 9 35.555 -8.881 15.228 1.00 14.55 N ANISOU 228 NZ LYS A 9 2383 1484 1662 235 -316 -86 N ATOM 0 H ALYS A 9 30.964 -12.780 13.267 0.65 8.65 H new ATOM 0 H BLYS A 9 30.967 -12.774 13.276 0.35 8.65 H new ATOM 0 HA LYS A 9 29.655 -10.486 13.328 1.00 8.61 H new ATOM 0 HB2 LYS A 9 32.147 -11.168 12.181 1.00 8.52 H new ATOM 0 HB3 LYS A 9 31.582 -9.720 12.052 1.00 8.52 H new ATOM 0 HG2 LYS A 9 31.627 -9.470 14.402 1.00 9.49 H new ATOM 0 HG3 LYS A 9 32.129 -10.938 14.563 1.00 9.49 H new ATOM 0 HD2 LYS A 9 34.147 -10.331 13.432 1.00 10.77 H new ATOM 0 HD3 LYS A 9 33.649 -8.854 13.388 1.00 10.77 H new ATOM 0 HE2 LYS A 9 33.605 -8.834 15.788 1.00 10.44 H new ATOM 0 HE3 LYS A 9 34.194 -10.278 15.789 1.00 10.44 H new ATOM 0 HZ1 LYS A 9 35.899 -8.835 16.047 1.00 14.55 H new ATOM 0 HZ2 LYS A 9 36.065 -9.406 14.722 1.00 14.55 H new ATOM 0 HZ3 LYS A 9 35.525 -8.065 14.873 1.00 14.55 H new ATOM 242 N ALA A 10 29.514 -12.097 10.603 1.00 10.86 N ANISOU 242 N ALA A 10 1549 1262 1314 190 101 35 N ATOM 243 CA ALA A 10 28.721 -12.153 9.383 1.00 11.02 C ANISOU 243 CA ALA A 10 1506 1306 1377 162 120 55 C ATOM 244 C ALA A 10 27.235 -12.035 9.702 1.00 11.13 C ANISOU 244 C ALA A 10 1498 1343 1388 188 177 83 C ATOM 245 O ALA A 10 26.486 -11.367 8.983 1.00 10.46 O ANISOU 245 O ALA A 10 1373 1269 1333 188 184 93 O ATOM 246 CB ALA A 10 29.015 -13.447 8.628 1.00 10.25 C ANISOU 246 CB ALA A 10 1379 1215 1300 117 114 69 C ATOM 0 H ALA A 10 30.000 -12.789 10.759 1.00 10.86 H new ATOM 0 HA ALA A 10 28.964 -11.404 8.817 1.00 11.02 H new ATOM 0 HB1 ALA A 10 28.483 -13.477 7.817 1.00 10.25 H new ATOM 0 HB2 ALA A 10 29.957 -13.481 8.398 1.00 10.25 H new ATOM 0 HB3 ALA A 10 28.792 -14.207 9.188 1.00 10.25 H new ATOM 252 N LYS A 11 26.792 -12.665 10.791 1.00 10.35 N ANISOU 252 N LYS A 11 1423 1254 1254 212 219 101 N ATOM 253 CA LYS A 11 25.383 -12.591 11.158 1.00 12.10 C ANISOU 253 CA LYS A 11 1614 1507 1477 240 284 138 C ATOM 254 C LYS A 11 25.010 -11.197 11.649 1.00 11.83 C ANISOU 254 C LYS A 11 1609 1466 1420 307 304 119 C ATOM 255 O LYS A 11 23.906 -10.711 11.370 1.00 12.70 O ANISOU 255 O LYS A 11 1670 1600 1557 330 343 145 O ATOM 256 CB LYS A 11 25.068 -13.648 12.215 1.00 10.38 C ANISOU 256 CB LYS A 11 1417 1303 1223 248 329 169 C ATOM 257 CG LYS A 11 25.163 -15.068 11.684 1.00 10.19 C ANISOU 257 CG LYS A 11 1362 1282 1228 183 312 196 C ATOM 258 CD LYS A 11 24.956 -16.079 12.790 1.00 18.80 C ANISOU 258 CD LYS A 11 2483 2379 2280 187 350 228 C ATOM 259 CE LYS A 11 25.159 -17.496 12.290 1.00 23.02 C ANISOU 259 CE LYS A 11 3003 2902 2840 124 320 250 C ATOM 260 NZ LYS A 11 25.208 -18.463 13.423 1.00 24.65 N ANISOU 260 NZ LYS A 11 3257 3106 3004 127 343 277 N ATOM 0 H LYS A 11 27.283 -13.132 11.321 1.00 10.35 H new ATOM 0 HA LYS A 11 24.849 -12.769 10.368 1.00 12.10 H new ATOM 0 HB2 LYS A 11 25.681 -13.545 12.960 1.00 10.38 H new ATOM 0 HB3 LYS A 11 24.174 -13.496 12.560 1.00 10.38 H new ATOM 0 HG2 LYS A 11 24.498 -15.202 10.991 1.00 10.19 H new ATOM 0 HG3 LYS A 11 26.031 -15.206 11.274 1.00 10.19 H new ATOM 0 HD2 LYS A 11 25.574 -15.899 13.515 1.00 18.80 H new ATOM 0 HD3 LYS A 11 24.060 -15.987 13.151 1.00 18.80 H new ATOM 0 HE2 LYS A 11 24.438 -17.736 11.687 1.00 23.02 H new ATOM 0 HE3 LYS A 11 25.983 -17.548 11.781 1.00 23.02 H new ATOM 0 HZ1 LYS A 11 25.414 -19.272 13.114 1.00 24.65 H new ATOM 0 HZ2 LYS A 11 25.826 -18.203 14.009 1.00 24.65 H new ATOM 0 HZ3 LYS A 11 24.414 -18.492 13.823 1.00 24.65 H new ATOM 274 N LEU A 12 25.911 -10.538 12.378 1.00 10.68 N ANISOU 274 N LEU A 12 1546 1285 1227 340 272 77 N ATOM 275 CA LEU A 12 25.672 -9.153 12.777 1.00 12.48 C ANISOU 275 CA LEU A 12 1822 1492 1430 404 275 51 C ATOM 276 C LEU A 12 25.606 -8.240 11.560 1.00 12.90 C ANISOU 276 C LEU A 12 1829 1535 1537 384 237 43 C ATOM 277 O LEU A 12 24.730 -7.370 11.467 1.00 11.37 O ANISOU 277 O LEU A 12 1623 1344 1352 431 265 48 O ATOM 278 CB LEU A 12 26.775 -8.685 13.727 1.00 10.61 C ANISOU 278 CB LEU A 12 1692 1206 1133 430 223 6 C ATOM 279 CG LEU A 12 26.851 -9.369 15.091 1.00 14.44 C ANISOU 279 CG LEU A 12 2250 1691 1547 463 255 9 C ATOM 280 CD1 LEU A 12 28.129 -8.976 15.814 1.00 14.14 C ANISOU 280 CD1 LEU A 12 2313 1597 1463 469 174 -34 C ATOM 281 CD2 LEU A 12 25.635 -9.034 15.948 1.00 17.65 C ANISOU 281 CD2 LEU A 12 2684 2118 1903 546 346 26 C ATOM 0 H LEU A 12 26.657 -10.870 12.648 1.00 10.68 H new ATOM 0 HA LEU A 12 24.818 -9.110 13.235 1.00 12.48 H new ATOM 0 HB2 LEU A 12 27.628 -8.805 13.281 1.00 10.61 H new ATOM 0 HB3 LEU A 12 26.663 -7.733 13.873 1.00 10.61 H new ATOM 0 HG LEU A 12 26.858 -10.327 14.941 1.00 14.44 H new ATOM 0 HD11 LEU A 12 28.162 -9.418 16.677 1.00 14.14 H new ATOM 0 HD12 LEU A 12 28.896 -9.244 15.284 1.00 14.14 H new ATOM 0 HD13 LEU A 12 28.146 -8.015 15.943 1.00 14.14 H new ATOM 0 HD21 LEU A 12 25.710 -9.481 16.806 1.00 17.65 H new ATOM 0 HD22 LEU A 12 25.591 -8.075 16.086 1.00 17.65 H new ATOM 0 HD23 LEU A 12 24.829 -9.333 15.498 1.00 17.65 H new ATOM 293 N ALA A 13 26.522 -8.432 10.611 1.00 11.88 N ANISOU 293 N ALA A 13 1676 1394 1445 320 177 33 N ATOM 294 CA ALA A 13 26.548 -7.590 9.423 1.00 13.18 C ANISOU 294 CA ALA A 13 1805 1549 1655 296 139 30 C ATOM 295 C ALA A 13 25.262 -7.737 8.622 1.00 9.65 C ANISOU 295 C ALA A 13 1279 1136 1251 290 178 68 C ATOM 296 O ALA A 13 24.734 -6.750 8.102 1.00 14.88 O ANISOU 296 O ALA A 13 1925 1791 1937 309 170 69 O ATOM 297 CB ALA A 13 27.765 -7.940 8.571 1.00 12.82 C ANISOU 297 CB ALA A 13 1744 1493 1635 230 84 22 C ATOM 0 H ALA A 13 27.130 -9.039 10.638 1.00 11.88 H new ATOM 0 HA ALA A 13 26.615 -6.662 9.699 1.00 13.18 H new ATOM 0 HB1 ALA A 13 27.780 -7.378 7.781 1.00 12.82 H new ATOM 0 HB2 ALA A 13 28.574 -7.794 9.086 1.00 12.82 H new ATOM 0 HB3 ALA A 13 27.716 -8.871 8.304 1.00 12.82 H new ATOM 303 N GLU A 14 24.726 -8.960 8.533 1.00 9.40 N ANISOU 303 N GLU A 14 1200 1140 1233 262 212 102 N ATOM 304 CA GLU A 14 23.437 -9.154 7.878 1.00 12.46 C ANISOU 304 CA GLU A 14 1509 1559 1666 252 240 147 C ATOM 305 C GLU A 14 22.343 -8.346 8.571 1.00 12.25 C ANISOU 305 C GLU A 14 1472 1546 1636 328 295 163 C ATOM 306 O GLU A 14 21.552 -7.659 7.917 1.00 13.82 O ANISOU 306 O GLU A 14 1623 1752 1876 341 294 181 O ATOM 307 CB GLU A 14 23.072 -10.640 7.850 1.00 13.36 C ANISOU 307 CB GLU A 14 1584 1700 1793 206 261 185 C ATOM 308 CG GLU A 14 21.792 -10.922 7.057 1.00 17.14 C ANISOU 308 CG GLU A 14 1976 2205 2330 179 270 238 C ATOM 309 CD GLU A 14 21.416 -12.394 7.009 1.00 21.73 C ANISOU 309 CD GLU A 14 2525 2803 2928 124 276 280 C ATOM 310 OE1 GLU A 14 21.834 -13.156 7.907 1.00 22.98 O ANISOU 310 OE1 GLU A 14 2721 2961 3049 128 299 278 O ATOM 311 OE2 GLU A 14 20.690 -12.787 6.064 1.00 23.00 O ANISOU 311 OE2 GLU A 14 2629 2972 3140 76 249 317 O ATOM 0 H GLU A 14 25.089 -9.676 8.841 1.00 9.40 H new ATOM 0 HA GLU A 14 23.511 -8.835 6.965 1.00 12.46 H new ATOM 0 HB2 GLU A 14 23.806 -11.142 7.461 1.00 13.36 H new ATOM 0 HB3 GLU A 14 22.961 -10.959 8.759 1.00 13.36 H new ATOM 0 HG2 GLU A 14 21.060 -10.422 7.451 1.00 17.14 H new ATOM 0 HG3 GLU A 14 21.904 -10.595 6.151 1.00 17.14 H new ATOM 318 N GLN A 15 22.282 -8.410 9.901 1.00 13.84 N ANISOU 318 N GLN A 15 1723 1752 1785 385 346 157 N ATOM 319 CA GLN A 15 21.262 -7.643 10.612 1.00 15.14 C ANISOU 319 CA GLN A 15 1886 1931 1936 472 412 172 C ATOM 320 C GLN A 15 21.422 -6.149 10.372 1.00 15.31 C ANISOU 320 C GLN A 15 1951 1913 1955 520 377 132 C ATOM 321 O GLN A 15 20.427 -5.413 10.331 1.00 16.37 O ANISOU 321 O GLN A 15 2052 2058 2109 580 414 151 O ATOM 322 CB GLN A 15 21.326 -7.941 12.105 1.00 15.27 C ANISOU 322 CB GLN A 15 1972 1951 1878 530 471 167 C ATOM 323 CG GLN A 15 20.933 -9.351 12.472 1.00 22.65 C ANISOU 323 CG GLN A 15 2863 2928 2816 493 519 218 C ATOM 324 CD GLN A 15 21.157 -9.632 13.937 1.00 33.28 C ANISOU 324 CD GLN A 15 4295 4273 4078 546 570 210 C ATOM 325 OE1 GLN A 15 22.123 -10.296 14.314 1.00 46.78 O ANISOU 325 OE1 GLN A 15 6062 5961 5751 511 533 189 O ATOM 326 NE2 GLN A 15 20.271 -9.114 14.777 1.00 26.09 N ANISOU 326 NE2 GLN A 15 3397 3385 3133 637 656 230 N ATOM 0 H GLN A 15 22.806 -8.877 10.398 1.00 13.84 H new ATOM 0 HA GLN A 15 20.395 -7.911 10.268 1.00 15.14 H new ATOM 0 HB2 GLN A 15 22.229 -7.775 12.419 1.00 15.27 H new ATOM 0 HB3 GLN A 15 20.745 -7.322 12.573 1.00 15.27 H new ATOM 0 HG2 GLN A 15 19.998 -9.493 12.255 1.00 22.65 H new ATOM 0 HG3 GLN A 15 21.447 -9.979 11.940 1.00 22.65 H new ATOM 0 HE21 GLN A 15 19.609 -8.656 14.475 1.00 26.09 H new ATOM 0 HE22 GLN A 15 20.358 -9.236 15.624 1.00 26.09 H new ATOM 335 N ALA A 16 22.657 -5.686 10.217 1.00 14.77 N ANISOU 335 N ALA A 16 1952 1795 1864 494 304 83 N ATOM 336 CA ALA A 16 22.950 -4.287 9.956 1.00 13.09 C ANISOU 336 CA ALA A 16 1789 1534 1650 524 254 48 C ATOM 337 C ALA A 16 22.899 -3.939 8.472 1.00 14.70 C ANISOU 337 C ALA A 16 1929 1735 1920 467 203 62 C ATOM 338 O ALA A 16 23.147 -2.783 8.112 1.00 16.90 O ANISOU 338 O ALA A 16 2245 1972 2205 482 155 39 O ATOM 339 CB ALA A 16 24.328 -3.938 10.526 1.00 14.52 C ANISOU 339 CB ALA A 16 2073 1662 1783 515 191 -2 C ATOM 0 H ALA A 16 23.357 -6.184 10.261 1.00 14.77 H new ATOM 0 HA ALA A 16 22.261 -3.762 10.393 1.00 13.09 H new ATOM 0 HB1 ALA A 16 24.523 -3.004 10.352 1.00 14.52 H new ATOM 0 HB2 ALA A 16 24.332 -4.096 11.483 1.00 14.52 H new ATOM 0 HB3 ALA A 16 25.003 -4.493 10.105 1.00 14.52 H new ATOM 345 N GLU A 17 22.558 -4.903 7.615 1.00 12.35 N ANISOU 345 N GLU A 17 1547 1477 1667 404 208 100 N ATOM 346 CA AGLU A 17 22.536 -4.713 6.162 0.56 11.71 C ANISOU 346 CA AGLU A 17 1417 1394 1637 346 158 114 C ATOM 347 CA BGLU A 17 22.529 -4.692 6.166 0.44 13.63 C ANISOU 347 CA BGLU A 17 1661 1637 1881 347 158 114 C ATOM 348 C GLU A 17 23.875 -4.184 5.655 1.00 16.20 C ANISOU 348 C GLU A 17 2038 1921 2196 304 89 80 C ATOM 349 O GLU A 17 23.944 -3.351 4.750 1.00 16.77 O ANISOU 349 O GLU A 17 2107 1971 2293 287 45 81 O ATOM 350 CB AGLU A 17 21.379 -3.803 5.750 0.56 19.93 C ANISOU 350 CB AGLU A 17 2417 2437 2717 392 167 137 C ATOM 351 CB BGLU A 17 21.399 -3.739 5.773 0.44 20.35 C ANISOU 351 CB BGLU A 17 2474 2488 2770 394 166 135 C ATOM 352 CG AGLU A 17 20.018 -4.441 6.001 0.56 26.42 C ANISOU 352 CG AGLU A 17 3157 3311 3571 418 232 190 C ATOM 353 CG BGLU A 17 20.036 -4.190 6.268 0.44 29.03 C ANISOU 353 CG BGLU A 17 3505 3635 3891 440 239 181 C ATOM 354 CD AGLU A 17 18.859 -3.504 5.720 0.56 39.05 C ANISOU 354 CD AGLU A 17 4708 4915 5215 477 245 217 C ATOM 355 CD BGLU A 17 18.890 -3.563 5.498 0.44 38.74 C ANISOU 355 CD BGLU A 17 4662 4875 5182 462 234 219 C ATOM 356 OE1AGLU A 17 18.514 -3.316 4.534 0.56 39.48 O ANISOU 356 OE1AGLU A 17 4713 4968 5320 435 195 240 O ATOM 357 OE1BGLU A 17 19.029 -2.407 5.042 0.44 33.97 O ANISOU 357 OE1BGLU A 17 4090 4232 4584 485 190 198 O ATOM 358 OE2AGLU A 17 18.296 -2.952 6.687 0.56 30.91 O ANISOU 358 OE2AGLU A 17 3694 3888 4164 571 304 215 O ATOM 359 OE2BGLU A 17 17.850 -4.236 5.342 0.44 32.31 O ANISOU 359 OE2BGLU A 17 3756 4106 4413 453 267 275 O ATOM 0 H AGLU A 17 22.330 -5.694 7.863 0.56 12.35 H new ATOM 0 H BGLU A 17 22.337 -5.698 7.858 0.44 12.35 H new ATOM 0 HA AGLU A 17 22.392 -5.578 5.747 0.56 13.63 H new ATOM 0 HA BGLU A 17 22.357 -5.549 5.746 0.44 13.63 H new ATOM 0 HB2AGLU A 17 21.437 -2.968 6.241 0.56 20.35 H new ATOM 0 HB2BGLU A 17 21.590 -2.857 6.128 0.44 20.35 H new ATOM 0 HB3AGLU A 17 21.462 -3.585 4.808 0.56 20.35 H new ATOM 0 HB3BGLU A 17 21.375 -3.657 4.807 0.44 20.35 H new ATOM 0 HG2AGLU A 17 19.930 -5.231 5.445 0.56 29.03 H new ATOM 0 HG2BGLU A 17 19.976 -5.156 6.199 0.44 29.03 H new ATOM 0 HG3AGLU A 17 19.971 -4.737 6.924 0.56 29.03 H new ATOM 0 HG3BGLU A 17 19.948 -3.967 7.208 0.44 29.03 H new ATOM 372 N ARG A 18 24.954 -4.699 6.238 1.00 12.60 N ANISOU 372 N ARG A 18 1626 1456 1706 284 79 57 N ATOM 373 CA ARG A 18 26.313 -4.360 5.836 1.00 10.57 C ANISOU 373 CA ARG A 18 1403 1167 1446 239 18 35 C ATOM 374 C ARG A 18 26.865 -5.541 5.044 1.00 13.02 C ANISOU 374 C ARG A 18 1671 1505 1771 173 15 50 C ATOM 375 O ARG A 18 27.645 -6.353 5.537 1.00 9.45 O ANISOU 375 O ARG A 18 1235 1058 1300 158 18 41 O ATOM 376 CB ARG A 18 27.157 -4.050 7.061 1.00 10.92 C ANISOU 376 CB ARG A 18 1525 1177 1447 268 -1 2 C ATOM 377 CG ARG A 18 26.736 -2.792 7.801 1.00 10.41 C ANISOU 377 CG ARG A 18 1526 1070 1357 338 -9 -21 C ATOM 378 CD ARG A 18 27.463 -1.576 7.267 1.00 14.61 C ANISOU 378 CD ARG A 18 2094 1551 1908 314 -86 -33 C ATOM 379 NE ARG A 18 28.896 -1.691 7.509 1.00 17.31 N ANISOU 379 NE ARG A 18 2467 1868 2242 267 -142 -45 N ATOM 380 CZ ARG A 18 29.768 -0.694 7.409 1.00 20.16 C ANISOU 380 CZ ARG A 18 2871 2175 2613 241 -219 -54 C ATOM 381 NH1 ARG A 18 29.368 0.526 7.077 1.00 20.21 N ANISOU 381 NH1 ARG A 18 2908 2141 2631 261 -250 -58 N ATOM 382 NH2 ARG A 18 31.050 -0.925 7.651 1.00 18.84 N ANISOU 382 NH2 ARG A 18 2716 1994 2450 195 -268 -55 N ATOM 0 H ARG A 18 24.915 -5.262 6.887 1.00 12.60 H new ATOM 0 HA ARG A 18 26.328 -3.566 5.279 1.00 10.57 H new ATOM 0 HB2 ARG A 18 27.113 -4.803 7.671 1.00 10.92 H new ATOM 0 HB3 ARG A 18 28.084 -3.959 6.789 1.00 10.92 H new ATOM 0 HG2 ARG A 18 25.779 -2.665 7.711 1.00 10.41 H new ATOM 0 HG3 ARG A 18 26.921 -2.893 8.748 1.00 10.41 H new ATOM 0 HD2 ARG A 18 27.296 -1.485 6.316 1.00 14.61 H new ATOM 0 HD3 ARG A 18 27.121 -0.775 7.693 1.00 14.61 H new ATOM 0 HE ARG A 18 29.200 -2.463 7.734 1.00 17.31 H new ATOM 0 HH11 ARG A 18 28.536 0.679 6.924 1.00 20.21 H new ATOM 0 HH12 ARG A 18 29.941 1.164 7.015 1.00 20.21 H new ATOM 0 HH21 ARG A 18 31.311 -1.715 7.870 1.00 18.84 H new ATOM 0 HH22 ARG A 18 31.621 -0.285 7.589 1.00 18.84 H new ATOM 396 N TYR A 19 26.444 -5.634 3.783 1.00 11.28 N ANISOU 396 N TYR A 19 1404 1299 1581 136 7 73 N ATOM 397 CA TYR A 19 26.682 -6.866 3.038 1.00 12.98 C ANISOU 397 CA TYR A 19 1591 1539 1803 86 12 87 C ATOM 398 C TYR A 19 28.110 -6.985 2.526 1.00 7.10 C ANISOU 398 C TYR A 19 862 784 1051 48 -15 76 C ATOM 399 O TYR A 19 28.596 -8.109 2.375 1.00 9.06 O ANISOU 399 O TYR A 19 1104 1047 1290 26 -3 77 O ATOM 400 CB TYR A 19 25.681 -6.984 1.894 1.00 11.10 C ANISOU 400 CB TYR A 19 1310 1316 1594 62 7 117 C ATOM 401 CG TYR A 19 24.283 -7.220 2.410 1.00 11.84 C ANISOU 401 CG TYR A 19 1365 1429 1704 93 40 141 C ATOM 402 CD1 TYR A 19 23.949 -8.415 3.032 1.00 14.28 C ANISOU 402 CD1 TYR A 19 1659 1761 2008 89 75 155 C ATOM 403 CD2 TYR A 19 23.304 -6.242 2.303 1.00 22.05 C ANISOU 403 CD2 TYR A 19 2635 2720 3024 127 39 157 C ATOM 404 CE1 TYR A 19 22.677 -8.632 3.521 1.00 17.27 C ANISOU 404 CE1 TYR A 19 1991 2163 2407 113 111 189 C ATOM 405 CE2 TYR A 19 22.027 -6.455 2.790 1.00 21.23 C ANISOU 405 CE2 TYR A 19 2481 2641 2943 160 78 188 C ATOM 406 CZ TYR A 19 21.723 -7.648 3.395 1.00 19.65 C ANISOU 406 CZ TYR A 19 2259 2468 2738 151 116 207 C ATOM 407 OH TYR A 19 20.455 -7.867 3.879 1.00 24.70 O ANISOU 407 OH TYR A 19 2839 3138 3407 179 159 251 O ATOM 0 H TYR A 19 26.031 -5.015 3.352 1.00 11.28 H new ATOM 0 HA TYR A 19 26.555 -7.603 3.655 1.00 12.98 H new ATOM 0 HB2 TYR A 19 25.699 -6.174 1.361 1.00 11.10 H new ATOM 0 HB3 TYR A 19 25.940 -7.714 1.309 1.00 11.10 H new ATOM 0 HD1 TYR A 19 24.593 -9.080 3.121 1.00 14.28 H new ATOM 0 HD2 TYR A 19 23.510 -5.431 1.898 1.00 22.05 H new ATOM 0 HE1 TYR A 19 22.466 -9.438 3.933 1.00 17.27 H new ATOM 0 HE2 TYR A 19 21.379 -5.793 2.708 1.00 21.23 H new ATOM 0 HH TYR A 19 19.980 -7.189 3.737 1.00 24.70 H new ATOM 417 N GLU A 20 28.799 -5.871 2.245 1.00 10.70 N ANISOU 417 N GLU A 20 1335 1216 1514 41 -50 71 N ATOM 418 CA AGLU A 20 30.218 -5.964 1.925 0.51 12.22 C ANISOU 418 CA AGLU A 20 1531 1404 1707 8 -70 70 C ATOM 419 CA BGLU A 20 30.223 -5.952 1.929 0.49 11.99 C ANISOU 419 CA BGLU A 20 1502 1375 1678 8 -70 70 C ATOM 420 C GLU A 20 31.007 -6.499 3.116 1.00 11.30 C ANISOU 420 C GLU A 20 1434 1284 1576 23 -69 52 C ATOM 421 O GLU A 20 31.880 -7.362 2.953 1.00 10.16 O ANISOU 421 O GLU A 20 1276 1154 1431 5 -62 55 O ATOM 422 CB AGLU A 20 30.755 -4.605 1.471 0.51 13.94 C ANISOU 422 CB AGLU A 20 1760 1594 1942 -9 -113 77 C ATOM 423 CB BGLU A 20 30.772 -4.583 1.518 0.49 13.61 C ANISOU 423 CB BGLU A 20 1720 1552 1901 -9 -114 77 C ATOM 424 CG AGLU A 20 30.262 -4.206 0.087 0.51 12.48 C ANISOU 424 CG AGLU A 20 1558 1415 1769 -35 -117 101 C ATOM 425 CG BGLU A 20 32.259 -4.615 1.154 0.49 12.51 C ANISOU 425 CG BGLU A 20 1567 1413 1772 -47 -131 90 C ATOM 426 CD AGLU A 20 31.067 -3.081 -0.540 0.51 26.77 C ANISOU 426 CD AGLU A 20 3375 3201 3595 -67 -156 119 C ATOM 427 CD BGLU A 20 32.824 -3.260 0.767 0.49 30.50 C ANISOU 427 CD BGLU A 20 3853 3661 4073 -74 -178 107 C ATOM 428 OE1AGLU A 20 31.889 -2.462 0.164 0.51 16.51 O ANISOU 428 OE1AGLU A 20 2094 1875 2305 -70 -188 114 O ATOM 429 OE1BGLU A 20 32.602 -2.275 1.506 0.49 24.65 O ANISOU 429 OE1BGLU A 20 3152 2879 3334 -54 -218 94 O ATOM 430 OE2AGLU A 20 30.878 -2.821 -1.748 0.51 36.78 O ANISOU 430 OE2AGLU A 20 4634 4475 4866 -94 -159 142 O ATOM 431 OE2BGLU A 20 33.500 -3.186 -0.279 0.49 23.30 O ANISOU 431 OE2BGLU A 20 2915 2764 3174 -113 -175 137 O ATOM 0 H AGLU A 20 28.470 -5.076 2.235 0.51 10.70 H new ATOM 0 H BGLU A 20 28.466 -5.078 2.233 0.49 10.70 H new ATOM 0 HA AGLU A 20 30.328 -6.590 1.192 0.51 11.99 H new ATOM 0 HA BGLU A 20 30.328 -6.560 1.181 0.49 11.99 H new ATOM 0 HB2AGLU A 20 30.490 -3.927 2.112 0.51 13.61 H new ATOM 0 HB2BGLU A 20 30.266 -4.253 0.759 0.49 13.61 H new ATOM 0 HB3AGLU A 20 31.725 -4.630 1.469 0.51 13.61 H new ATOM 0 HB3BGLU A 20 30.636 -3.955 2.245 0.49 13.61 H new ATOM 0 HG2AGLU A 20 30.293 -4.981 -0.496 0.51 12.51 H new ATOM 0 HG2BGLU A 20 32.761 -4.962 1.908 0.49 12.51 H new ATOM 0 HG3AGLU A 20 29.333 -3.935 0.148 0.51 12.51 H new ATOM 0 HG3BGLU A 20 32.390 -5.233 0.418 0.49 12.51 H new ATOM 444 N ASP A 21 30.706 -6.011 4.322 1.00 11.45 N ANISOU 444 N ASP A 21 1491 1281 1578 63 -77 34 N ATOM 445 CA ASP A 21 31.317 -6.576 5.520 1.00 9.48 C ANISOU 445 CA ASP A 21 1271 1024 1305 80 -80 18 C ATOM 446 C ASP A 21 30.980 -8.056 5.639 1.00 10.04 C ANISOU 446 C ASP A 21 1324 1128 1365 81 -35 24 C ATOM 447 O ASP A 21 31.847 -8.892 5.922 1.00 9.18 O ANISOU 447 O ASP A 21 1215 1023 1250 71 -40 22 O ATOM 448 CB ASP A 21 30.820 -5.850 6.773 1.00 7.75 C ANISOU 448 CB ASP A 21 1112 776 1055 132 -87 -3 C ATOM 449 CG ASP A 21 31.408 -4.461 6.954 1.00 13.80 C ANISOU 449 CG ASP A 21 1923 1492 1827 132 -150 -15 C ATOM 450 OD1 ASP A 21 32.331 -4.059 6.212 1.00 16.63 O ANISOU 450 OD1 ASP A 21 2258 1841 2218 84 -192 -1 O ATOM 451 OD2 ASP A 21 30.920 -3.767 7.874 1.00 15.83 O ANISOU 451 OD2 ASP A 21 2243 1718 2053 182 -157 -37 O ATOM 0 H ASP A 21 30.159 -5.363 4.464 1.00 11.45 H new ATOM 0 HA ASP A 21 32.278 -6.466 5.445 1.00 9.48 H new ATOM 0 HB2 ASP A 21 29.853 -5.780 6.733 1.00 7.75 H new ATOM 0 HB3 ASP A 21 31.034 -6.386 7.553 1.00 7.75 H new ATOM 456 N MET A 22 29.704 -8.389 5.458 1.00 10.23 N ANISOU 456 N MET A 22 1328 1171 1387 93 4 36 N ATOM 457 CA MET A 22 29.265 -9.771 5.578 1.00 8.79 C ANISOU 457 CA MET A 22 1131 1013 1197 86 38 48 C ATOM 458 C MET A 22 30.066 -10.667 4.650 1.00 11.27 C ANISOU 458 C MET A 22 1426 1334 1520 48 30 52 C ATOM 459 O MET A 22 30.529 -11.744 5.047 1.00 7.44 O ANISOU 459 O MET A 22 952 853 1024 47 37 50 O ATOM 460 CB MET A 22 27.772 -9.854 5.267 1.00 7.59 C ANISOU 460 CB MET A 22 947 880 1058 91 69 71 C ATOM 461 CG MET A 22 27.141 -11.171 5.649 1.00 10.56 C ANISOU 461 CG MET A 22 1309 1275 1428 85 102 92 C ATOM 462 SD MET A 22 25.446 -11.295 5.076 1.00 11.81 S ANISOU 462 SD MET A 22 1409 1457 1622 74 124 134 S ATOM 463 CE MET A 22 25.049 -12.944 5.651 1.00 10.39 C ANISOU 463 CE MET A 22 1223 1291 1435 53 151 163 C ATOM 0 H MET A 22 29.080 -7.829 5.266 1.00 10.23 H new ATOM 0 HA MET A 22 29.415 -10.080 6.485 1.00 8.79 H new ATOM 0 HB2 MET A 22 27.313 -9.138 5.733 1.00 7.59 H new ATOM 0 HB3 MET A 22 27.639 -9.705 4.318 1.00 7.59 H new ATOM 0 HG2 MET A 22 27.662 -11.899 5.275 1.00 10.56 H new ATOM 0 HG3 MET A 22 27.164 -11.272 6.613 1.00 10.56 H new ATOM 0 HE1 MET A 22 24.141 -13.167 5.394 1.00 10.39 H new ATOM 0 HE2 MET A 22 25.663 -13.582 5.254 1.00 10.39 H new ATOM 0 HE3 MET A 22 25.128 -12.978 6.617 1.00 10.39 H new ATOM 473 N ALA A 23 30.250 -10.223 3.406 1.00 8.50 N ANISOU 473 N ALA A 23 1056 986 1188 22 15 58 N ATOM 474 CA ALA A 23 30.998 -11.000 2.424 1.00 12.11 C ANISOU 474 CA ALA A 23 1504 1451 1647 -4 16 62 C ATOM 475 C ALA A 23 32.448 -11.183 2.852 1.00 8.93 C ANISOU 475 C ALA A 23 1106 1045 1245 2 6 54 C ATOM 476 O ALA A 23 32.999 -12.285 2.762 1.00 8.83 O ANISOU 476 O ALA A 23 1094 1037 1224 3 18 52 O ATOM 477 CB ALA A 23 30.922 -10.308 1.062 1.00 12.77 C ANISOU 477 CB ALA A 23 1575 1537 1741 -28 6 74 C ATOM 0 H ALA A 23 29.948 -9.473 3.113 1.00 8.50 H new ATOM 0 HA ALA A 23 30.600 -11.882 2.359 1.00 12.11 H new ATOM 0 HB1 ALA A 23 31.419 -10.824 0.408 1.00 12.77 H new ATOM 0 HB2 ALA A 23 29.995 -10.242 0.784 1.00 12.77 H new ATOM 0 HB3 ALA A 23 31.303 -9.419 1.129 1.00 12.77 H new ATOM 483 N ALA A 24 33.085 -10.107 3.315 1.00 11.97 N ANISOU 483 N ALA A 24 1492 1415 1641 5 -23 51 N ATOM 484 CA ALA A 24 34.478 -10.194 3.741 1.00 11.49 C ANISOU 484 CA ALA A 24 1424 1350 1592 4 -45 52 C ATOM 485 C ALA A 24 34.634 -11.150 4.915 1.00 7.96 C ANISOU 485 C ALA A 24 1001 898 1127 28 -44 39 C ATOM 486 O ALA A 24 35.593 -11.933 4.968 1.00 9.89 O ANISOU 486 O ALA A 24 1232 1147 1379 31 -46 43 O ATOM 487 CB ALA A 24 35.003 -8.803 4.111 1.00 14.56 C ANISOU 487 CB ALA A 24 1818 1714 1999 -5 -92 54 C ATOM 0 H ALA A 24 32.732 -9.326 3.389 1.00 11.97 H new ATOM 0 HA ALA A 24 35.000 -10.542 3.002 1.00 11.49 H new ATOM 0 HB1 ALA A 24 35.929 -8.871 4.393 1.00 14.56 H new ATOM 0 HB2 ALA A 24 34.942 -8.218 3.340 1.00 14.56 H new ATOM 0 HB3 ALA A 24 34.471 -8.438 4.835 1.00 14.56 H new ATOM 493 N PHE A 25 33.702 -11.101 5.870 1.00 9.75 N ANISOU 493 N PHE A 25 1263 1115 1329 49 -38 28 N ATOM 494 CA PHE A 25 33.745 -12.026 6.999 1.00 8.35 C ANISOU 494 CA PHE A 25 1116 931 1125 71 -34 21 C ATOM 495 C PHE A 25 33.621 -13.473 6.523 1.00 11.58 C ANISOU 495 C PHE A 25 1513 1355 1531 64 -4 29 C ATOM 496 O PHE A 25 34.384 -14.353 6.947 1.00 9.02 O ANISOU 496 O PHE A 25 1198 1026 1204 73 -13 28 O ATOM 497 CB PHE A 25 32.628 -11.687 7.995 1.00 7.12 C ANISOU 497 CB PHE A 25 1000 769 937 99 -17 15 C ATOM 498 CG PHE A 25 32.833 -10.392 8.756 1.00 8.06 C ANISOU 498 CG PHE A 25 1160 860 1044 119 -53 -1 C ATOM 499 CD1 PHE A 25 31.756 -9.550 9.016 1.00 9.96 C ANISOU 499 CD1 PHE A 25 1422 1096 1267 147 -33 -6 C ATOM 500 CD2 PHE A 25 34.081 -10.030 9.239 1.00 12.96 C ANISOU 500 CD2 PHE A 25 1799 1454 1669 113 -112 -8 C ATOM 501 CE1 PHE A 25 31.927 -8.357 9.731 1.00 8.90 C ANISOU 501 CE1 PHE A 25 1344 925 1114 173 -71 -26 C ATOM 502 CE2 PHE A 25 34.258 -8.846 9.950 1.00 10.75 C ANISOU 502 CE2 PHE A 25 1573 1137 1376 128 -159 -24 C ATOM 503 CZ PHE A 25 33.180 -8.008 10.194 1.00 13.28 C ANISOU 503 CZ PHE A 25 1930 1447 1670 160 -138 -36 C ATOM 0 H PHE A 25 33.045 -10.546 5.881 1.00 9.75 H new ATOM 0 HA PHE A 25 34.602 -11.932 7.444 1.00 8.35 H new ATOM 0 HB2 PHE A 25 31.787 -11.636 7.515 1.00 7.12 H new ATOM 0 HB3 PHE A 25 32.548 -12.414 8.632 1.00 7.12 H new ATOM 0 HD1 PHE A 25 30.909 -9.783 8.710 1.00 9.96 H new ATOM 0 HD2 PHE A 25 34.811 -10.586 9.086 1.00 12.96 H new ATOM 0 HE1 PHE A 25 31.199 -7.802 9.893 1.00 8.90 H new ATOM 0 HE2 PHE A 25 35.103 -8.616 10.263 1.00 10.75 H new ATOM 0 HZ PHE A 25 33.300 -7.216 10.666 1.00 13.28 H new ATOM 513 N MET A 26 32.662 -13.740 5.636 1.00 7.78 N ANISOU 513 N MET A 26 1017 887 1053 49 23 38 N ATOM 514 CA MET A 26 32.462 -15.103 5.155 1.00 7.58 C ANISOU 514 CA MET A 26 995 864 1022 39 40 44 C ATOM 515 C MET A 26 33.611 -15.564 4.261 1.00 9.69 C ANISOU 515 C MET A 26 1252 1133 1299 38 36 40 C ATOM 516 O MET A 26 33.996 -16.738 4.304 1.00 11.09 O ANISOU 516 O MET A 26 1445 1301 1467 48 41 38 O ATOM 517 CB MET A 26 31.129 -15.208 4.418 1.00 11.50 C ANISOU 517 CB MET A 26 1480 1367 1521 17 55 58 C ATOM 518 CG MET A 26 29.895 -15.151 5.328 1.00 10.83 C ANISOU 518 CG MET A 26 1396 1288 1430 23 74 74 C ATOM 519 SD MET A 26 30.008 -16.224 6.769 1.00 11.41 S ANISOU 519 SD MET A 26 1505 1354 1477 41 85 79 S ATOM 520 CE MET A 26 30.203 -17.816 5.962 1.00 8.64 C ANISOU 520 CE MET A 26 1166 988 1129 13 75 85 C ATOM 0 H MET A 26 32.125 -13.155 5.306 1.00 7.78 H new ATOM 0 HA MET A 26 32.445 -15.691 5.926 1.00 7.58 H new ATOM 0 HB2 MET A 26 31.073 -14.489 3.770 1.00 11.50 H new ATOM 0 HB3 MET A 26 31.112 -16.040 3.920 1.00 11.50 H new ATOM 0 HG2 MET A 26 29.764 -14.237 5.625 1.00 10.83 H new ATOM 0 HG3 MET A 26 29.111 -15.397 4.812 1.00 10.83 H new ATOM 0 HE1 MET A 26 30.105 -18.525 6.617 1.00 8.64 H new ATOM 0 HE2 MET A 26 29.526 -17.915 5.274 1.00 8.64 H new ATOM 0 HE3 MET A 26 31.084 -17.869 5.559 1.00 8.64 H new ATOM 530 N LYS A 27 34.174 -14.669 3.445 1.00 12.34 N ANISOU 530 N LYS A 27 1561 1478 1651 30 32 42 N ATOM 531 CA LYS A 27 35.395 -15.022 2.724 1.00 10.77 C ANISOU 531 CA LYS A 27 1343 1286 1462 39 40 46 C ATOM 532 C LYS A 27 36.473 -15.469 3.710 1.00 13.06 C ANISOU 532 C LYS A 27 1628 1570 1763 62 23 45 C ATOM 533 O LYS A 27 37.125 -16.504 3.518 1.00 8.25 O ANISOU 533 O LYS A 27 1021 960 1153 84 36 44 O ATOM 534 CB LYS A 27 35.872 -13.835 1.873 1.00 8.81 C ANISOU 534 CB LYS A 27 1062 1053 1234 23 39 59 C ATOM 535 CG LYS A 27 37.175 -14.077 1.095 1.00 7.58 C ANISOU 535 CG LYS A 27 874 913 1091 35 60 74 C ATOM 536 CD LYS A 27 37.504 -12.905 0.181 1.00 12.60 C ANISOU 536 CD LYS A 27 1479 1565 1744 12 64 97 C ATOM 537 CE LYS A 27 38.716 -13.169 -0.712 1.00 20.98 C ANISOU 537 CE LYS A 27 2505 2653 2815 27 102 121 C ATOM 538 NZ LYS A 27 40.004 -13.157 0.030 1.00 18.94 N ANISOU 538 NZ LYS A 27 2194 2402 2600 40 87 141 N ATOM 0 H LYS A 27 33.875 -13.876 3.299 1.00 12.34 H new ATOM 0 HA LYS A 27 35.210 -15.762 2.124 1.00 10.77 H new ATOM 0 HB2 LYS A 27 35.172 -13.605 1.242 1.00 8.81 H new ATOM 0 HB3 LYS A 27 35.995 -13.067 2.453 1.00 8.81 H new ATOM 0 HG2 LYS A 27 37.904 -14.217 1.719 1.00 7.58 H new ATOM 0 HG3 LYS A 27 37.093 -14.887 0.568 1.00 7.58 H new ATOM 0 HD2 LYS A 27 36.734 -12.709 -0.376 1.00 12.60 H new ATOM 0 HD3 LYS A 27 37.671 -12.117 0.721 1.00 12.60 H new ATOM 0 HE2 LYS A 27 38.608 -14.029 -1.147 1.00 20.98 H new ATOM 0 HE3 LYS A 27 38.747 -12.498 -1.412 1.00 20.98 H new ATOM 0 HZ1 LYS A 27 40.617 -12.723 -0.447 1.00 18.94 H new ATOM 0 HZ2 LYS A 27 39.892 -12.748 0.812 1.00 18.94 H new ATOM 0 HZ3 LYS A 27 40.274 -13.993 0.169 1.00 18.94 H new ATOM 552 N GLY A 28 36.650 -14.709 4.794 1.00 13.38 N ANISOU 552 N GLY A 28 1670 1602 1813 61 -10 44 N ATOM 553 CA GLY A 28 37.625 -15.090 5.802 1.00 14.08 C ANISOU 553 CA GLY A 28 1759 1679 1911 80 -40 46 C ATOM 554 C GLY A 28 37.326 -16.444 6.410 1.00 11.57 C ANISOU 554 C GLY A 28 1480 1350 1568 100 -31 38 C ATOM 555 O GLY A 28 38.236 -17.236 6.664 1.00 9.10 O ANISOU 555 O GLY A 28 1162 1031 1265 122 -42 41 O ATOM 0 H GLY A 28 36.221 -13.982 4.958 1.00 13.38 H new ATOM 0 HA2 GLY A 28 38.509 -15.105 5.404 1.00 14.08 H new ATOM 0 HA3 GLY A 28 37.641 -14.420 6.503 1.00 14.08 H new ATOM 559 N ALA A 29 36.043 -16.729 6.656 1.00 9.63 N ANISOU 559 N ALA A 29 1269 1098 1291 92 -13 32 N ATOM 560 CA ALA A 29 35.665 -18.023 7.208 1.00 10.10 C ANISOU 560 CA ALA A 29 1366 1143 1327 102 -5 33 C ATOM 561 C ALA A 29 35.984 -19.151 6.234 1.00 8.75 C ANISOU 561 C ALA A 29 1197 968 1161 109 11 32 C ATOM 562 O ALA A 29 36.551 -20.174 6.624 1.00 10.68 O ANISOU 562 O ALA A 29 1461 1195 1401 132 1 31 O ATOM 563 CB ALA A 29 34.180 -18.024 7.579 1.00 9.71 C ANISOU 563 CB ALA A 29 1340 1094 1254 87 16 40 C ATOM 0 H ALA A 29 35.388 -16.191 6.511 1.00 9.63 H new ATOM 0 HA ALA A 29 36.185 -18.176 8.012 1.00 10.10 H new ATOM 0 HB1 ALA A 29 33.938 -18.889 7.945 1.00 9.71 H new ATOM 0 HB2 ALA A 29 34.011 -17.335 8.240 1.00 9.71 H new ATOM 0 HB3 ALA A 29 33.648 -17.849 6.787 1.00 9.71 H new ATOM 569 N VAL A 30 35.652 -18.976 4.955 1.00 12.12 N ANISOU 569 N VAL A 30 1610 1405 1590 96 32 30 N ATOM 570 CA VAL A 30 35.993 -20.001 3.970 1.00 11.45 C ANISOU 570 CA VAL A 30 1543 1311 1498 111 47 24 C ATOM 571 C VAL A 30 37.494 -20.265 3.963 1.00 7.59 C ANISOU 571 C VAL A 30 1030 826 1028 152 48 24 C ATOM 572 O VAL A 30 37.935 -21.421 3.918 1.00 8.59 O ANISOU 572 O VAL A 30 1184 933 1146 184 51 19 O ATOM 573 CB VAL A 30 35.495 -19.587 2.577 1.00 8.18 C ANISOU 573 CB VAL A 30 1125 907 1076 92 65 23 C ATOM 574 CG1 VAL A 30 36.075 -20.528 1.521 1.00 10.27 C ANISOU 574 CG1 VAL A 30 1420 1160 1323 121 84 13 C ATOM 575 CG2 VAL A 30 33.973 -19.571 2.545 1.00 9.73 C ANISOU 575 CG2 VAL A 30 1341 1095 1262 53 57 29 C ATOM 0 H VAL A 30 35.239 -18.289 4.643 1.00 12.12 H new ATOM 0 HA VAL A 30 35.550 -20.828 4.216 1.00 11.45 H new ATOM 0 HB VAL A 30 35.799 -18.688 2.377 1.00 8.18 H new ATOM 0 HG11 VAL A 30 35.759 -20.264 0.643 1.00 10.27 H new ATOM 0 HG12 VAL A 30 37.044 -20.481 1.543 1.00 10.27 H new ATOM 0 HG13 VAL A 30 35.791 -21.437 1.706 1.00 10.27 H new ATOM 0 HG21 VAL A 30 33.670 -19.308 1.662 1.00 9.73 H new ATOM 0 HG22 VAL A 30 33.635 -20.456 2.752 1.00 9.73 H new ATOM 0 HG23 VAL A 30 33.642 -18.938 3.201 1.00 9.73 H new ATOM 585 N GLU A 31 38.301 -19.204 4.014 1.00 13.75 N ANISOU 585 N GLU A 31 1756 1630 1838 152 43 35 N ATOM 586 CA GLU A 31 39.750 -19.346 3.905 1.00 9.42 C ANISOU 586 CA GLU A 31 1164 1094 1321 188 46 47 C ATOM 587 C GLU A 31 40.377 -20.012 5.125 1.00 13.43 C ANISOU 587 C GLU A 31 1679 1583 1842 212 10 50 C ATOM 588 O GLU A 31 41.570 -20.336 5.084 1.00 13.57 O ANISOU 588 O GLU A 31 1657 1609 1891 249 9 64 O ATOM 589 CB GLU A 31 40.374 -17.976 3.646 1.00 9.89 C ANISOU 589 CB GLU A 31 1160 1182 1418 168 41 68 C ATOM 590 CG GLU A 31 40.014 -17.440 2.249 1.00 10.66 C ANISOU 590 CG GLU A 31 1248 1299 1503 152 81 72 C ATOM 591 CD GLU A 31 40.475 -16.019 1.990 1.00 17.18 C ANISOU 591 CD GLU A 31 2018 2147 2363 123 72 98 C ATOM 592 OE1 GLU A 31 40.857 -15.316 2.945 1.00 17.78 O ANISOU 592 OE1 GLU A 31 2070 2215 2469 106 24 108 O ATOM 593 OE2 GLU A 31 40.437 -15.610 0.810 1.00 21.63 O ANISOU 593 OE2 GLU A 31 2571 2730 2920 115 108 109 O ATOM 0 H GLU A 31 38.028 -18.394 4.111 1.00 13.75 H new ATOM 0 HA GLU A 31 39.933 -19.937 3.158 1.00 9.42 H new ATOM 0 HB2 GLU A 31 40.070 -17.349 4.321 1.00 9.89 H new ATOM 0 HB3 GLU A 31 41.338 -18.038 3.730 1.00 9.89 H new ATOM 0 HG2 GLU A 31 40.405 -18.023 1.579 1.00 10.66 H new ATOM 0 HG3 GLU A 31 39.052 -17.483 2.135 1.00 10.66 H new ATOM 600 N LYS A 32 39.609 -20.245 6.194 1.00 11.75 N ANISOU 600 N LYS A 32 1514 1347 1604 197 -17 41 N ATOM 601 CA LYS A 32 40.101 -21.086 7.278 1.00 11.29 C ANISOU 601 CA LYS A 32 1479 1264 1545 222 -51 44 C ATOM 602 C LYS A 32 40.321 -22.522 6.827 1.00 10.93 C ANISOU 602 C LYS A 32 1464 1199 1490 260 -33 38 C ATOM 603 O LYS A 32 41.036 -23.270 7.502 1.00 10.38 O ANISOU 603 O LYS A 32 1403 1109 1430 292 -59 44 O ATOM 604 CB LYS A 32 39.129 -21.062 8.465 1.00 12.76 C ANISOU 604 CB LYS A 32 1721 1432 1696 199 -72 41 C ATOM 605 CG LYS A 32 38.929 -19.689 9.077 1.00 10.35 C ANISOU 605 CG LYS A 32 1406 1136 1390 176 -95 42 C ATOM 606 CD LYS A 32 40.233 -19.091 9.593 1.00 14.28 C ANISOU 606 CD LYS A 32 1869 1633 1925 185 -146 52 C ATOM 607 CE LYS A 32 40.010 -17.665 10.099 1.00 14.08 C ANISOU 607 CE LYS A 32 1849 1606 1895 160 -177 49 C ATOM 608 NZ LYS A 32 41.286 -16.964 10.461 1.00 13.30 N ANISOU 608 NZ LYS A 32 1711 1501 1840 156 -241 65 N ATOM 0 H LYS A 32 38.816 -19.931 6.306 1.00 11.75 H new ATOM 0 HA LYS A 32 40.957 -20.722 7.554 1.00 11.29 H new ATOM 0 HB2 LYS A 32 38.269 -21.403 8.173 1.00 12.76 H new ATOM 0 HB3 LYS A 32 39.456 -21.666 9.150 1.00 12.76 H new ATOM 0 HG2 LYS A 32 38.543 -19.095 8.415 1.00 10.35 H new ATOM 0 HG3 LYS A 32 38.293 -19.752 9.807 1.00 10.35 H new ATOM 0 HD2 LYS A 32 40.586 -19.642 10.309 1.00 14.28 H new ATOM 0 HD3 LYS A 32 40.896 -19.088 8.885 1.00 14.28 H new ATOM 0 HE2 LYS A 32 39.549 -17.154 9.416 1.00 14.08 H new ATOM 0 HE3 LYS A 32 39.429 -17.690 10.876 1.00 14.08 H new ATOM 0 HZ1 LYS A 32 41.225 -16.645 11.289 1.00 13.30 H new ATOM 0 HZ2 LYS A 32 41.964 -17.539 10.414 1.00 13.30 H new ATOM 0 HZ3 LYS A 32 41.427 -16.292 9.894 1.00 13.30 H new ATOM 622 N GLY A 33 39.712 -22.933 5.715 1.00 11.09 N ANISOU 622 N GLY A 33 1509 1216 1489 257 5 26 N ATOM 623 CA GLY A 33 39.992 -24.219 5.122 1.00 10.49 C ANISOU 623 CA GLY A 33 1473 1114 1399 299 20 16 C ATOM 624 C GLY A 33 39.064 -25.340 5.525 1.00 12.81 C ANISOU 624 C GLY A 33 1847 1363 1660 284 0 9 C ATOM 625 O GLY A 33 39.158 -26.433 4.953 1.00 17.35 O ANISOU 625 O GLY A 33 2472 1904 2217 315 6 -3 O ATOM 0 H GLY A 33 39.127 -22.468 5.290 1.00 11.09 H new ATOM 0 HA2 GLY A 33 39.960 -24.126 4.157 1.00 10.49 H new ATOM 0 HA3 GLY A 33 40.899 -24.473 5.353 1.00 10.49 H new ATOM 629 N AGLU A 34 38.189 -25.121 6.498 0.58 13.50 N ANISOU 629 N AGLU A 34 1949 1444 1734 241 -21 20 N ATOM 630 N BGLU A 34 38.173 -25.112 6.483 0.42 13.80 N ANISOU 630 N BGLU A 34 1988 1483 1773 240 -20 19 N ATOM 631 CA AGLU A 34 37.221 -26.133 6.879 0.58 9.16 C ANISOU 631 CA AGLU A 34 1466 856 1158 216 -36 26 C ATOM 632 CA BGLU A 34 37.220 -26.129 6.894 0.42 11.00 C ANISOU 632 CA BGLU A 34 1700 1090 1391 216 -36 26 C ATOM 633 C AGLU A 34 35.984 -26.025 5.995 0.58 14.76 C ANISOU 633 C AGLU A 34 2190 1564 1852 170 -22 26 C ATOM 634 C BGLU A 34 35.941 -26.006 6.072 0.42 16.69 C ANISOU 634 C BGLU A 34 2434 1810 2097 168 -22 27 C ATOM 635 O AGLU A 34 35.680 -24.965 5.441 0.58 13.40 O ANISOU 635 O AGLU A 34 1976 1427 1688 151 -2 23 O ATOM 636 O BGLU A 34 35.558 -24.915 5.641 0.42 15.57 O ANISOU 636 O BGLU A 34 2250 1703 1963 145 -4 27 O ATOM 637 CB AGLU A 34 36.828 -25.991 8.349 0.58 13.55 C ANISOU 637 CB AGLU A 34 2033 1411 1704 194 -56 46 C ATOM 638 CB BGLU A 34 36.914 -26.002 8.389 0.42 15.27 C ANISOU 638 CB BGLU A 34 2250 1629 1923 198 -57 45 C ATOM 639 CG AGLU A 34 37.993 -26.095 9.323 0.58 19.87 C ANISOU 639 CG AGLU A 34 2828 2205 2516 234 -86 49 C ATOM 640 CG BGLU A 34 38.163 -25.824 9.252 0.42 21.00 C ANISOU 640 CG BGLU A 34 2956 2357 2665 237 -85 47 C ATOM 641 CD AGLU A 34 38.561 -27.501 9.430 0.58 31.07 C ANISOU 641 CD AGLU A 34 4295 3579 3933 271 -109 49 C ATOM 642 CD BGLU A 34 37.886 -25.944 10.743 0.42 32.17 C ANISOU 642 CD BGLU A 34 4410 3759 4056 225 -112 64 C ATOM 643 OE1AGLU A 34 39.692 -27.645 9.943 0.58 35.00 O ANISOU 643 OE1AGLU A 34 4777 4072 4451 314 -136 51 O ATOM 644 OE1BGLU A 34 37.247 -26.935 11.156 0.42 25.46 O ANISOU 644 OE1BGLU A 34 3616 2878 3181 211 -117 79 O ATOM 645 OE2AGLU A 34 37.881 -28.463 9.010 0.58 30.66 O ANISOU 645 OE2AGLU A 34 4296 3492 3862 258 -107 49 O ATOM 646 OE2BGLU A 34 38.309 -25.046 11.504 0.42 28.49 O ANISOU 646 OE2BGLU A 34 3924 3310 3592 229 -131 66 O ATOM 0 H AGLU A 34 38.141 -24.391 6.950 0.58 13.80 H new ATOM 0 H BGLU A 34 38.105 -24.368 6.909 0.42 13.80 H new ATOM 0 HA AGLU A 34 37.628 -27.005 6.758 0.58 11.00 H new ATOM 0 HA BGLU A 34 37.608 -27.004 6.737 0.42 11.00 H new ATOM 0 HB2AGLU A 34 36.391 -25.134 8.475 0.58 15.27 H new ATOM 0 HB2BGLU A 34 36.323 -25.246 8.528 0.42 15.27 H new ATOM 0 HB3AGLU A 34 36.177 -26.676 8.566 0.58 15.27 H new ATOM 0 HB3BGLU A 34 36.436 -26.793 8.683 0.42 15.27 H new ATOM 0 HG2AGLU A 34 38.696 -25.489 9.043 0.58 21.00 H new ATOM 0 HG2BGLU A 34 38.822 -26.489 8.997 0.42 21.00 H new ATOM 0 HG3AGLU A 34 37.700 -25.803 10.201 0.58 21.00 H new ATOM 0 HG3BGLU A 34 38.553 -24.954 9.071 0.42 21.00 H new ATOM 659 N GLU A 35 35.283 -27.142 5.853 1.00 17.90 N ANISOU 659 N GLU A 35 2650 1919 2233 150 -40 32 N ATOM 660 CA GLU A 35 34.038 -27.140 5.104 1.00 16.09 C ANISOU 660 CA GLU A 35 2435 1682 1996 98 -43 40 C ATOM 661 C GLU A 35 33.010 -26.273 5.833 1.00 19.30 C ANISOU 661 C GLU A 35 2797 2124 2413 51 -31 68 C ATOM 662 O GLU A 35 33.148 -25.964 7.023 1.00 15.58 O ANISOU 662 O GLU A 35 2310 1669 1941 58 -25 81 O ATOM 663 CB GLU A 35 33.551 -28.581 4.902 1.00 16.35 C ANISOU 663 CB GLU A 35 2547 1651 2013 80 -79 46 C ATOM 664 CG GLU A 35 34.572 -29.434 4.099 1.00 22.18 C ANISOU 664 CG GLU A 35 3344 2349 2734 142 -85 12 C ATOM 665 CD GLU A 35 34.109 -30.851 3.784 1.00 35.27 C ANISOU 665 CD GLU A 35 5100 3931 4372 127 -132 13 C ATOM 666 OE1 GLU A 35 34.976 -31.733 3.582 1.00 19.63 O ANISOU 666 OE1 GLU A 35 3177 1907 2376 188 -140 -11 O ATOM 667 OE2 GLU A 35 32.886 -31.089 3.721 1.00 31.84 O ANISOU 667 OE2 GLU A 35 4684 3474 3939 56 -162 39 O ATOM 0 H AGLU A 35 35.509 -27.905 6.180 0.58 17.90 H new ATOM 0 H BGLU A 35 35.540 -27.915 6.128 0.42 17.90 H new ATOM 0 HA GLU A 35 34.174 -26.757 4.223 1.00 16.09 H new ATOM 0 HB2 GLU A 35 33.396 -28.993 5.766 1.00 16.35 H new ATOM 0 HB3 GLU A 35 32.701 -28.572 4.435 1.00 16.35 H new ATOM 0 HG2 GLU A 35 34.771 -28.979 3.266 1.00 22.18 H new ATOM 0 HG3 GLU A 35 35.401 -29.482 4.601 1.00 22.18 H new ATOM 674 N LEU A 36 31.996 -25.831 5.092 1.00 11.64 N ANISOU 674 N LEU A 36 1809 1165 1448 9 -29 78 N ATOM 675 CA LEU A 36 30.947 -24.978 5.639 1.00 8.26 C ANISOU 675 CA LEU A 36 1333 772 1034 -26 -12 106 C ATOM 676 C LEU A 36 29.705 -25.802 5.939 1.00 14.86 C ANISOU 676 C LEU A 36 2185 1587 1876 -79 -28 149 C ATOM 677 O LEU A 36 29.328 -26.683 5.166 1.00 10.86 O ANISOU 677 O LEU A 36 1718 1039 1370 -109 -63 154 O ATOM 678 CB LEU A 36 30.548 -23.857 4.678 1.00 9.25 C ANISOU 678 CB LEU A 36 1415 928 1172 -39 -1 99 C ATOM 679 CG LEU A 36 31.589 -22.894 4.126 1.00 25.15 C ANISOU 679 CG LEU A 36 3404 2966 3186 -2 15 68 C ATOM 680 CD1 LEU A 36 30.881 -21.703 3.486 1.00 20.51 C ANISOU 680 CD1 LEU A 36 2773 2407 2612 -25 23 74 C ATOM 681 CD2 LEU A 36 32.520 -22.454 5.206 1.00 19.77 C ANISOU 681 CD2 LEU A 36 2705 2300 2506 33 25 60 C ATOM 0 H LEU A 36 31.898 -26.018 4.258 1.00 11.64 H new ATOM 0 HA LEU A 36 31.307 -24.583 6.448 1.00 8.26 H new ATOM 0 HB2 LEU A 36 30.115 -24.275 3.917 1.00 9.25 H new ATOM 0 HB3 LEU A 36 29.876 -23.322 5.128 1.00 9.25 H new ATOM 0 HG LEU A 36 32.120 -23.343 3.450 1.00 25.15 H new ATOM 0 HD11 LEU A 36 31.541 -21.086 3.132 1.00 20.51 H new ATOM 0 HD12 LEU A 36 30.311 -22.014 2.765 1.00 20.51 H new ATOM 0 HD13 LEU A 36 30.341 -21.251 4.153 1.00 20.51 H new ATOM 0 HD21 LEU A 36 33.176 -21.842 4.838 1.00 19.77 H new ATOM 0 HD22 LEU A 36 32.017 -22.007 5.905 1.00 19.77 H new ATOM 0 HD23 LEU A 36 32.973 -23.227 5.578 1.00 19.77 H new ATOM 693 N SER A 37 29.052 -25.479 7.044 1.00 10.33 N ANISOU 693 N SER A 37 1581 1039 1305 -91 -2 184 N ATOM 694 CA SER A 37 27.760 -26.056 7.345 1.00 9.90 C ANISOU 694 CA SER A 37 1517 978 1266 -146 -5 239 C ATOM 695 C SER A 37 26.689 -25.464 6.435 1.00 9.65 C ANISOU 695 C SER A 37 1434 966 1266 -185 -9 259 C ATOM 696 O SER A 37 26.910 -24.495 5.709 1.00 9.89 O ANISOU 696 O SER A 37 1440 1019 1301 -167 -3 229 O ATOM 697 CB SER A 37 27.388 -25.775 8.792 1.00 13.10 C ANISOU 697 CB SER A 37 1903 1414 1659 -136 39 274 C ATOM 698 OG SER A 37 27.213 -24.378 8.940 1.00 9.28 O ANISOU 698 OG SER A 37 1369 980 1178 -109 78 263 O ATOM 0 H SER A 37 29.344 -24.925 7.633 1.00 10.33 H new ATOM 0 HA SER A 37 27.813 -27.014 7.200 1.00 9.90 H new ATOM 0 HB2 SER A 37 26.573 -26.245 9.029 1.00 13.10 H new ATOM 0 HB3 SER A 37 28.083 -26.094 9.388 1.00 13.10 H new ATOM 0 HG SER A 37 26.896 -24.214 9.701 1.00 9.28 H new ATOM 704 N CYS A 38 25.491 -26.038 6.518 1.00 11.11 N ANISOU 704 N CYS A 38 1600 1144 1478 -243 -22 317 N ATOM 705 CA CYS A 38 24.379 -25.531 5.722 1.00 11.23 C ANISOU 705 CA CYS A 38 1558 1177 1533 -285 -35 347 C ATOM 706 C CYS A 38 24.113 -24.061 6.027 1.00 11.77 C ANISOU 706 C CYS A 38 1557 1306 1610 -249 20 345 C ATOM 707 O CYS A 38 23.929 -23.245 5.114 1.00 9.71 O ANISOU 707 O CYS A 38 1267 1057 1364 -249 8 328 O ATOM 708 CB CYS A 38 23.129 -26.372 5.981 1.00 13.45 C ANISOU 708 CB CYS A 38 1813 1446 1853 -356 -55 425 C ATOM 709 SG CYS A 38 21.720 -25.856 4.995 1.00 21.72 S ANISOU 709 SG CYS A 38 2780 2510 2962 -414 -87 473 S ATOM 0 H CYS A 38 25.304 -26.710 7.020 1.00 11.11 H new ATOM 0 HA CYS A 38 24.615 -25.599 4.784 1.00 11.23 H new ATOM 0 HB2 CYS A 38 23.326 -27.303 5.792 1.00 13.45 H new ATOM 0 HB3 CYS A 38 22.897 -26.317 6.921 1.00 13.45 H new ATOM 0 HG CYS A 38 21.820 -24.689 4.733 1.00 21.72 H new ATOM 715 N GLU A 39 24.076 -23.699 7.311 1.00 9.45 N ANISOU 715 N GLU A 39 1244 1045 1301 -216 77 361 N ATOM 716 CA GLU A 39 23.826 -22.303 7.652 1.00 9.27 C ANISOU 716 CA GLU A 39 1172 1071 1280 -173 127 355 C ATOM 717 C GLU A 39 24.940 -21.408 7.131 1.00 8.65 C ANISOU 717 C GLU A 39 1117 990 1180 -131 116 286 C ATOM 718 O GLU A 39 24.681 -20.301 6.643 1.00 8.48 O ANISOU 718 O GLU A 39 1057 990 1174 -117 123 276 O ATOM 719 CB GLU A 39 23.670 -22.144 9.168 1.00 13.14 C ANISOU 719 CB GLU A 39 1663 1589 1741 -136 190 379 C ATOM 720 CG GLU A 39 23.358 -20.717 9.599 1.00 21.56 C ANISOU 720 CG GLU A 39 2694 2699 2801 -82 242 371 C ATOM 721 CD GLU A 39 23.170 -20.579 11.102 1.00 31.93 C ANISOU 721 CD GLU A 39 4024 4035 4072 -38 308 393 C ATOM 722 OE1 GLU A 39 23.482 -21.536 11.840 1.00 22.77 O ANISOU 722 OE1 GLU A 39 2910 2858 2883 -48 309 409 O ATOM 723 OE2 GLU A 39 22.708 -19.508 11.545 1.00 34.52 O ANISOU 723 OE2 GLU A 39 4330 4396 4392 11 358 395 O ATOM 0 H GLU A 39 24.189 -24.229 7.979 1.00 9.45 H new ATOM 0 HA GLU A 39 22.999 -22.030 7.226 1.00 9.27 H new ATOM 0 HB2 GLU A 39 22.961 -22.730 9.476 1.00 13.14 H new ATOM 0 HB3 GLU A 39 24.487 -22.434 9.602 1.00 13.14 H new ATOM 0 HG2 GLU A 39 24.078 -20.133 9.313 1.00 21.56 H new ATOM 0 HG3 GLU A 39 22.553 -20.417 9.148 1.00 21.56 H new ATOM 729 N GLU A 40 26.189 -21.875 7.220 1.00 8.39 N ANISOU 729 N GLU A 40 1141 930 1117 -110 97 245 N ATOM 730 CA GLU A 40 27.326 -21.069 6.785 1.00 7.92 C ANISOU 730 CA GLU A 40 1094 871 1044 -73 88 192 C ATOM 731 C GLU A 40 27.337 -20.891 5.274 1.00 10.75 C ANISOU 731 C GLU A 40 1445 1221 1420 -95 58 175 C ATOM 732 O GLU A 40 27.687 -19.814 4.775 1.00 10.98 O ANISOU 732 O GLU A 40 1455 1266 1453 -77 62 152 O ATOM 733 CB GLU A 40 28.623 -21.714 7.270 1.00 9.22 C ANISOU 733 CB GLU A 40 1309 1011 1181 -46 75 163 C ATOM 734 CG GLU A 40 28.742 -21.701 8.796 1.00 13.39 C ANISOU 734 CG GLU A 40 1857 1548 1683 -19 99 174 C ATOM 735 CD GLU A 40 29.764 -22.683 9.345 1.00 16.99 C ANISOU 735 CD GLU A 40 2366 1973 2118 -3 76 162 C ATOM 736 OE1 GLU A 40 30.333 -23.467 8.560 1.00 12.83 O ANISOU 736 OE1 GLU A 40 1859 1417 1599 -8 47 147 O ATOM 737 OE2 GLU A 40 29.993 -22.673 10.576 1.00 13.75 O ANISOU 737 OE2 GLU A 40 1983 1564 1679 21 86 169 O ATOM 0 H GLU A 40 26.395 -22.651 7.528 1.00 8.39 H new ATOM 0 HA GLU A 40 27.246 -20.184 7.175 1.00 7.92 H new ATOM 0 HB2 GLU A 40 28.665 -22.629 6.952 1.00 9.22 H new ATOM 0 HB3 GLU A 40 29.379 -21.245 6.885 1.00 9.22 H new ATOM 0 HG2 GLU A 40 28.979 -20.806 9.085 1.00 13.39 H new ATOM 0 HG3 GLU A 40 27.875 -21.902 9.181 1.00 13.39 H new ATOM 744 N ARG A 41 26.967 -21.937 4.531 1.00 9.21 N ANISOU 744 N ARG A 41 1273 994 1231 -134 24 189 N ATOM 745 CA ARG A 41 26.851 -21.811 3.087 1.00 8.60 C ANISOU 745 CA ARG A 41 1203 903 1160 -155 -9 176 C ATOM 746 C ARG A 41 25.842 -20.740 2.730 1.00 10.79 C ANISOU 746 C ARG A 41 1420 1211 1467 -172 -5 199 C ATOM 747 O ARG A 41 26.064 -19.938 1.817 1.00 10.73 O ANISOU 747 O ARG A 41 1408 1209 1458 -165 -14 178 O ATOM 748 CB ARG A 41 26.437 -23.146 2.466 1.00 12.85 C ANISOU 748 CB ARG A 41 1790 1394 1698 -199 -58 190 C ATOM 749 CG ARG A 41 27.497 -24.212 2.527 1.00 14.62 C ANISOU 749 CG ARG A 41 2087 1579 1890 -173 -69 160 C ATOM 750 CD ARG A 41 27.183 -25.368 1.597 1.00 13.54 C ANISOU 750 CD ARG A 41 2018 1383 1742 -209 -128 162 C ATOM 751 NE ARG A 41 25.982 -26.120 1.960 1.00 14.23 N ANISOU 751 NE ARG A 41 2099 1448 1860 -273 -163 216 N ATOM 752 CZ ARG A 41 25.942 -27.131 2.832 1.00 16.31 C ANISOU 752 CZ ARG A 41 2389 1685 2124 -286 -171 240 C ATOM 753 NH1 ARG A 41 27.031 -27.518 3.481 1.00 16.57 N ANISOU 753 NH1 ARG A 41 2459 1709 2128 -236 -148 211 N ATOM 754 NH2 ARG A 41 24.795 -27.758 3.062 1.00 20.32 N ANISOU 754 NH2 ARG A 41 2881 2174 2664 -354 -205 301 N ATOM 0 H ARG A 41 26.782 -22.717 4.844 1.00 9.21 H new ATOM 0 HA ARG A 41 27.717 -21.556 2.732 1.00 8.60 H new ATOM 0 HB2 ARG A 41 25.642 -23.469 2.919 1.00 12.85 H new ATOM 0 HB3 ARG A 41 26.195 -22.998 1.538 1.00 12.85 H new ATOM 0 HG2 ARG A 41 28.356 -23.829 2.289 1.00 14.62 H new ATOM 0 HG3 ARG A 41 27.575 -24.540 3.437 1.00 14.62 H new ATOM 0 HD2 ARG A 41 27.078 -25.025 0.696 1.00 13.54 H new ATOM 0 HD3 ARG A 41 27.940 -25.974 1.584 1.00 13.54 H new ATOM 0 HE ARG A 41 25.243 -25.893 1.582 1.00 14.23 H new ATOM 0 HH11 ARG A 41 27.779 -27.116 3.344 1.00 16.57 H new ATOM 0 HH12 ARG A 41 26.990 -28.171 4.040 1.00 16.57 H new ATOM 0 HH21 ARG A 41 24.081 -27.513 2.650 1.00 20.32 H new ATOM 0 HH22 ARG A 41 24.766 -28.409 3.623 1.00 20.32 H new ATOM 768 N ASN A 42 24.726 -20.701 3.450 1.00 11.36 N ANISOU 768 N ASN A 42 1444 1303 1568 -190 12 246 N ATOM 769 CA ASN A 42 23.698 -19.734 3.109 1.00 11.80 C ANISOU 769 CA ASN A 42 1437 1387 1660 -200 15 274 C ATOM 770 C ASN A 42 24.122 -18.321 3.483 1.00 11.37 C ANISOU 770 C ASN A 42 1361 1362 1596 -146 54 247 C ATOM 771 O ASN A 42 23.773 -17.374 2.774 1.00 11.11 O ANISOU 771 O ASN A 42 1300 1341 1582 -145 43 246 O ATOM 772 CB ASN A 42 22.379 -20.149 3.755 1.00 16.23 C ANISOU 772 CB ASN A 42 1942 1965 2260 -231 29 342 C ATOM 773 CG ASN A 42 21.685 -21.264 2.964 1.00 22.26 C ANISOU 773 CG ASN A 42 2713 2692 3051 -303 -36 379 C ATOM 774 OD1 ASN A 42 20.942 -20.997 2.019 1.00 38.26 O ANISOU 774 OD1 ASN A 42 4710 4715 5111 -338 -80 400 O ATOM 775 ND2 ASN A 42 21.965 -22.511 3.318 1.00 37.05 N ANISOU 775 ND2 ASN A 42 4636 4532 4908 -326 -53 386 N ATOM 0 H ASN A 42 24.550 -21.210 4.120 1.00 11.36 H new ATOM 0 HA ASN A 42 23.568 -19.724 2.148 1.00 11.80 H new ATOM 0 HB2 ASN A 42 22.544 -20.450 4.662 1.00 16.23 H new ATOM 0 HB3 ASN A 42 21.791 -19.380 3.814 1.00 16.23 H new ATOM 0 HD21 ASN A 42 21.623 -23.169 2.882 1.00 37.05 H new ATOM 0 HD22 ASN A 42 22.488 -22.662 3.984 1.00 37.05 H new ATOM 782 N LEU A 43 24.919 -18.163 4.545 1.00 9.54 N ANISOU 782 N LEU A 43 1153 1138 1335 -104 88 223 N ATOM 783 CA LEU A 43 25.486 -16.854 4.868 1.00 10.53 C ANISOU 783 CA LEU A 43 1276 1277 1447 -58 108 192 C ATOM 784 C LEU A 43 26.420 -16.369 3.765 1.00 11.17 C ANISOU 784 C LEU A 43 1375 1345 1523 -60 78 156 C ATOM 785 O LEU A 43 26.393 -15.193 3.375 1.00 9.27 O ANISOU 785 O LEU A 43 1116 1113 1292 -47 75 147 O ATOM 786 CB LEU A 43 26.243 -16.917 6.198 1.00 8.91 C ANISOU 786 CB LEU A 43 1106 1071 1208 -19 133 175 C ATOM 787 CG LEU A 43 25.434 -17.085 7.483 1.00 15.94 C ANISOU 787 CG LEU A 43 1989 1980 2088 0 179 208 C ATOM 788 CD1 LEU A 43 26.374 -17.342 8.661 1.00 13.03 C ANISOU 788 CD1 LEU A 43 1677 1600 1675 33 187 187 C ATOM 789 CD2 LEU A 43 24.575 -15.865 7.730 1.00 15.40 C ANISOU 789 CD2 LEU A 43 1884 1937 2031 34 212 221 C ATOM 0 H LEU A 43 25.140 -18.795 5.084 1.00 9.54 H new ATOM 0 HA LEU A 43 24.753 -16.224 4.945 1.00 10.53 H new ATOM 0 HB2 LEU A 43 26.872 -17.653 6.146 1.00 8.91 H new ATOM 0 HB3 LEU A 43 26.765 -16.103 6.281 1.00 8.91 H new ATOM 0 HG LEU A 43 24.845 -17.850 7.388 1.00 15.94 H new ATOM 0 HD11 LEU A 43 25.854 -17.448 9.473 1.00 13.03 H new ATOM 0 HD12 LEU A 43 26.885 -18.150 8.497 1.00 13.03 H new ATOM 0 HD13 LEU A 43 26.980 -16.591 8.761 1.00 13.03 H new ATOM 0 HD21 LEU A 43 24.068 -15.986 8.548 1.00 15.40 H new ATOM 0 HD22 LEU A 43 25.141 -15.082 7.814 1.00 15.40 H new ATOM 0 HD23 LEU A 43 23.964 -15.743 6.987 1.00 15.40 H new ATOM 801 N LEU A 44 27.288 -17.258 3.283 1.00 8.02 N ANISOU 801 N LEU A 44 1015 925 1107 -71 59 137 N ATOM 802 CA LEU A 44 28.168 -16.920 2.173 1.00 9.10 C ANISOU 802 CA LEU A 44 1167 1054 1235 -70 42 111 C ATOM 803 C LEU A 44 27.362 -16.477 0.963 1.00 9.27 C ANISOU 803 C LEU A 44 1174 1076 1271 -99 19 125 C ATOM 804 O LEU A 44 27.653 -15.444 0.352 1.00 10.19 O ANISOU 804 O LEU A 44 1281 1200 1389 -93 16 115 O ATOM 805 CB LEU A 44 29.034 -18.125 1.821 1.00 8.52 C ANISOU 805 CB LEU A 44 1139 958 1139 -69 32 94 C ATOM 806 CG LEU A 44 29.938 -17.995 0.591 1.00 7.53 C ANISOU 806 CG LEU A 44 1036 828 998 -62 28 73 C ATOM 807 CD1 LEU A 44 31.098 -17.051 0.849 1.00 12.10 C ANISOU 807 CD1 LEU A 44 1591 1425 1580 -32 45 59 C ATOM 808 CD2 LEU A 44 30.444 -19.366 0.154 1.00 11.42 C ANISOU 808 CD2 LEU A 44 1583 1291 1465 -55 20 60 C ATOM 0 H LEU A 44 27.381 -18.058 3.585 1.00 8.02 H new ATOM 0 HA LEU A 44 28.740 -16.183 2.440 1.00 9.10 H new ATOM 0 HB2 LEU A 44 29.594 -18.328 2.587 1.00 8.52 H new ATOM 0 HB3 LEU A 44 28.450 -18.887 1.687 1.00 8.52 H new ATOM 0 HG LEU A 44 29.408 -17.616 -0.128 1.00 7.53 H new ATOM 0 HD11 LEU A 44 31.650 -16.991 0.053 1.00 12.10 H new ATOM 0 HD12 LEU A 44 30.756 -16.171 1.072 1.00 12.10 H new ATOM 0 HD13 LEU A 44 31.631 -17.387 1.587 1.00 12.10 H new ATOM 0 HD21 LEU A 44 31.014 -19.268 -0.625 1.00 11.42 H new ATOM 0 HD22 LEU A 44 30.950 -19.770 0.876 1.00 11.42 H new ATOM 0 HD23 LEU A 44 29.690 -19.934 -0.068 1.00 11.42 H new ATOM 820 N SER A 45 26.344 -17.261 0.606 1.00 10.87 N ANISOU 820 N SER A 45 1377 1267 1487 -135 -4 151 N ATOM 821 CA SER A 45 25.532 -16.966 -0.566 1.00 11.71 C ANISOU 821 CA SER A 45 1475 1367 1607 -168 -41 168 C ATOM 822 C SER A 45 24.800 -15.636 -0.421 1.00 12.43 C ANISOU 822 C SER A 45 1509 1484 1730 -158 -32 186 C ATOM 823 O SER A 45 24.830 -14.800 -1.329 1.00 11.23 O ANISOU 823 O SER A 45 1358 1332 1578 -161 -51 181 O ATOM 824 CB SER A 45 24.540 -18.103 -0.797 1.00 14.17 C ANISOU 824 CB SER A 45 1794 1656 1934 -216 -80 201 C ATOM 825 OG SER A 45 23.773 -17.876 -1.966 1.00 16.17 O ANISOU 825 OG SER A 45 2046 1897 2201 -252 -130 219 O ATOM 0 H SER A 45 26.110 -17.970 1.033 1.00 10.87 H new ATOM 0 HA SER A 45 26.119 -16.889 -1.334 1.00 11.71 H new ATOM 0 HB2 SER A 45 25.018 -18.943 -0.878 1.00 14.17 H new ATOM 0 HB3 SER A 45 23.951 -18.184 -0.030 1.00 14.17 H new ATOM 0 HG SER A 45 24.202 -17.380 -2.491 1.00 16.17 H new ATOM 831 N VAL A 46 24.115 -15.435 0.708 1.00 9.39 N ANISOU 831 N VAL A 46 1079 1120 1369 -141 -2 210 N ATOM 832 CA VAL A 46 23.369 -14.197 0.932 1.00 9.56 C ANISOU 832 CA VAL A 46 1050 1163 1419 -117 13 227 C ATOM 833 C VAL A 46 24.288 -12.987 0.826 1.00 12.47 C ANISOU 833 C VAL A 46 1439 1530 1769 -83 19 190 C ATOM 834 O VAL A 46 23.921 -11.952 0.252 1.00 12.56 O ANISOU 834 O VAL A 46 1432 1543 1798 -78 3 195 O ATOM 835 CB VAL A 46 22.668 -14.250 2.304 1.00 15.16 C ANISOU 835 CB VAL A 46 1721 1896 2143 -89 61 254 C ATOM 836 CG1 VAL A 46 22.105 -12.884 2.679 1.00 17.36 C ANISOU 836 CG1 VAL A 46 1963 2194 2440 -41 87 260 C ATOM 837 CG2 VAL A 46 21.569 -15.299 2.292 1.00 23.23 C ANISOU 837 CG2 VAL A 46 2705 2923 3199 -132 51 308 C ATOM 0 H VAL A 46 24.071 -16.002 1.353 1.00 9.39 H new ATOM 0 HA VAL A 46 22.690 -14.108 0.245 1.00 9.56 H new ATOM 0 HB VAL A 46 23.324 -14.497 2.974 1.00 15.16 H new ATOM 0 HG11 VAL A 46 21.669 -12.940 3.544 1.00 17.36 H new ATOM 0 HG12 VAL A 46 22.827 -12.237 2.722 1.00 17.36 H new ATOM 0 HG13 VAL A 46 21.461 -12.605 2.010 1.00 17.36 H new ATOM 0 HG21 VAL A 46 21.135 -15.324 3.159 1.00 23.23 H new ATOM 0 HG22 VAL A 46 20.916 -15.076 1.611 1.00 23.23 H new ATOM 0 HG23 VAL A 46 21.953 -16.168 2.098 1.00 23.23 H new ATOM 847 N ALA A 47 25.488 -13.085 1.395 1.00 10.51 N ANISOU 847 N ALA A 47 1226 1277 1490 -63 36 157 N ATOM 848 CA ALA A 47 26.382 -11.935 1.425 1.00 8.04 C ANISOU 848 CA ALA A 47 927 959 1167 -38 35 131 C ATOM 849 C ALA A 47 26.763 -11.500 0.019 1.00 12.33 C ANISOU 849 C ALA A 47 1480 1494 1709 -63 6 128 C ATOM 850 O ALA A 47 26.581 -10.336 -0.359 1.00 12.49 O ANISOU 850 O ALA A 47 1491 1512 1743 -58 -8 131 O ATOM 851 CB ALA A 47 27.629 -12.263 2.243 1.00 11.26 C ANISOU 851 CB ALA A 47 1366 1362 1550 -20 47 105 C ATOM 0 H ALA A 47 25.798 -13.798 1.763 1.00 10.51 H new ATOM 0 HA ALA A 47 25.915 -11.196 1.846 1.00 8.04 H new ATOM 0 HB1 ALA A 47 28.218 -11.493 2.258 1.00 11.26 H new ATOM 0 HB2 ALA A 47 27.371 -12.490 3.150 1.00 11.26 H new ATOM 0 HB3 ALA A 47 28.091 -13.015 1.841 1.00 11.26 H new ATOM 857 N TYR A 48 27.292 -12.424 -0.778 1.00 10.08 N ANISOU 857 N TYR A 48 1222 1202 1404 -87 -3 122 N ATOM 858 CA TYR A 48 27.746 -12.046 -2.110 1.00 8.98 C ANISOU 858 CA TYR A 48 1103 1058 1252 -105 -21 120 C ATOM 859 C TYR A 48 26.580 -11.771 -3.047 1.00 8.99 C ANISOU 859 C TYR A 48 1097 1053 1266 -131 -55 144 C ATOM 860 O TYR A 48 26.698 -10.919 -3.930 1.00 9.58 O ANISOU 860 O TYR A 48 1179 1124 1336 -139 -72 149 O ATOM 861 CB TYR A 48 28.663 -13.127 -2.671 1.00 9.85 C ANISOU 861 CB TYR A 48 1254 1162 1329 -109 -12 105 C ATOM 862 CG TYR A 48 30.070 -13.017 -2.128 1.00 9.29 C ANISOU 862 CG TYR A 48 1181 1099 1252 -83 15 89 C ATOM 863 CD1 TYR A 48 30.938 -12.052 -2.603 1.00 9.52 C ANISOU 863 CD1 TYR A 48 1200 1136 1281 -81 20 92 C ATOM 864 CD2 TYR A 48 30.527 -13.877 -1.137 1.00 10.76 C ANISOU 864 CD2 TYR A 48 1370 1284 1435 -64 29 77 C ATOM 865 CE1 TYR A 48 32.219 -11.943 -2.114 1.00 11.43 C ANISOU 865 CE1 TYR A 48 1428 1386 1529 -64 37 87 C ATOM 866 CE2 TYR A 48 31.820 -13.777 -0.644 1.00 11.30 C ANISOU 866 CE2 TYR A 48 1431 1358 1505 -42 44 67 C ATOM 867 CZ TYR A 48 32.658 -12.805 -1.135 1.00 12.11 C ANISOU 867 CZ TYR A 48 1516 1471 1616 -43 46 74 C ATOM 868 OH TYR A 48 33.946 -12.689 -0.653 1.00 12.22 O ANISOU 868 OH TYR A 48 1510 1492 1642 -28 53 74 O ATOM 0 H TYR A 48 27.395 -13.253 -0.574 1.00 10.08 H new ATOM 0 HA TYR A 48 28.247 -11.219 -2.037 1.00 8.98 H new ATOM 0 HB2 TYR A 48 28.301 -14.001 -2.454 1.00 9.85 H new ATOM 0 HB3 TYR A 48 28.685 -13.061 -3.638 1.00 9.85 H new ATOM 0 HD1 TYR A 48 30.651 -11.466 -3.265 1.00 9.52 H new ATOM 0 HD2 TYR A 48 29.957 -14.530 -0.799 1.00 10.76 H new ATOM 0 HE1 TYR A 48 32.789 -11.287 -2.445 1.00 11.43 H new ATOM 0 HE2 TYR A 48 32.117 -14.363 0.014 1.00 11.30 H new ATOM 0 HH TYR A 48 34.465 -12.497 -1.285 1.00 12.22 H new ATOM 878 N LYS A 49 25.446 -12.454 -2.860 1.00 9.21 N ANISOU 878 N LYS A 49 1107 1079 1314 -147 -70 165 N ATOM 879 CA LYS A 49 24.266 -12.155 -3.668 1.00 12.49 C ANISOU 879 CA LYS A 49 1503 1489 1754 -174 -113 195 C ATOM 880 C LYS A 49 23.868 -10.691 -3.521 1.00 12.79 C ANISOU 880 C LYS A 49 1503 1536 1821 -150 -113 205 C ATOM 881 O LYS A 49 23.527 -10.025 -4.509 1.00 9.60 O ANISOU 881 O LYS A 49 1104 1123 1422 -165 -149 218 O ATOM 882 CB LYS A 49 23.111 -13.075 -3.265 1.00 11.84 C ANISOU 882 CB LYS A 49 1388 1407 1704 -197 -128 227 C ATOM 883 CG LYS A 49 21.895 -13.083 -4.193 1.00 27.51 C ANISOU 883 CG LYS A 49 3352 3380 3720 -237 -190 266 C ATOM 884 CD LYS A 49 22.223 -13.479 -5.654 1.00 52.29 C ANISOU 884 CD LYS A 49 6566 6487 6815 -272 -243 254 C ATOM 885 CE LYS A 49 23.037 -14.781 -5.789 1.00 47.68 C ANISOU 885 CE LYS A 49 6053 5880 6181 -281 -239 225 C ATOM 886 NZ LYS A 49 22.253 -16.040 -5.584 1.00 33.90 N ANISOU 886 NZ LYS A 49 4310 4114 4457 -321 -277 250 N ATOM 0 H LYS A 49 25.342 -13.082 -2.281 1.00 9.21 H new ATOM 0 HA LYS A 49 24.479 -12.313 -4.601 1.00 12.49 H new ATOM 0 HB2 LYS A 49 23.451 -13.981 -3.202 1.00 11.84 H new ATOM 0 HB3 LYS A 49 22.815 -12.821 -2.377 1.00 11.84 H new ATOM 0 HG2 LYS A 49 21.234 -13.700 -3.841 1.00 27.51 H new ATOM 0 HG3 LYS A 49 21.491 -12.201 -4.189 1.00 27.51 H new ATOM 0 HD2 LYS A 49 21.393 -13.576 -6.146 1.00 52.29 H new ATOM 0 HD3 LYS A 49 22.717 -12.756 -6.071 1.00 52.29 H new ATOM 0 HE2 LYS A 49 23.438 -14.806 -6.672 1.00 47.68 H new ATOM 0 HE3 LYS A 49 23.764 -14.760 -5.147 1.00 47.68 H new ATOM 0 HZ1 LYS A 49 22.793 -16.743 -5.663 1.00 33.90 H new ATOM 0 HZ2 LYS A 49 21.891 -16.035 -4.771 1.00 33.90 H new ATOM 0 HZ3 LYS A 49 21.608 -16.091 -6.195 1.00 33.90 H new ATOM 900 N ASN A 50 23.918 -10.168 -2.295 1.00 10.13 N ANISOU 900 N ASN A 50 1139 1211 1498 -109 -75 198 N ATOM 901 CA ASN A 50 23.542 -8.780 -2.064 1.00 11.34 C ANISOU 901 CA ASN A 50 1269 1365 1675 -77 -75 203 C ATOM 902 C ASN A 50 24.600 -7.819 -2.597 1.00 14.20 C ANISOU 902 C ASN A 50 1668 1712 2016 -77 -87 182 C ATOM 903 O ASN A 50 24.263 -6.784 -3.185 1.00 13.54 O ANISOU 903 O ASN A 50 1581 1617 1947 -75 -115 194 O ATOM 904 CB ASN A 50 23.296 -8.554 -0.571 1.00 14.50 C ANISOU 904 CB ASN A 50 1647 1777 2083 -27 -30 198 C ATOM 905 CG ASN A 50 21.888 -8.936 -0.149 1.00 16.85 C ANISOU 905 CG ASN A 50 1887 2096 2420 -17 -15 238 C ATOM 906 OD1 ASN A 50 20.947 -8.163 -0.321 1.00 20.30 O ANISOU 906 OD1 ASN A 50 2283 2537 2893 3 -23 263 O ATOM 907 ND2 ASN A 50 21.737 -10.125 0.410 1.00 12.18 N ANISOU 907 ND2 ASN A 50 1286 1518 1825 -32 8 250 N ATOM 0 H ASN A 50 24.165 -10.598 -1.592 1.00 10.13 H new ATOM 0 HA ASN A 50 22.722 -8.598 -2.549 1.00 11.34 H new ATOM 0 HB2 ASN A 50 23.936 -9.073 -0.059 1.00 14.50 H new ATOM 0 HB3 ASN A 50 23.452 -7.621 -0.358 1.00 14.50 H new ATOM 0 HD21 ASN A 50 20.958 -10.383 0.669 1.00 12.18 H new ATOM 0 HD22 ASN A 50 22.417 -10.640 0.515 1.00 12.18 H new ATOM 914 N VAL A 51 25.881 -8.146 -2.422 1.00 8.56 N ANISOU 914 N VAL A 51 985 997 1272 -80 -70 158 N ATOM 915 CA VAL A 51 26.942 -7.299 -2.968 1.00 7.66 C ANISOU 915 CA VAL A 51 894 871 1143 -88 -80 150 C ATOM 916 C VAL A 51 26.824 -7.215 -4.488 1.00 11.13 C ANISOU 916 C VAL A 51 1353 1306 1570 -123 -107 168 C ATOM 917 O VAL A 51 26.764 -6.123 -5.066 1.00 11.50 O ANISOU 917 O VAL A 51 1405 1340 1624 -129 -132 181 O ATOM 918 CB VAL A 51 28.325 -7.819 -2.539 1.00 9.04 C ANISOU 918 CB VAL A 51 1085 1052 1298 -87 -56 131 C ATOM 919 CG1 VAL A 51 29.429 -7.081 -3.287 1.00 12.19 C ANISOU 919 CG1 VAL A 51 1496 1447 1689 -105 -63 138 C ATOM 920 CG2 VAL A 51 28.508 -7.637 -1.045 1.00 14.42 C ANISOU 920 CG2 VAL A 51 1761 1730 1987 -54 -43 114 C ATOM 0 H VAL A 51 26.154 -8.842 -1.997 1.00 8.56 H new ATOM 0 HA VAL A 51 26.842 -6.403 -2.611 1.00 7.66 H new ATOM 0 HB VAL A 51 28.379 -8.763 -2.755 1.00 9.04 H new ATOM 0 HG11 VAL A 51 30.293 -7.420 -3.006 1.00 12.19 H new ATOM 0 HG12 VAL A 51 29.323 -7.220 -4.241 1.00 12.19 H new ATOM 0 HG13 VAL A 51 29.375 -6.133 -3.091 1.00 12.19 H new ATOM 0 HG21 VAL A 51 29.382 -7.967 -0.783 1.00 14.42 H new ATOM 0 HG22 VAL A 51 28.439 -6.695 -0.823 1.00 14.42 H new ATOM 0 HG23 VAL A 51 27.821 -8.132 -0.572 1.00 14.42 H new ATOM 930 N VAL A 52 26.796 -8.363 -5.165 1.00 11.21 N ANISOU 930 N VAL A 52 1384 1320 1554 -145 -107 169 N ATOM 931 CA AVAL A 52 26.735 -8.340 -6.621 0.59 7.96 C ANISOU 931 CA AVAL A 52 1009 900 1116 -174 -134 183 C ATOM 932 CA BVAL A 52 26.735 -8.330 -6.624 0.41 8.82 C ANISOU 932 CA BVAL A 52 1118 1009 1224 -174 -134 183 C ATOM 933 C VAL A 52 25.388 -7.809 -7.097 1.00 10.66 C ANISOU 933 C VAL A 52 1335 1230 1485 -186 -183 208 C ATOM 934 O VAL A 52 25.297 -7.202 -8.168 1.00 11.11 O ANISOU 934 O VAL A 52 1419 1275 1527 -204 -215 225 O ATOM 935 CB AVAL A 52 27.030 -9.743 -7.186 0.59 10.55 C ANISOU 935 CB AVAL A 52 1381 1226 1401 -186 -126 172 C ATOM 936 CB BVAL A 52 27.030 -9.713 -7.237 0.41 9.90 C ANISOU 936 CB BVAL A 52 1300 1143 1318 -187 -127 172 C ATOM 937 CG1AVAL A 52 25.770 -10.598 -7.212 0.59 12.93 C ANISOU 937 CG1AVAL A 52 1679 1515 1717 -206 -164 182 C ATOM 938 CG1BVAL A 52 28.435 -10.144 -6.906 0.41 7.45 C ANISOU 938 CG1BVAL A 52 1000 846 984 -168 -78 152 C ATOM 939 CG2AVAL A 52 27.650 -9.641 -8.563 0.59 11.50 C ANISOU 939 CG2AVAL A 52 1558 1342 1471 -200 -128 177 C ATOM 940 CG2BVAL A 52 26.011 -10.747 -6.780 0.41 16.88 C ANISOU 940 CG2BVAL A 52 2172 2021 2221 -196 -147 175 C ATOM 0 H AVAL A 52 26.811 -9.146 -4.809 0.59 11.21 H new ATOM 0 H BVAL A 52 26.811 -9.147 -4.812 0.41 11.21 H new ATOM 0 HA AVAL A 52 27.416 -7.735 -6.956 0.59 8.82 H new ATOM 0 HA BVAL A 52 27.425 -7.721 -6.930 0.41 8.82 H new ATOM 0 HB AVAL A 52 27.668 -10.179 -6.599 0.59 9.90 H new ATOM 0 HB BVAL A 52 26.955 -9.641 -8.201 0.41 9.90 H new ATOM 0 HG11AVAL A 52 25.981 -11.474 -7.571 0.59 7.45 H new ATOM 0 HG11BVAL A 52 28.607 -11.015 -7.297 0.41 7.45 H new ATOM 0 HG12AVAL A 52 25.424 -10.693 -6.311 0.59 7.45 H new ATOM 0 HG12BVAL A 52 29.064 -9.499 -7.264 0.41 7.45 H new ATOM 0 HG13AVAL A 52 25.101 -10.172 -7.771 0.59 7.45 H new ATOM 0 HG13BVAL A 52 28.539 -10.196 -5.943 0.41 7.45 H new ATOM 0 HG21AVAL A 52 27.829 -10.531 -8.904 0.59 16.88 H new ATOM 0 HG21BVAL A 52 26.220 -11.606 -7.180 0.41 16.88 H new ATOM 0 HG22AVAL A 52 27.038 -9.183 -9.161 0.59 16.88 H new ATOM 0 HG22BVAL A 52 26.040 -10.825 -5.814 0.41 16.88 H new ATOM 0 HG23AVAL A 52 28.481 -9.143 -8.508 0.59 16.88 H new ATOM 0 HG23BVAL A 52 25.123 -10.470 -7.055 0.41 16.88 H new ATOM 959 N GLY A 53 24.325 -8.026 -6.322 1.00 12.47 N ANISOU 959 N GLY A 53 1519 1465 1756 -175 -190 218 N ATOM 960 CA GLY A 53 23.026 -7.503 -6.710 1.00 15.80 C ANISOU 960 CA GLY A 53 1909 1878 2216 -181 -236 250 C ATOM 961 C GLY A 53 23.030 -5.993 -6.841 1.00 18.68 C ANISOU 961 C GLY A 53 2268 2233 2597 -160 -249 257 C ATOM 962 O GLY A 53 22.459 -5.439 -7.783 1.00 13.74 O ANISOU 962 O GLY A 53 1649 1592 1979 -176 -298 281 O ATOM 0 H GLY A 53 24.337 -8.465 -5.583 1.00 12.47 H new ATOM 0 HA2 GLY A 53 22.760 -7.898 -7.555 1.00 15.80 H new ATOM 0 HA3 GLY A 53 22.364 -7.767 -6.052 1.00 15.80 H new ATOM 966 N GLY A 54 23.677 -5.310 -5.901 1.00 14.20 N ANISOU 966 N GLY A 54 1695 1667 2034 -126 -213 237 N ATOM 967 CA GLY A 54 23.806 -3.867 -6.001 1.00 15.10 C ANISOU 967 CA GLY A 54 1817 1760 2161 -108 -232 241 C ATOM 968 C GLY A 54 24.673 -3.436 -7.169 1.00 10.89 C ANISOU 968 C GLY A 54 1332 1214 1593 -145 -252 248 C ATOM 969 O GLY A 54 24.377 -2.441 -7.836 1.00 12.07 O ANISOU 969 O GLY A 54 1494 1341 1751 -151 -291 269 O ATOM 0 H GLY A 54 24.043 -5.661 -5.207 1.00 14.20 H new ATOM 0 HA2 GLY A 54 22.925 -3.473 -6.095 1.00 15.10 H new ATOM 0 HA3 GLY A 54 24.185 -3.522 -5.177 1.00 15.10 H new ATOM 973 N GLN A 55 25.752 -4.178 -7.434 1.00 11.19 N ANISOU 973 N GLN A 55 1397 1265 1590 -167 -223 236 N ATOM 974 CA GLN A 55 26.602 -3.885 -8.582 1.00 12.04 C ANISOU 974 CA GLN A 55 1548 1369 1660 -199 -226 250 C ATOM 975 C GLN A 55 25.856 -4.103 -9.891 1.00 8.56 C ANISOU 975 C GLN A 55 1141 918 1194 -225 -267 272 C ATOM 976 O GLN A 55 25.979 -3.299 -10.823 1.00 10.31 O ANISOU 976 O GLN A 55 1394 1125 1398 -244 -293 296 O ATOM 977 CB GLN A 55 27.848 -4.763 -8.553 1.00 9.32 C ANISOU 977 CB GLN A 55 1217 1045 1279 -204 -176 235 C ATOM 978 CG GLN A 55 28.751 -4.538 -7.358 1.00 15.72 C ANISOU 978 CG GLN A 55 1999 1862 2112 -185 -146 219 C ATOM 979 CD GLN A 55 29.895 -5.521 -7.321 1.00 14.31 C ANISOU 979 CD GLN A 55 1825 1707 1907 -185 -100 208 C ATOM 980 OE1 GLN A 55 29.712 -6.719 -7.553 1.00 15.17 O ANISOU 980 OE1 GLN A 55 1950 1825 1989 -181 -84 195 O ATOM 981 NE2 GLN A 55 31.084 -5.025 -7.040 1.00 16.85 N ANISOU 981 NE2 GLN A 55 2131 2034 2238 -189 -82 216 N ATOM 0 H GLN A 55 26.005 -4.851 -6.962 1.00 11.19 H new ATOM 0 HA GLN A 55 26.861 -2.952 -8.528 1.00 12.04 H new ATOM 0 HB2 GLN A 55 27.574 -5.693 -8.566 1.00 9.32 H new ATOM 0 HB3 GLN A 55 28.358 -4.607 -9.363 1.00 9.32 H new ATOM 0 HG2 GLN A 55 29.103 -3.634 -7.385 1.00 15.72 H new ATOM 0 HG3 GLN A 55 28.232 -4.616 -6.542 1.00 15.72 H new ATOM 0 HE21 GLN A 55 31.173 -4.184 -6.884 1.00 16.85 H new ATOM 0 HE22 GLN A 55 31.770 -5.542 -7.013 1.00 16.85 H new ATOM 990 N ARG A 56 25.101 -5.199 -9.991 1.00 9.97 N ANISOU 990 N ARG A 56 1319 1101 1369 -231 -281 267 N ATOM 991 CA ARG A 56 24.354 -5.467 -11.215 1.00 11.95 C ANISOU 991 CA ARG A 56 1609 1335 1595 -260 -336 288 C ATOM 992 C ARG A 56 23.305 -4.395 -11.468 1.00 10.89 C ANISOU 992 C ARG A 56 1450 1182 1505 -260 -395 318 C ATOM 993 O ARG A 56 23.115 -3.962 -12.608 1.00 9.91 O ANISOU 993 O ARG A 56 1372 1038 1354 -283 -441 341 O ATOM 994 CB ARG A 56 23.695 -6.842 -11.137 1.00 11.92 C ANISOU 994 CB ARG A 56 1607 1332 1591 -272 -353 281 C ATOM 995 CG ARG A 56 24.678 -8.003 -11.104 1.00 9.88 C ANISOU 995 CG ARG A 56 1390 1082 1280 -271 -305 252 C ATOM 996 CD ARG A 56 23.997 -9.261 -10.607 1.00 14.19 C ANISOU 996 CD ARG A 56 1922 1624 1844 -279 -320 245 C ATOM 997 NE ARG A 56 23.063 -9.816 -11.586 1.00 11.75 N ANISOU 997 NE ARG A 56 1656 1286 1521 -316 -396 264 N ATOM 998 CZ ARG A 56 21.993 -10.546 -11.273 1.00 12.96 C ANISOU 998 CZ ARG A 56 1777 1430 1717 -339 -442 281 C ATOM 999 NH1 ARG A 56 21.691 -10.784 -10.006 1.00 14.88 N ANISOU 999 NH1 ARG A 56 1943 1694 2015 -323 -408 284 N ATOM 1000 NH2 ARG A 56 21.213 -11.029 -12.230 1.00 17.07 N ANISOU 1000 NH2 ARG A 56 2343 1918 2225 -380 -525 301 N ATOM 0 H ARG A 56 25.010 -5.789 -9.372 1.00 9.97 H new ATOM 0 HA ARG A 56 24.979 -5.455 -11.957 1.00 11.95 H new ATOM 0 HB2 ARG A 56 23.140 -6.879 -10.343 1.00 11.92 H new ATOM 0 HB3 ARG A 56 23.106 -6.951 -11.900 1.00 11.92 H new ATOM 0 HG2 ARG A 56 25.039 -8.153 -11.992 1.00 9.88 H new ATOM 0 HG3 ARG A 56 25.426 -7.784 -10.527 1.00 9.88 H new ATOM 0 HD2 ARG A 56 24.670 -9.926 -10.393 1.00 14.19 H new ATOM 0 HD3 ARG A 56 23.521 -9.064 -9.785 1.00 14.19 H new ATOM 0 HE ARG A 56 23.214 -9.661 -12.418 1.00 11.75 H new ATOM 0 HH11 ARG A 56 22.187 -10.467 -9.379 1.00 14.88 H new ATOM 0 HH12 ARG A 56 20.999 -11.256 -9.810 1.00 14.88 H new ATOM 0 HH21 ARG A 56 21.397 -10.871 -13.055 1.00 17.07 H new ATOM 0 HH22 ARG A 56 20.523 -11.500 -12.026 1.00 17.07 H new ATOM 1014 N ALA A 57 22.603 -3.964 -10.419 1.00 12.56 N ANISOU 1014 N ALA A 57 1594 1398 1781 -227 -393 320 N ATOM 1015 CA ALA A 57 21.599 -2.919 -10.585 1.00 18.53 C ANISOU 1015 CA ALA A 57 2320 2135 2584 -213 -444 348 C ATOM 1016 C ALA A 57 22.231 -1.629 -11.087 1.00 15.22 C ANISOU 1016 C ALA A 57 1941 1693 2148 -214 -456 356 C ATOM 1017 O ALA A 57 21.679 -0.961 -11.970 1.00 12.57 O ANISOU 1017 O ALA A 57 1625 1335 1817 -226 -515 386 O ATOM 1018 CB ALA A 57 20.870 -2.671 -9.266 1.00 15.34 C ANISOU 1018 CB ALA A 57 1840 1743 2244 -163 -420 346 C ATOM 0 H ALA A 57 22.692 -4.259 -9.616 1.00 12.56 H new ATOM 0 HA ALA A 57 20.958 -3.220 -11.248 1.00 18.53 H new ATOM 0 HB1 ALA A 57 20.206 -1.975 -9.389 1.00 15.34 H new ATOM 0 HB2 ALA A 57 20.432 -3.488 -8.979 1.00 15.34 H new ATOM 0 HB3 ALA A 57 21.508 -2.392 -8.591 1.00 15.34 H new ATOM 1024 N ALA A 58 23.387 -1.256 -10.527 1.00 12.67 N ANISOU 1024 N ALA A 58 1630 1374 1809 -205 -408 335 N ATOM 1025 CA ALA A 58 24.077 -0.047 -10.968 1.00 9.63 C ANISOU 1025 CA ALA A 58 1281 964 1413 -215 -422 350 C ATOM 1026 C ALA A 58 24.572 -0.189 -12.397 1.00 10.49 C ANISOU 1026 C ALA A 58 1452 1072 1461 -262 -435 374 C ATOM 1027 O ALA A 58 24.439 0.738 -13.203 1.00 11.22 O ANISOU 1027 O ALA A 58 1577 1138 1547 -278 -478 404 O ATOM 1028 CB ALA A 58 25.250 0.259 -10.038 1.00 12.45 C ANISOU 1028 CB ALA A 58 1634 1326 1772 -205 -375 328 C ATOM 0 H ALA A 58 23.782 -1.687 -9.896 1.00 12.67 H new ATOM 0 HA ALA A 58 23.444 0.688 -10.937 1.00 9.63 H new ATOM 0 HB1 ALA A 58 25.701 1.063 -10.340 1.00 12.45 H new ATOM 0 HB2 ALA A 58 24.921 0.392 -9.135 1.00 12.45 H new ATOM 0 HB3 ALA A 58 25.874 -0.484 -10.048 1.00 12.45 H new ATOM 1034 N TRP A 59 25.160 -1.340 -12.725 1.00 11.75 N ANISOU 1034 N TRP A 59 1635 1257 1572 -279 -395 360 N ATOM 1035 CA TRP A 59 25.631 -1.563 -14.086 1.00 10.86 C ANISOU 1035 CA TRP A 59 1593 1144 1388 -311 -397 380 C ATOM 1036 C TRP A 59 24.492 -1.424 -15.088 1.00 13.44 C ANISOU 1036 C TRP A 59 1957 1445 1705 -329 -475 405 C ATOM 1037 O TRP A 59 24.673 -0.853 -16.170 1.00 12.83 O ANISOU 1037 O TRP A 59 1939 1351 1583 -352 -500 435 O ATOM 1038 CB TRP A 59 26.281 -2.943 -14.183 1.00 9.90 C ANISOU 1038 CB TRP A 59 1496 1050 1216 -311 -343 356 C ATOM 1039 CG TRP A 59 26.880 -3.237 -15.510 1.00 10.35 C ANISOU 1039 CG TRP A 59 1636 1109 1188 -331 -327 372 C ATOM 1040 CD1 TRP A 59 28.181 -3.064 -15.882 1.00 11.52 C ANISOU 1040 CD1 TRP A 59 1805 1279 1294 -333 -262 385 C ATOM 1041 CD2 TRP A 59 26.203 -3.768 -16.651 1.00 10.83 C ANISOU 1041 CD2 TRP A 59 1774 1150 1192 -348 -377 379 C ATOM 1042 NE1 TRP A 59 28.356 -3.451 -17.190 1.00 12.31 N ANISOU 1042 NE1 TRP A 59 1994 1377 1307 -343 -255 400 N ATOM 1043 CE2 TRP A 59 27.156 -3.886 -17.685 1.00 17.72 C ANISOU 1043 CE2 TRP A 59 2724 2033 1977 -353 -331 392 C ATOM 1044 CE3 TRP A 59 24.883 -4.153 -16.901 1.00 13.19 C ANISOU 1044 CE3 TRP A 59 2083 1422 1506 -360 -459 379 C ATOM 1045 CZ2 TRP A 59 26.832 -4.375 -18.945 1.00 13.47 C ANISOU 1045 CZ2 TRP A 59 2290 1474 1355 -365 -364 398 C ATOM 1046 CZ3 TRP A 59 24.562 -4.637 -18.156 1.00 13.98 C ANISOU 1046 CZ3 TRP A 59 2281 1499 1531 -381 -506 388 C ATOM 1047 CH2 TRP A 59 25.535 -4.745 -19.162 1.00 14.85 C ANISOU 1047 CH2 TRP A 59 2485 1615 1544 -381 -458 394 C ATOM 0 H TRP A 59 25.293 -1.993 -12.182 1.00 11.75 H new ATOM 0 HA TRP A 59 26.293 -0.888 -14.304 1.00 10.86 H new ATOM 0 HB2 TRP A 59 26.970 -3.014 -13.504 1.00 9.90 H new ATOM 0 HB3 TRP A 59 25.615 -3.619 -13.982 1.00 9.90 H new ATOM 0 HD1 TRP A 59 28.853 -2.732 -15.331 1.00 11.52 H new ATOM 0 HE1 TRP A 59 29.097 -3.424 -17.625 1.00 12.31 H new ATOM 0 HE3 TRP A 59 24.235 -4.085 -16.238 1.00 13.19 H new ATOM 0 HZ2 TRP A 59 27.473 -4.448 -19.615 1.00 13.47 H new ATOM 0 HZ3 TRP A 59 23.687 -4.895 -18.336 1.00 13.98 H new ATOM 0 HH2 TRP A 59 25.291 -5.076 -19.996 1.00 14.85 H new ATOM 1058 N ARG A 60 23.303 -1.930 -14.747 1.00 12.26 N ANISOU 1058 N ARG A 60 1770 1291 1598 -320 -518 400 N ATOM 1059 CA ARG A 60 22.181 -1.834 -15.675 1.00 14.28 C ANISOU 1059 CA ARG A 60 2052 1520 1855 -339 -606 429 C ATOM 1060 C ARG A 60 21.741 -0.389 -15.864 1.00 13.97 C ANISOU 1060 C ARG A 60 2000 1453 1854 -331 -654 461 C ATOM 1061 O ARG A 60 21.411 0.020 -16.981 1.00 13.00 O ANISOU 1061 O ARG A 60 1934 1304 1701 -356 -716 492 O ATOM 1062 CB ARG A 60 21.014 -2.694 -15.194 1.00 16.80 C ANISOU 1062 CB ARG A 60 2314 1842 2226 -336 -643 427 C ATOM 1063 CG ARG A 60 21.259 -4.198 -15.360 1.00 17.84 C ANISOU 1063 CG ARG A 60 2485 1983 2309 -356 -627 404 C ATOM 1064 CD ARG A 60 19.986 -4.998 -15.142 1.00 33.01 C ANISOU 1064 CD ARG A 60 4359 3898 4284 -371 -687 418 C ATOM 1065 NE ARG A 60 19.542 -4.961 -13.752 1.00 45.18 N ANISOU 1065 NE ARG A 60 5793 5465 5907 -337 -649 415 N ATOM 1066 CZ ARG A 60 19.753 -5.929 -12.861 1.00 61.48 C ANISOU 1066 CZ ARG A 60 7828 7551 7980 -330 -598 392 C ATOM 1067 NH1 ARG A 60 20.406 -7.035 -13.199 1.00 60.26 N ANISOU 1067 NH1 ARG A 60 7741 7393 7763 -352 -582 367 N ATOM 1068 NH2 ARG A 60 19.302 -5.789 -11.620 1.00 62.01 N ANISOU 1068 NH2 ARG A 60 7804 7642 8116 -296 -561 395 N ATOM 0 H ARG A 60 23.131 -2.323 -14.002 1.00 12.26 H new ATOM 0 HA ARG A 60 22.477 -2.168 -16.536 1.00 14.28 H new ATOM 0 HB2 ARG A 60 20.843 -2.502 -14.259 1.00 16.80 H new ATOM 0 HB3 ARG A 60 20.215 -2.447 -15.685 1.00 16.80 H new ATOM 0 HG2 ARG A 60 21.605 -4.374 -16.249 1.00 17.84 H new ATOM 0 HG3 ARG A 60 21.937 -4.488 -14.729 1.00 17.84 H new ATOM 0 HD2 ARG A 60 19.284 -4.648 -15.713 1.00 33.01 H new ATOM 0 HD3 ARG A 60 20.135 -5.919 -15.408 1.00 33.01 H new ATOM 0 HE ARG A 60 19.113 -4.264 -13.489 1.00 45.18 H new ATOM 0 HH11 ARG A 60 20.699 -7.133 -14.002 1.00 60.26 H new ATOM 0 HH12 ARG A 60 20.536 -7.653 -12.615 1.00 60.26 H new ATOM 0 HH21 ARG A 60 18.876 -5.076 -11.395 1.00 62.01 H new ATOM 0 HH22 ARG A 60 19.436 -6.411 -11.041 1.00 62.01 H new ATOM 1082 N VAL A 61 21.727 0.400 -14.787 1.00 12.66 N ANISOU 1082 N VAL A 61 1772 1288 1751 -294 -631 453 N ATOM 1083 CA VAL A 61 21.423 1.823 -14.910 1.00 12.58 C ANISOU 1083 CA VAL A 61 1761 1243 1774 -279 -675 478 C ATOM 1084 C VAL A 61 22.406 2.487 -15.867 1.00 15.51 C ANISOU 1084 C VAL A 61 2210 1598 2084 -315 -674 501 C ATOM 1085 O VAL A 61 22.013 3.181 -16.810 1.00 13.68 O ANISOU 1085 O VAL A 61 2022 1335 1839 -332 -737 537 O ATOM 1086 CB VAL A 61 21.441 2.500 -13.524 1.00 12.22 C ANISOU 1086 CB VAL A 61 1657 1196 1791 -227 -641 457 C ATOM 1087 CG1 VAL A 61 21.458 4.006 -13.666 1.00 16.51 C ANISOU 1087 CG1 VAL A 61 2223 1694 2355 -213 -682 478 C ATOM 1088 CG2 VAL A 61 20.249 2.062 -12.687 1.00 18.25 C ANISOU 1088 CG2 VAL A 61 2341 1975 2619 -183 -645 450 C ATOM 0 H VAL A 61 21.889 0.133 -13.986 1.00 12.66 H new ATOM 0 HA VAL A 61 20.531 1.926 -15.276 1.00 12.58 H new ATOM 0 HB VAL A 61 22.251 2.223 -13.068 1.00 12.22 H new ATOM 0 HG11 VAL A 61 21.469 4.414 -12.786 1.00 16.51 H new ATOM 0 HG12 VAL A 61 22.250 4.276 -14.157 1.00 16.51 H new ATOM 0 HG13 VAL A 61 20.666 4.295 -14.146 1.00 16.51 H new ATOM 0 HG21 VAL A 61 20.282 2.500 -11.822 1.00 18.25 H new ATOM 0 HG22 VAL A 61 19.427 2.306 -13.141 1.00 18.25 H new ATOM 0 HG23 VAL A 61 20.276 1.100 -12.563 1.00 18.25 H new ATOM 1098 N LEU A 62 23.703 2.262 -15.645 1.00 12.77 N ANISOU 1098 N LEU A 62 1879 1273 1699 -328 -602 486 N ATOM 1099 CA LEU A 62 24.736 2.933 -16.423 1.00 13.19 C ANISOU 1099 CA LEU A 62 1990 1318 1703 -362 -586 516 C ATOM 1100 C LEU A 62 24.758 2.450 -17.867 1.00 12.66 C ANISOU 1100 C LEU A 62 2003 1254 1553 -397 -601 541 C ATOM 1101 O LEU A 62 24.971 3.249 -18.788 1.00 12.69 O ANISOU 1101 O LEU A 62 2064 1235 1521 -423 -627 583 O ATOM 1102 CB LEU A 62 26.100 2.706 -15.771 1.00 11.87 C ANISOU 1102 CB LEU A 62 1802 1181 1527 -366 -504 500 C ATOM 1103 CG LEU A 62 26.236 3.272 -14.359 1.00 12.73 C ANISOU 1103 CG LEU A 62 1851 1279 1705 -336 -496 476 C ATOM 1104 CD1 LEU A 62 27.569 2.875 -13.740 1.00 14.61 C ANISOU 1104 CD1 LEU A 62 2068 1548 1937 -344 -425 463 C ATOM 1105 CD2 LEU A 62 26.073 4.782 -14.394 1.00 13.01 C ANISOU 1105 CD2 LEU A 62 1903 1263 1775 -338 -552 505 C ATOM 0 H LEU A 62 24.002 1.722 -15.046 1.00 12.77 H new ATOM 0 HA LEU A 62 24.534 3.882 -16.436 1.00 13.19 H new ATOM 0 HB2 LEU A 62 26.276 1.753 -15.742 1.00 11.87 H new ATOM 0 HB3 LEU A 62 26.783 3.104 -16.333 1.00 11.87 H new ATOM 0 HG LEU A 62 25.536 2.898 -13.801 1.00 12.73 H new ATOM 0 HD11 LEU A 62 27.633 3.245 -12.845 1.00 14.61 H new ATOM 0 HD12 LEU A 62 27.630 1.908 -13.695 1.00 14.61 H new ATOM 0 HD13 LEU A 62 28.294 3.219 -14.285 1.00 14.61 H new ATOM 0 HD21 LEU A 62 26.160 5.138 -13.496 1.00 13.01 H new ATOM 0 HD22 LEU A 62 26.758 5.168 -14.962 1.00 13.01 H new ATOM 0 HD23 LEU A 62 25.197 5.005 -14.746 1.00 13.01 H new ATOM 1117 N SER A 63 24.559 1.147 -18.082 1.00 16.36 N ANISOU 1117 N SER A 63 2488 1745 1984 -396 -586 517 N ATOM 1118 CA ASER A 63 24.541 0.605 -19.436 0.74 16.96 C ANISOU 1118 CA ASER A 63 2660 1816 1970 -421 -606 533 C ATOM 1119 CA BSER A 63 24.542 0.601 -19.432 0.26 16.72 C ANISOU 1119 CA BSER A 63 2628 1785 1939 -421 -605 533 C ATOM 1120 C SER A 63 23.391 1.187 -20.241 1.00 17.97 C ANISOU 1120 C SER A 63 2824 1902 2103 -436 -712 566 C ATOM 1121 O SER A 63 23.537 1.475 -21.436 1.00 16.94 O ANISOU 1121 O SER A 63 2784 1754 1899 -462 -738 598 O ATOM 1122 CB ASER A 63 24.438 -0.922 -19.384 0.74 16.12 C ANISOU 1122 CB ASER A 63 2567 1727 1828 -414 -585 495 C ATOM 1123 CB BSER A 63 24.441 -0.924 -19.390 0.26 16.96 C ANISOU 1123 CB BSER A 63 2675 1834 1935 -414 -585 495 C ATOM 1124 OG ASER A 63 24.380 -1.472 -20.689 0.74 19.83 O ANISOU 1124 OG ASER A 63 3149 2184 2202 -434 -611 505 O ATOM 1125 OG BSER A 63 25.608 -1.484 -18.816 0.26 13.23 O ANISOU 1125 OG BSER A 63 2181 1399 1446 -398 -486 470 O ATOM 0 H ASER A 63 24.434 0.566 -17.460 0.74 16.36 H new ATOM 0 H BSER A 63 24.433 0.568 -17.459 0.26 16.36 H new ATOM 0 HA ASER A 63 25.369 0.852 -19.877 0.74 16.72 H new ATOM 0 HA BSER A 63 25.374 0.846 -19.867 0.26 16.72 H new ATOM 0 HB2ASER A 63 25.202 -1.285 -18.910 0.74 16.96 H new ATOM 0 HB2BSER A 63 23.662 -1.188 -18.875 0.26 16.96 H new ATOM 0 HB3ASER A 63 23.647 -1.179 -18.885 0.74 16.96 H new ATOM 0 HB3BSER A 63 24.318 -1.270 -20.288 0.26 16.96 H new ATOM 0 HG ASER A 63 24.610 -2.280 -20.663 0.74 13.23 H new ATOM 0 HG BSER A 63 25.513 -2.315 -18.742 0.26 13.23 H new ATOM 1136 N SER A 64 22.234 1.366 -19.602 1.00 16.14 N ANISOU 1136 N SER A 64 2522 1655 1957 -418 -774 562 N ATOM 1137 CA ASER A 64 21.099 1.984 -20.280 0.66 19.88 C ANISOU 1137 CA ASER A 64 3012 2088 2453 -426 -882 598 C ATOM 1138 CA CSER A 64 21.107 1.979 -20.296 0.34 19.97 C ANISOU 1138 CA CSER A 64 3025 2100 2464 -427 -882 598 C ATOM 1139 C SER A 64 21.433 3.410 -20.700 1.00 20.00 C ANISOU 1139 C SER A 64 3058 2074 2465 -433 -900 635 C ATOM 1140 O SER A 64 21.169 3.815 -21.837 1.00 21.19 O ANISOU 1140 O SER A 64 3269 2206 2575 -455 -943 649 O ATOM 1141 CB ASER A 64 19.873 1.958 -19.364 0.66 19.40 C ANISOU 1141 CB ASER A 64 2847 2025 2500 -394 -927 592 C ATOM 1142 CB CSER A 64 19.858 1.932 -19.417 0.34 20.30 C ANISOU 1142 CB CSER A 64 2965 2139 2611 -396 -929 593 C ATOM 1143 OG ASER A 64 18.762 2.605 -19.959 0.66 22.64 O ANISOU 1143 OG ASER A 64 3254 2400 2947 -396 -1026 627 O ATOM 1144 OG CSER A 64 19.485 0.591 -19.144 0.34 24.62 O ANISOU 1144 OG CSER A 64 3487 2707 3160 -401 -924 569 O ATOM 0 H ASER A 64 22.088 1.139 -18.785 0.66 16.14 H new ATOM 0 H CSER A 64 22.085 1.144 -18.785 0.34 16.14 H new ATOM 0 HA ASER A 64 20.899 1.478 -21.083 0.66 19.97 H new ATOM 0 HA CSER A 64 20.932 1.475 -21.106 0.34 19.97 H new ATOM 0 HB2ASER A 64 19.641 1.039 -19.159 0.66 20.30 H new ATOM 0 HB2CSER A 64 20.025 2.402 -18.585 0.34 20.30 H new ATOM 0 HB3ASER A 64 20.088 2.391 -18.523 0.66 20.30 H new ATOM 0 HB3CSER A 64 19.128 2.392 -19.860 0.34 20.30 H new ATOM 0 HG ASER A 64 18.710 3.393 -19.672 0.66 24.62 H new ATOM 0 HG CSER A 64 20.002 0.268 -18.566 0.34 24.62 H new ATOM 1155 N ILE A 65 22.024 4.184 -19.790 1.00 17.31 N ANISOU 1155 N ILE A 65 2667 1737 2172 -413 -851 628 N ATOM 1156 CA ILE A 65 22.416 5.551 -20.115 1.00 17.76 C ANISOU 1156 CA ILE A 65 2752 1765 2232 -423 -865 657 C ATOM 1157 C ILE A 65 23.419 5.552 -21.259 1.00 19.76 C ANISOU 1157 C ILE A 65 3088 2032 2387 -465 -822 677 C ATOM 1158 O ILE A 65 23.335 6.369 -22.186 1.00 19.93 O ANISOU 1158 O ILE A 65 3156 2033 2383 -484 -856 700 O ATOM 1159 CB ILE A 65 22.981 6.247 -18.861 1.00 18.66 C ANISOU 1159 CB ILE A 65 2810 1872 2409 -398 -827 647 C ATOM 1160 CG1 ILE A 65 21.877 6.428 -17.819 1.00 16.19 C ANISOU 1160 CG1 ILE A 65 2418 1545 2187 -341 -861 622 C ATOM 1161 CG2 ILE A 65 23.626 7.585 -19.227 1.00 19.41 C ANISOU 1161 CG2 ILE A 65 2938 1940 2499 -419 -832 672 C ATOM 1162 CD1 ILE A 65 22.392 6.774 -16.436 1.00 18.36 C ANISOU 1162 CD1 ILE A 65 2642 1823 2512 -305 -809 588 C ATOM 0 H ILE A 65 22.205 3.938 -18.986 1.00 17.31 H new ATOM 0 HA ILE A 65 21.637 6.050 -20.408 1.00 17.76 H new ATOM 0 HB ILE A 65 23.672 5.686 -18.476 1.00 18.66 H new ATOM 0 HG12 ILE A 65 21.276 7.129 -18.116 1.00 16.19 H new ATOM 0 HG13 ILE A 65 21.357 5.611 -17.766 1.00 16.19 H new ATOM 0 HG21 ILE A 65 23.975 8.006 -18.426 1.00 19.41 H new ATOM 0 HG22 ILE A 65 24.351 7.434 -19.854 1.00 19.41 H new ATOM 0 HG23 ILE A 65 22.962 8.164 -19.633 1.00 19.41 H new ATOM 0 HD11 ILE A 65 21.643 6.874 -15.827 1.00 18.36 H new ATOM 0 HD12 ILE A 65 22.973 6.064 -16.120 1.00 18.36 H new ATOM 0 HD13 ILE A 65 22.890 7.605 -16.475 1.00 18.36 H new ATOM 1174 N GLU A 66 24.379 4.629 -21.214 1.00 15.84 N ANISOU 1174 N GLU A 66 2611 1573 1835 -476 -744 671 N ATOM 1175 CA GLU A 66 25.375 4.522 -22.273 1.00 16.96 C ANISOU 1175 CA GLU A 66 2827 1737 1880 -504 -684 692 C ATOM 1176 C GLU A 66 24.710 4.234 -23.613 1.00 27.86 C ANISOU 1176 C GLU A 66 4291 3104 3190 -514 -735 693 C ATOM 1177 O GLU A 66 25.013 4.874 -24.627 1.00 24.44 O ANISOU 1177 O GLU A 66 3917 2663 2705 -533 -733 721 O ATOM 1178 CB GLU A 66 26.381 3.424 -21.920 1.00 17.46 C ANISOU 1178 CB GLU A 66 2889 1846 1902 -500 -588 678 C ATOM 1179 CG GLU A 66 27.592 3.358 -22.833 1.00 21.62 C ANISOU 1179 CG GLU A 66 3474 2404 2338 -518 -503 708 C ATOM 1180 CD GLU A 66 28.585 2.297 -22.418 1.00 18.17 C ANISOU 1180 CD GLU A 66 3015 2017 1872 -500 -399 685 C ATOM 1181 OE1 GLU A 66 28.236 1.449 -21.571 1.00 21.97 O ANISOU 1181 OE1 GLU A 66 3445 2508 2393 -472 -398 631 O ATOM 1182 OE2 GLU A 66 29.723 2.312 -22.935 1.00 20.13 O ANISOU 1182 OE2 GLU A 66 3286 2297 2063 -508 -313 721 O ATOM 0 H GLU A 66 24.469 4.057 -20.578 1.00 15.84 H new ATOM 0 HA GLU A 66 25.844 5.367 -22.352 1.00 16.96 H new ATOM 0 HB2 GLU A 66 26.685 3.561 -21.009 1.00 17.46 H new ATOM 0 HB3 GLU A 66 25.927 2.567 -21.942 1.00 17.46 H new ATOM 0 HG2 GLU A 66 27.298 3.182 -23.740 1.00 21.62 H new ATOM 0 HG3 GLU A 66 28.033 4.222 -22.840 1.00 21.62 H new ATOM 1189 N GLN A 67 23.784 3.276 -23.630 1.00 21.22 N ANISOU 1189 N GLN A 67 3457 2255 2348 -505 -785 665 N ATOM 1190 CA GLN A 67 23.148 2.882 -24.881 1.00 25.12 C ANISOU 1190 CA GLN A 67 4038 2731 2777 -518 -841 660 C ATOM 1191 C GLN A 67 22.342 4.029 -25.477 1.00 31.20 C ANISOU 1191 C GLN A 67 4813 3461 3580 -530 -926 683 C ATOM 1192 O GLN A 67 22.338 4.224 -26.697 1.00 34.31 O ANISOU 1192 O GLN A 67 5294 3840 3904 -548 -946 696 O ATOM 1193 CB GLN A 67 22.277 1.646 -24.655 1.00 31.32 C ANISOU 1193 CB GLN A 67 4815 3509 3574 -513 -890 628 C ATOM 1194 CG GLN A 67 23.096 0.368 -24.462 1.00 52.43 C ANISOU 1194 CG GLN A 67 7525 6215 6182 -503 -812 601 C ATOM 1195 CD GLN A 67 22.241 -0.875 -24.291 1.00 82.90 C ANISOU 1195 CD GLN A 67 11386 10061 10052 -504 -868 569 C ATOM 1196 OE1 GLN A 67 22.455 -1.886 -24.962 1.00 90.92 O ANISOU 1196 OE1 GLN A 67 12492 11073 10982 -505 -856 544 O ATOM 1197 NE2 GLN A 67 21.275 -0.812 -23.380 1.00 96.21 N ANISOU 1197 NE2 GLN A 67 12971 11739 11844 -500 -927 572 N ATOM 0 H GLN A 67 23.514 2.847 -22.935 1.00 21.22 H new ATOM 0 HA GLN A 67 23.840 2.658 -25.523 1.00 25.12 H new ATOM 0 HB2 GLN A 67 21.719 1.788 -23.875 1.00 31.32 H new ATOM 0 HB3 GLN A 67 21.682 1.532 -25.413 1.00 31.32 H new ATOM 0 HG2 GLN A 67 23.681 0.248 -25.227 1.00 52.43 H new ATOM 0 HG3 GLN A 67 23.665 0.471 -23.683 1.00 52.43 H new ATOM 0 HE21 GLN A 67 21.155 -0.089 -22.930 1.00 96.21 H new ATOM 0 HE22 GLN A 67 20.770 -1.494 -23.241 1.00 96.21 H new ATOM 1206 N ALYS A 68 21.668 4.814 -24.641 0.47 30.64 N ANISOU 1206 N ALYS A 68 4655 3372 3614 -515 -973 688 N ATOM 1207 N BLYS A 68 21.645 4.797 -24.629 0.53 30.09 N ANISOU 1207 N BLYS A 68 4585 3303 3547 -514 -974 688 N ATOM 1208 CA ALYS A 68 20.940 5.955 -25.184 0.47 31.55 C ANISOU 1208 CA ALYS A 68 4775 3448 3763 -520 -1050 710 C ATOM 1209 CA BLYS A 68 20.931 5.973 -25.119 0.53 30.49 C ANISOU 1209 CA BLYS A 68 4637 3315 3634 -519 -1049 710 C ATOM 1210 C ALYS A 68 21.885 7.028 -25.703 0.47 38.53 C ANISOU 1210 C ALYS A 68 5704 4329 4607 -538 -1011 741 C ATOM 1211 C BLYS A 68 21.897 6.986 -25.718 0.53 38.77 C ANISOU 1211 C BLYS A 68 5736 4360 4634 -538 -1010 740 C ATOM 1212 O ALYS A 68 21.560 7.720 -26.675 0.47 33.88 O ANISOU 1212 O ALYS A 68 5169 3711 3992 -555 -1061 762 O ATOM 1213 O BLYS A 68 21.609 7.591 -26.758 0.53 34.69 O ANISOU 1213 O BLYS A 68 5280 3817 4084 -557 -1057 761 O ATOM 1214 CB ALYS A 68 20.011 6.532 -24.126 0.47 35.31 C ANISOU 1214 CB ALYS A 68 5149 3906 4361 -487 -1098 706 C ATOM 1215 CB BLYS A 68 20.126 6.634 -23.996 0.53 33.56 C ANISOU 1215 CB BLYS A 68 4921 3686 4143 -484 -1090 706 C ATOM 1216 CG ALYS A 68 18.895 5.587 -23.765 0.47 39.29 C ANISOU 1216 CG ALYS A 68 5599 4412 4915 -473 -1146 689 C ATOM 1217 CG BLYS A 68 19.186 5.727 -23.200 0.53 41.33 C ANISOU 1217 CG BLYS A 68 5830 4681 5195 -460 -1116 685 C ATOM 1218 CD ALYS A 68 18.186 6.035 -22.515 0.47 46.54 C ANISOU 1218 CD ALYS A 68 6406 5328 5950 -426 -1158 685 C ATOM 1219 CD BLYS A 68 18.444 4.698 -24.044 0.53 44.86 C ANISOU 1219 CD BLYS A 68 6317 5121 5606 -485 -1172 679 C ATOM 1220 CE ALYS A 68 17.068 5.082 -22.165 0.47 45.36 C ANISOU 1220 CE ALYS A 68 6189 5187 5858 -416 -1198 678 C ATOM 1221 CE BLYS A 68 17.790 3.642 -23.159 0.53 44.67 C ANISOU 1221 CE BLYS A 68 6215 5116 5643 -470 -1178 663 C ATOM 1222 NZ ALYS A 68 16.380 5.509 -20.927 0.47 44.42 N ANISOU 1222 NZ ALYS A 68 5957 5073 5849 -359 -1193 678 N ATOM 1223 NZ BLYS A 68 18.666 2.452 -22.980 0.53 23.63 N ANISOU 1223 NZ BLYS A 68 3587 2482 2909 -480 -1113 640 N ATOM 0 H ALYS A 68 21.619 4.710 -23.789 0.47 30.09 H new ATOM 0 H BLYS A 68 21.576 4.655 -23.784 0.53 30.09 H new ATOM 0 HA ALYS A 68 20.412 5.642 -25.936 0.47 30.49 H new ATOM 0 HA BLYS A 68 20.319 5.675 -25.810 0.53 30.49 H new ATOM 0 HB2ALYS A 68 20.523 6.743 -23.330 0.47 33.56 H new ATOM 0 HB2BLYS A 68 20.750 7.042 -23.376 0.53 33.56 H new ATOM 0 HB3ALYS A 68 19.634 7.365 -24.450 0.47 33.56 H new ATOM 0 HB3BLYS A 68 19.600 7.351 -24.382 0.53 33.56 H new ATOM 0 HG2ALYS A 68 18.262 5.535 -24.498 0.47 41.33 H new ATOM 0 HG2BLYS A 68 19.700 5.263 -22.521 0.53 41.33 H new ATOM 0 HG3ALYS A 68 19.253 4.695 -23.635 0.47 41.33 H new ATOM 0 HG3BLYS A 68 18.537 6.279 -22.737 0.53 41.33 H new ATOM 0 HD2ALYS A 68 18.817 6.085 -21.780 0.47 44.86 H new ATOM 0 HD2BLYS A 68 17.768 5.140 -24.580 0.53 44.86 H new ATOM 0 HD3ALYS A 68 17.828 6.928 -22.643 0.47 44.86 H new ATOM 0 HD3BLYS A 68 19.061 4.273 -24.660 0.53 44.86 H new ATOM 0 HE2ALYS A 68 16.432 5.041 -22.896 0.47 44.67 H new ATOM 0 HE2BLYS A 68 17.586 4.027 -22.292 0.53 44.67 H new ATOM 0 HE3ALYS A 68 17.425 4.187 -22.049 0.47 44.67 H new ATOM 0 HE3BLYS A 68 16.947 3.367 -23.552 0.53 44.67 H new ATOM 0 HZ1ALYS A 68 15.726 4.936 -20.738 0.47 23.63 H new ATOM 0 HZ1BLYS A 68 18.282 1.883 -22.414 0.53 23.63 H new ATOM 0 HZ2ALYS A 68 16.962 5.526 -20.254 0.47 23.63 H new ATOM 0 HZ2BLYS A 68 18.788 2.052 -23.766 0.53 23.63 H new ATOM 0 HZ3ALYS A 68 16.037 6.322 -21.043 0.47 23.63 H new ATOM 0 HZ3BLYS A 68 19.453 2.709 -22.653 0.53 23.63 H new ATOM 1249 N SER A 69 23.050 7.187 -25.074 1.00 31.36 N ANISOU 1249 N SER A 69 4772 3448 3696 -538 -925 747 N ATOM 1250 CA SER A 69 24.024 8.154 -25.564 1.00 32.47 C ANISOU 1250 CA SER A 69 4945 3588 3803 -562 -884 785 C ATOM 1251 C SER A 69 24.562 7.774 -26.935 1.00 43.56 C ANISOU 1251 C SER A 69 6449 5010 5092 -584 -845 806 C ATOM 1252 O SER A 69 25.150 8.622 -27.615 1.00 47.52 O ANISOU 1252 O SER A 69 6988 5508 5561 -606 -825 845 O ATOM 1253 CB SER A 69 25.184 8.284 -24.575 1.00 44.35 C ANISOU 1253 CB SER A 69 6394 5120 5338 -562 -801 790 C ATOM 1254 OG SER A 69 26.060 7.174 -24.678 1.00 53.97 O ANISOU 1254 OG SER A 69 7630 6386 6491 -564 -711 786 O ATOM 0 H ASER A 69 23.291 6.751 -24.373 0.47 31.36 H new ATOM 0 H BSER A 69 23.283 6.774 -24.356 0.53 31.36 H new ATOM 0 HA SER A 69 23.568 9.006 -25.648 1.00 32.47 H new ATOM 0 HB2 SER A 69 25.672 9.104 -24.749 1.00 44.35 H new ATOM 0 HB3 SER A 69 24.838 8.346 -23.671 1.00 44.35 H new ATOM 0 HG SER A 69 25.668 6.482 -24.409 1.00 53.97 H new ATOM 1260 N ASN A 70 24.375 6.521 -27.354 1.00 50.54 N ANISOU 1260 N ASN A 70 7380 5911 5913 -576 -834 780 N ATOM 1261 CA ASN A 70 24.853 6.040 -28.642 1.00 58.25 C ANISOU 1261 CA ASN A 70 8461 6900 6769 -584 -793 791 C ATOM 1262 C ASN A 70 23.729 5.900 -29.666 1.00 54.38 C ANISOU 1262 C ASN A 70 8048 6369 6246 -592 -892 780 C ATOM 1263 O ASN A 70 23.898 5.202 -30.672 1.00 65.76 O ANISOU 1263 O ASN A 70 9587 7813 7585 -591 -873 774 O ATOM 1264 CB ASN A 70 25.583 4.707 -28.458 1.00 55.61 C ANISOU 1264 CB ASN A 70 8144 6609 6375 -564 -702 767 C ATOM 1265 CG ASN A 70 26.811 4.834 -27.568 1.00 59.64 C ANISOU 1265 CG ASN A 70 8583 7162 6915 -560 -598 784 C ATOM 1266 OD1 ASN A 70 27.416 5.902 -27.476 1.00 65.07 O ANISOU 1266 OD1 ASN A 70 9238 7852 7634 -578 -574 826 O ATOM 1267 ND2 ASN A 70 27.182 3.743 -26.907 1.00 58.29 N ANISOU 1267 ND2 ASN A 70 8389 7022 6738 -540 -543 755 N ATOM 0 H ASN A 70 23.963 5.925 -26.891 1.00 50.54 H new ATOM 0 HA ASN A 70 25.469 6.702 -28.993 1.00 58.25 H new ATOM 0 HB2 ASN A 70 24.973 4.058 -28.073 1.00 55.61 H new ATOM 0 HB3 ASN A 70 25.850 4.365 -29.326 1.00 55.61 H new ATOM 0 HD21 ASN A 70 27.869 3.766 -26.390 1.00 58.29 H new ATOM 0 HD22 ASN A 70 26.735 3.014 -26.996 1.00 58.29 H new ATOM 1274 N GLU A 71 22.593 6.551 -29.435 1.00 51.85 N ANISOU 1274 N GLU A 71 7348 6645 5707 497 -2069 1224 N ATOM 1275 CA GLU A 71 21.503 6.567 -30.396 1.00 46.20 C ANISOU 1275 CA GLU A 71 6562 6023 4969 530 -2328 1387 C ATOM 1276 C GLU A 71 21.674 7.725 -31.380 1.00 62.05 C ANISOU 1276 C GLU A 71 8724 7999 6852 633 -2318 1519 C ATOM 1277 O GLU A 71 22.564 8.567 -31.242 1.00 52.97 O ANISOU 1277 O GLU A 71 7716 6747 5664 682 -2112 1501 O ATOM 1278 CB GLU A 71 20.157 6.684 -29.680 1.00 59.45 C ANISOU 1278 CB GLU A 71 7953 7748 6889 604 -2387 1523 C ATOM 1279 CG GLU A 71 19.728 5.435 -28.927 1.00 72.83 C ANISOU 1279 CG GLU A 71 9457 9510 8704 490 -2471 1449 C ATOM 1280 CD GLU A 71 18.401 5.619 -28.211 1.00 89.11 C ANISOU 1280 CD GLU A 71 11220 11641 10997 573 -2519 1606 C ATOM 1281 OE1 GLU A 71 17.965 6.778 -28.048 1.00 92.39 O ANISOU 1281 OE1 GLU A 71 11579 12032 11494 735 -2430 1735 O ATOM 1282 OE2 GLU A 71 17.793 4.603 -27.815 1.00 97.15 O ANISOU 1282 OE2 GLU A 71 12054 12741 12117 479 -2651 1604 O ATOM 0 H GLU A 71 22.435 6.995 -28.716 1.00 51.85 H new ATOM 0 HA GLU A 71 21.522 5.732 -30.889 1.00 46.20 H new ATOM 0 HB2 GLU A 71 20.200 7.425 -29.055 1.00 59.45 H new ATOM 0 HB3 GLU A 71 19.475 6.903 -30.334 1.00 59.45 H new ATOM 0 HG2 GLU A 71 19.657 4.694 -29.549 1.00 72.83 H new ATOM 0 HG3 GLU A 71 20.412 5.199 -28.281 1.00 72.83 H new ATOM 1289 N GLU A 72 20.796 7.760 -32.384 1.00 77.10 N ANISOU 1289 N GLU A 72 10595 9996 8702 664 -2552 1663 N ATOM 1290 CA GLU A 72 20.814 8.840 -33.364 1.00 84.68 C ANISOU 1290 CA GLU A 72 11677 10946 9553 766 -2570 1819 C ATOM 1291 C GLU A 72 20.268 10.121 -32.745 1.00 84.00 C ANISOU 1291 C GLU A 72 11479 10768 9670 925 -2440 1972 C ATOM 1292 O GLU A 72 19.199 10.119 -32.126 1.00 78.15 O ANISOU 1292 O GLU A 72 10514 10058 9123 983 -2492 2047 O ATOM 1293 CB GLU A 72 19.989 8.464 -34.597 1.00 93.25 C ANISOU 1293 CB GLU A 72 12715 12177 10538 755 -2794 1885 C ATOM 1294 CG GLU A 72 20.009 9.525 -35.704 1.00102.78 C ANISOU 1294 CG GLU A 72 14026 13403 11625 855 -2785 2034 C ATOM 1295 CD GLU A 72 18.949 9.300 -36.770 1.00111.33 C ANISOU 1295 CD GLU A 72 15005 14633 12664 880 -2961 2102 C ATOM 1296 OE1 GLU A 72 18.249 8.267 -36.711 1.00113.11 O ANISOU 1296 OE1 GLU A 72 15092 14939 12944 810 -3091 2019 O ATOM 1297 OE2 GLU A 72 18.814 10.162 -37.667 1.00112.11 O ANISOU 1297 OE2 GLU A 72 15158 14761 12677 971 -2967 2240 O ATOM 0 H GLU A 72 20.185 7.169 -32.513 1.00 77.10 H new ATOM 0 HA GLU A 72 21.732 8.987 -33.639 1.00 84.68 H new ATOM 0 HB2 GLU A 72 20.324 7.628 -34.957 1.00 93.25 H new ATOM 0 HB3 GLU A 72 19.071 8.309 -34.326 1.00 93.25 H new ATOM 0 HG2 GLU A 72 19.879 10.400 -35.307 1.00102.78 H new ATOM 0 HG3 GLU A 72 20.884 9.530 -36.123 1.00102.78 H new ATOM 1304 N GLY A 73 20.998 11.221 -32.926 1.00 84.42 N ANISOU 1304 N GLY A 73 11684 10714 9680 999 -2280 2024 N ATOM 1305 CA GLY A 73 20.593 12.509 -32.409 1.00 83.88 C ANISOU 1305 CA GLY A 73 11537 10535 9797 1159 -2165 2158 C ATOM 1306 C GLY A 73 21.094 12.817 -31.017 1.00 79.07 C ANISOU 1306 C GLY A 73 10880 9801 9360 1195 -1917 2039 C ATOM 1307 O GLY A 73 20.894 13.941 -30.537 1.00 73.22 O ANISOU 1307 O GLY A 73 10093 8951 8776 1339 -1810 2124 O ATOM 0 H GLY A 73 21.743 11.233 -33.355 1.00 84.42 H new ATOM 0 HA2 GLY A 73 20.908 13.200 -33.013 1.00 83.88 H new ATOM 0 HA3 GLY A 73 19.624 12.553 -32.408 1.00 83.88 H new ATOM 1311 N SER A 74 21.741 11.860 -30.357 1.00 80.10 N ANISOU 1311 N SER A 74 11020 9945 9469 1076 -1830 1841 N ATOM 1312 CA SER A 74 22.221 12.069 -29.000 1.00 75.65 C ANISOU 1312 CA SER A 74 10401 9282 9060 1109 -1596 1716 C ATOM 1313 C SER A 74 23.437 12.984 -29.001 1.00 68.77 C ANISOU 1313 C SER A 74 9735 8254 8139 1136 -1394 1678 C ATOM 1314 O SER A 74 24.343 12.841 -29.826 1.00 67.87 O ANISOU 1314 O SER A 74 9828 8139 7820 1045 -1394 1647 O ATOM 1315 CB SER A 74 22.579 10.732 -28.354 1.00 70.55 C ANISOU 1315 CB SER A 74 9709 8702 8395 965 -1571 1524 C ATOM 1316 OG SER A 74 21.495 9.822 -28.429 1.00 71.67 O ANISOU 1316 OG SER A 74 9666 8982 8582 918 -1779 1569 O ATOM 0 H SER A 74 21.911 11.082 -30.680 1.00 80.10 H new ATOM 0 HA SER A 74 21.514 12.489 -28.486 1.00 75.65 H new ATOM 0 HB2 SER A 74 23.354 10.353 -28.797 1.00 70.55 H new ATOM 0 HB3 SER A 74 22.823 10.873 -27.426 1.00 70.55 H new ATOM 0 HG SER A 74 21.606 9.206 -27.868 1.00 71.67 H new ATOM 1322 N GLU A 75 23.452 13.931 -28.071 1.00 66.70 N ANISOU 1322 N GLU A 75 9409 7867 8065 1267 -1228 1682 N ATOM 1323 CA GLU A 75 24.610 14.797 -27.921 1.00 67.61 C ANISOU 1323 CA GLU A 75 9702 7816 8170 1290 -1034 1637 C ATOM 1324 C GLU A 75 25.766 14.012 -27.312 1.00 66.44 C ANISOU 1324 C GLU A 75 9643 7655 7945 1159 -872 1412 C ATOM 1325 O GLU A 75 25.583 13.232 -26.373 1.00 55.15 O ANISOU 1325 O GLU A 75 8076 6283 6596 1127 -826 1282 O ATOM 1326 CB GLU A 75 24.263 16.001 -27.044 1.00 63.00 C ANISOU 1326 CB GLU A 75 9015 7095 7827 1477 -920 1684 C ATOM 1327 CG GLU A 75 25.180 17.202 -27.226 1.00 44.40 C ANISOU 1327 CG GLU A 75 6839 4546 5484 1530 -793 1722 C ATOM 1328 CD GLU A 75 25.296 17.631 -28.676 1.00 44.15 C ANISOU 1328 CD GLU A 75 6965 4517 5293 1499 -921 1906 C ATOM 1329 OE1 GLU A 75 26.436 17.696 -29.183 1.00 60.89 O ANISOU 1329 OE1 GLU A 75 9285 6590 7262 1402 -846 1881 O ATOM 1330 OE2 GLU A 75 24.250 17.877 -29.315 1.00 53.06 O ANISOU 1330 OE2 GLU A 75 8010 5711 6438 1571 -1098 2080 O ATOM 0 H GLU A 75 22.808 14.087 -27.522 1.00 66.70 H new ATOM 0 HA GLU A 75 24.876 15.122 -28.795 1.00 67.61 H new ATOM 0 HB2 GLU A 75 23.352 16.273 -27.234 1.00 63.00 H new ATOM 0 HB3 GLU A 75 24.289 15.727 -26.114 1.00 63.00 H new ATOM 0 HG2 GLU A 75 24.845 17.944 -26.698 1.00 44.40 H new ATOM 0 HG3 GLU A 75 26.062 16.986 -26.884 1.00 44.40 H new ATOM 1337 N GLU A 76 26.960 14.206 -27.866 1.00 72.87 N ANISOU 1337 N GLU A 76 10682 8405 8599 1083 -789 1375 N ATOM 1338 CA GLU A 76 28.146 13.562 -27.320 1.00 67.79 C ANISOU 1338 CA GLU A 76 10141 7742 7876 966 -624 1164 C ATOM 1339 C GLU A 76 28.529 14.224 -26.004 1.00 64.61 C ANISOU 1339 C GLU A 76 9684 7193 7672 1056 -401 1066 C ATOM 1340 O GLU A 76 28.703 15.445 -25.939 1.00 74.86 O ANISOU 1340 O GLU A 76 11027 8343 9072 1166 -324 1150 O ATOM 1341 CB GLU A 76 29.305 13.644 -28.312 1.00 71.30 C ANISOU 1341 CB GLU A 76 10833 8174 8084 871 -599 1167 C ATOM 1342 CG GLU A 76 30.636 13.142 -27.758 1.00 85.62 C ANISOU 1342 CG GLU A 76 12768 9952 9813 763 -410 956 C ATOM 1343 CD GLU A 76 30.571 11.702 -27.277 1.00 96.50 C ANISOU 1343 CD GLU A 76 14069 11448 11150 655 -442 774 C ATOM 1344 OE1 GLU A 76 29.856 10.891 -27.904 1.00101.95 O ANISOU 1344 OE1 GLU A 76 14703 12274 11758 607 -649 809 O ATOM 1345 OE2 GLU A 76 31.234 11.381 -26.268 1.00 98.89 O ANISOU 1345 OE2 GLU A 76 14364 11701 11507 617 -268 599 O ATOM 0 H GLU A 76 27.102 14.703 -28.553 1.00 72.87 H new ATOM 0 HA GLU A 76 27.949 12.626 -27.159 1.00 67.79 H new ATOM 0 HB2 GLU A 76 29.079 13.128 -29.102 1.00 71.30 H new ATOM 0 HB3 GLU A 76 29.411 14.566 -28.596 1.00 71.30 H new ATOM 0 HG2 GLU A 76 31.316 13.218 -28.445 1.00 85.62 H new ATOM 0 HG3 GLU A 76 30.910 13.712 -27.023 1.00 85.62 H new ATOM 1352 N LYS A 77 28.658 13.415 -24.954 1.00 39.83 N ANISOU 1352 N LYS A 77 6445 4096 4594 1012 -306 889 N ATOM 1353 CA LYS A 77 29.020 13.906 -23.630 1.00 55.43 C ANISOU 1353 CA LYS A 77 8353 5961 6746 1098 -94 771 C ATOM 1354 C LYS A 77 30.381 13.396 -23.173 1.00 57.88 C ANISOU 1354 C LYS A 77 8799 6233 6959 979 88 567 C ATOM 1355 O LYS A 77 30.711 13.507 -21.985 1.00 51.29 O ANISOU 1355 O LYS A 77 7895 5341 6252 1028 262 432 O ATOM 1356 CB LYS A 77 27.939 13.527 -22.612 1.00 55.11 C ANISOU 1356 CB LYS A 77 8042 6014 6885 1182 -116 750 C ATOM 1357 CG LYS A 77 26.589 14.207 -22.845 1.00 59.09 C ANISOU 1357 CG LYS A 77 8389 6544 7519 1335 -264 944 C ATOM 1358 CD LYS A 77 26.656 15.720 -22.623 1.00 60.89 C ANISOU 1358 CD LYS A 77 8647 6597 7890 1512 -177 1010 C ATOM 1359 CE LYS A 77 25.653 16.459 -23.498 1.00 71.13 C ANISOU 1359 CE LYS A 77 9909 7894 9224 1616 -359 1237 C ATOM 1360 NZ LYS A 77 25.968 17.917 -23.635 1.00 73.02 N ANISOU 1360 NZ LYS A 77 10252 7933 9560 1747 -301 1318 N ATOM 0 H LYS A 77 28.537 12.564 -24.992 1.00 39.83 H new ATOM 0 HA LYS A 77 29.084 14.872 -23.689 1.00 55.43 H new ATOM 0 HB2 LYS A 77 27.813 12.565 -22.633 1.00 55.11 H new ATOM 0 HB3 LYS A 77 28.254 13.753 -21.723 1.00 55.11 H new ATOM 0 HG2 LYS A 77 26.291 14.028 -23.750 1.00 59.09 H new ATOM 0 HG3 LYS A 77 25.928 13.823 -22.247 1.00 59.09 H new ATOM 0 HD2 LYS A 77 26.481 15.919 -21.690 1.00 60.89 H new ATOM 0 HD3 LYS A 77 27.552 16.037 -22.818 1.00 60.89 H new ATOM 0 HE2 LYS A 77 25.636 16.052 -24.378 1.00 71.13 H new ATOM 0 HE3 LYS A 77 24.765 16.358 -23.121 1.00 71.13 H new ATOM 0 HZ1 LYS A 77 25.357 18.306 -24.153 1.00 73.02 H new ATOM 0 HZ2 LYS A 77 25.961 18.299 -22.831 1.00 73.02 H new ATOM 0 HZ3 LYS A 77 26.773 18.014 -24.002 1.00 73.02 H new ATOM 1374 N GLY A 78 31.181 12.846 -24.085 1.00 43.51 N ANISOU 1374 N GLY A 78 7168 4455 4910 833 51 539 N ATOM 1375 CA GLY A 78 32.523 12.432 -23.766 1.00 27.12 C ANISOU 1375 CA GLY A 78 5237 2343 2723 724 220 357 C ATOM 1376 C GLY A 78 32.596 11.009 -23.256 1.00 24.83 C ANISOU 1376 C GLY A 78 4878 2174 2381 608 216 187 C ATOM 1377 O GLY A 78 31.627 10.246 -23.312 1.00 25.40 O ANISOU 1377 O GLY A 78 4804 2367 2480 589 55 221 O ATOM 0 H GLY A 78 30.952 12.707 -24.902 1.00 43.51 H new ATOM 0 HA2 GLY A 78 33.079 12.516 -24.557 1.00 27.12 H new ATOM 0 HA3 GLY A 78 32.890 13.030 -23.096 1.00 27.12 H new ATOM 1381 N PRO A 79 33.765 10.628 -22.740 1.00 22.73 N ANISOU 1381 N PRO A 79 4716 1875 2046 525 388 5 N ATOM 1382 CA PRO A 79 33.988 9.241 -22.321 1.00 21.05 C ANISOU 1382 CA PRO A 79 4464 1766 1766 401 385 -163 C ATOM 1383 C PRO A 79 33.436 8.884 -20.950 1.00 20.04 C ANISOU 1383 C PRO A 79 4109 1663 1842 450 462 -241 C ATOM 1384 O PRO A 79 33.551 7.721 -20.555 1.00 18.76 O ANISOU 1384 O PRO A 79 3895 1586 1646 346 450 -363 O ATOM 1385 CB PRO A 79 35.519 9.140 -22.317 1.00 19.30 C ANISOU 1385 CB PRO A 79 4351 1531 1452 289 524 -266 C ATOM 1386 CG PRO A 79 35.965 10.509 -21.946 1.00 19.46 C ANISOU 1386 CG PRO A 79 4375 1434 1584 375 668 -200 C ATOM 1387 CD PRO A 79 34.975 11.454 -22.582 1.00 22.57 C ANISOU 1387 CD PRO A 79 4861 1714 2001 534 586 -49 C ATOM 0 HA PRO A 79 33.527 8.625 -22.912 1.00 21.05 H new ATOM 0 HB2 PRO A 79 35.830 8.479 -21.679 1.00 19.30 H new ATOM 0 HB3 PRO A 79 35.861 8.878 -23.186 1.00 19.30 H new ATOM 0 HG2 PRO A 79 35.982 10.620 -20.982 1.00 19.46 H new ATOM 0 HG3 PRO A 79 36.864 10.680 -22.267 1.00 19.46 H new ATOM 0 HD2 PRO A 79 34.809 12.228 -22.021 1.00 22.57 H new ATOM 0 HD3 PRO A 79 35.295 11.786 -23.435 1.00 22.57 H new ATOM 1395 N GLU A 80 32.833 9.830 -20.223 1.00 13.74 N ANISOU 1395 N GLU A 80 2469 1324 1428 -672 -59 391 N ATOM 1396 CA GLU A 80 32.581 9.623 -18.798 1.00 15.95 C ANISOU 1396 CA GLU A 80 2657 1634 1768 -635 -104 353 C ATOM 1397 C GLU A 80 31.609 8.477 -18.546 1.00 13.37 C ANISOU 1397 C GLU A 80 2297 1358 1426 -583 -138 330 C ATOM 1398 O GLU A 80 31.817 7.676 -17.631 1.00 14.69 O ANISOU 1398 O GLU A 80 2382 1568 1630 -566 -131 297 O ATOM 1399 CB GLU A 80 32.058 10.909 -18.159 1.00 12.84 C ANISOU 1399 CB GLU A 80 2287 1193 1399 -616 -167 356 C ATOM 1400 CG GLU A 80 33.110 12.010 -18.011 1.00 14.43 C ANISOU 1400 CG GLU A 80 2502 1344 1638 -672 -145 370 C ATOM 1401 CD GLU A 80 33.295 12.868 -19.264 1.00 18.04 C ANISOU 1401 CD GLU A 80 3054 1745 2053 -712 -120 418 C ATOM 1402 OE1 GLU A 80 32.681 12.573 -20.315 1.00 18.51 O ANISOU 1402 OE1 GLU A 80 3181 1806 2046 -700 -120 441 O ATOM 1403 OE2 GLU A 80 34.061 13.849 -19.192 1.00 17.48 O ANISOU 1403 OE2 GLU A 80 2999 1624 2016 -760 -106 436 O ATOM 0 H GLU A 80 32.567 10.587 -20.532 1.00 13.74 H new ATOM 0 HA GLU A 80 33.426 9.381 -18.388 1.00 15.95 H new ATOM 0 HB2 GLU A 80 31.323 11.248 -18.694 1.00 12.84 H new ATOM 0 HB3 GLU A 80 31.698 10.700 -17.283 1.00 12.84 H new ATOM 0 HG2 GLU A 80 32.861 12.585 -17.271 1.00 14.43 H new ATOM 0 HG3 GLU A 80 33.960 11.603 -17.781 1.00 14.43 H new ATOM 1410 N VAL A 81 30.525 8.396 -19.319 1.00 14.71 N ANISOU 1410 N VAL A 81 2527 1518 1545 -559 -185 350 N ATOM 1411 CA VAL A 81 29.548 7.330 -19.106 1.00 14.35 C ANISOU 1411 CA VAL A 81 2443 1513 1497 -516 -227 335 C ATOM 1412 C VAL A 81 30.205 5.968 -19.289 1.00 15.37 C ANISOU 1412 C VAL A 81 2542 1686 1609 -534 -168 313 C ATOM 1413 O VAL A 81 30.062 5.071 -18.449 1.00 13.26 O ANISOU 1413 O VAL A 81 2198 1464 1377 -507 -170 284 O ATOM 1414 CB VAL A 81 28.344 7.498 -20.052 1.00 23.38 C ANISOU 1414 CB VAL A 81 3660 2629 2596 -500 -301 370 C ATOM 1415 CG1 VAL A 81 27.402 6.305 -19.916 1.00 26.24 C ANISOU 1415 CG1 VAL A 81 3976 3029 2964 -467 -346 359 C ATOM 1416 CG2 VAL A 81 27.605 8.795 -19.756 1.00 27.45 C ANISOU 1416 CG2 VAL A 81 4189 3097 3143 -469 -359 393 C ATOM 0 H VAL A 81 30.340 8.938 -19.960 1.00 14.71 H new ATOM 0 HA VAL A 81 29.219 7.388 -18.195 1.00 14.35 H new ATOM 0 HB VAL A 81 28.671 7.537 -20.965 1.00 23.38 H new ATOM 0 HG11 VAL A 81 26.647 6.419 -20.515 1.00 26.24 H new ATOM 0 HG12 VAL A 81 27.876 5.490 -20.145 1.00 26.24 H new ATOM 0 HG13 VAL A 81 27.083 6.247 -19.002 1.00 26.24 H new ATOM 0 HG21 VAL A 81 26.851 8.883 -20.360 1.00 27.45 H new ATOM 0 HG22 VAL A 81 27.285 8.784 -18.840 1.00 27.45 H new ATOM 0 HG23 VAL A 81 28.207 9.546 -19.878 1.00 27.45 H new ATOM 1426 N ARG A 82 30.925 5.789 -20.398 1.00 14.55 N ANISOU 1426 N ARG A 82 2509 1568 1453 -575 -108 328 N ATOM 1427 CA ARG A 82 31.615 4.526 -20.632 1.00 12.72 C ANISOU 1427 CA ARG A 82 2258 1368 1207 -586 -37 308 C ATOM 1428 C ARG A 82 32.609 4.237 -19.518 1.00 11.50 C ANISOU 1428 C ARG A 82 1989 1247 1133 -588 12 282 C ATOM 1429 O ARG A 82 32.678 3.114 -19.011 1.00 12.77 O ANISOU 1429 O ARG A 82 2089 1448 1316 -568 23 256 O ATOM 1430 CB ARG A 82 32.333 4.545 -21.984 1.00 15.63 C ANISOU 1430 CB ARG A 82 2731 1703 1506 -627 43 331 C ATOM 1431 CG ARG A 82 33.243 3.330 -22.187 1.00 19.47 C ANISOU 1431 CG ARG A 82 3194 2213 1989 -634 143 311 C ATOM 1432 CD ARG A 82 34.047 3.386 -23.471 1.00 22.36 C ANISOU 1432 CD ARG A 82 3667 2538 2289 -670 251 336 C ATOM 1433 NE ARG A 82 34.876 4.583 -23.576 1.00 35.99 N ANISOU 1433 NE ARG A 82 5389 4233 4052 -704 304 366 N ATOM 1434 CZ ARG A 82 35.991 4.798 -22.882 1.00 32.34 C ANISOU 1434 CZ ARG A 82 4817 3780 3689 -724 368 369 C ATOM 1435 NH1 ARG A 82 36.423 3.907 -22.003 1.00 30.85 N ANISOU 1435 NH1 ARG A 82 4511 3638 3574 -704 383 340 N ATOM 1436 NH2 ARG A 82 36.676 5.919 -23.065 1.00 30.64 N ANISOU 1436 NH2 ARG A 82 4593 3534 3513 -748 400 396 N ATOM 0 H ARG A 82 31.024 6.378 -21.017 1.00 14.55 H new ATOM 0 HA ARG A 82 30.950 3.820 -20.642 1.00 12.72 H new ATOM 0 HB2 ARG A 82 31.674 4.573 -22.695 1.00 15.63 H new ATOM 0 HB3 ARG A 82 32.861 5.355 -22.054 1.00 15.63 H new ATOM 0 HG2 ARG A 82 33.852 3.261 -21.435 1.00 19.47 H new ATOM 0 HG3 ARG A 82 32.701 2.525 -22.188 1.00 19.47 H new ATOM 0 HD2 ARG A 82 34.614 2.601 -23.526 1.00 22.36 H new ATOM 0 HD3 ARG A 82 33.441 3.352 -24.228 1.00 22.36 H new ATOM 0 HE ARG A 82 34.625 5.194 -24.127 1.00 35.99 H new ATOM 0 HH11 ARG A 82 35.982 3.180 -21.876 1.00 30.85 H new ATOM 0 HH12 ARG A 82 37.145 4.055 -21.560 1.00 30.85 H new ATOM 0 HH21 ARG A 82 36.399 6.505 -23.631 1.00 30.64 H new ATOM 0 HH22 ARG A 82 37.397 6.060 -22.618 1.00 30.64 H new ATOM 1450 N GLU A 83 33.408 5.239 -19.143 1.00 12.64 N ANISOU 1450 N GLU A 83 2109 1368 1326 -615 34 293 N ATOM 1451 CA GLU A 83 34.416 5.048 -18.105 1.00 14.71 C ANISOU 1451 CA GLU A 83 2267 1652 1670 -625 62 275 C ATOM 1452 C GLU A 83 33.786 4.540 -16.819 1.00 16.79 C ANISOU 1452 C GLU A 83 2464 1952 1965 -581 -3 242 C ATOM 1453 O GLU A 83 34.255 3.565 -16.223 1.00 11.22 O ANISOU 1453 O GLU A 83 1686 1282 1294 -572 17 221 O ATOM 1454 CB GLU A 83 35.161 6.360 -17.849 1.00 14.21 C ANISOU 1454 CB GLU A 83 2199 1547 1655 -665 64 295 C ATOM 1455 CG GLU A 83 36.149 6.720 -18.946 1.00 13.80 C ANISOU 1455 CG GLU A 83 2183 1461 1599 -717 156 332 C ATOM 1456 CD GLU A 83 36.727 8.111 -18.769 1.00 16.87 C ANISOU 1456 CD GLU A 83 2577 1800 2034 -762 146 357 C ATOM 1457 OE1 GLU A 83 37.651 8.477 -19.526 1.00 18.19 O ANISOU 1457 OE1 GLU A 83 2757 1937 2219 -811 229 394 O ATOM 1458 OE2 GLU A 83 36.263 8.832 -17.860 1.00 14.93 O ANISOU 1458 OE2 GLU A 83 2325 1540 1809 -749 62 343 O ATOM 0 H GLU A 83 33.381 6.031 -19.477 1.00 12.64 H new ATOM 0 HA GLU A 83 35.048 4.380 -18.414 1.00 14.71 H new ATOM 0 HB2 GLU A 83 34.515 7.078 -17.757 1.00 14.21 H new ATOM 0 HB3 GLU A 83 35.635 6.295 -17.005 1.00 14.21 H new ATOM 0 HG2 GLU A 83 36.870 6.071 -18.954 1.00 13.80 H new ATOM 0 HG3 GLU A 83 35.707 6.663 -19.808 1.00 13.80 H new ATOM 1465 N TYR A 84 32.711 5.186 -16.378 1.00 13.58 N ANISOU 1465 N TYR A 84 2082 1532 1547 -549 -74 239 N ATOM 1466 CA TYR A 84 32.134 4.818 -15.093 1.00 12.71 C ANISOU 1466 CA TYR A 84 1917 1448 1465 -506 -119 211 C ATOM 1467 C TYR A 84 31.415 3.474 -15.185 1.00 12.69 C ANISOU 1467 C TYR A 84 1892 1488 1442 -473 -123 199 C ATOM 1468 O TYR A 84 31.482 2.663 -14.255 1.00 11.39 O ANISOU 1468 O TYR A 84 1666 1357 1304 -453 -123 176 O ATOM 1469 CB TYR A 84 31.204 5.932 -14.603 1.00 13.42 C ANISOU 1469 CB TYR A 84 2042 1503 1555 -475 -176 215 C ATOM 1470 CG TYR A 84 30.663 5.682 -13.214 1.00 10.57 C ANISOU 1470 CG TYR A 84 1640 1159 1219 -427 -204 187 C ATOM 1471 CD1 TYR A 84 31.498 5.263 -12.193 1.00 14.10 C ANISOU 1471 CD1 TYR A 84 2040 1624 1696 -437 -196 162 C ATOM 1472 CD2 TYR A 84 29.321 5.859 -12.935 1.00 13.17 C ANISOU 1472 CD2 TYR A 84 1979 1480 1545 -372 -236 192 C ATOM 1473 CE1 TYR A 84 31.007 5.013 -10.925 1.00 17.18 C ANISOU 1473 CE1 TYR A 84 2412 2023 2093 -394 -217 138 C ATOM 1474 CE2 TYR A 84 28.817 5.614 -11.681 1.00 14.38 C ANISOU 1474 CE2 TYR A 84 2103 1644 1717 -326 -242 170 C ATOM 1475 CZ TYR A 84 29.664 5.189 -10.679 1.00 10.83 C ANISOU 1475 CZ TYR A 84 1626 1211 1278 -337 -231 142 C ATOM 1476 OH TYR A 84 29.164 4.940 -9.435 1.00 14.30 O ANISOU 1476 OH TYR A 84 2057 1655 1722 -292 -233 121 O ATOM 0 H TYR A 84 32.311 5.823 -16.795 1.00 13.58 H new ATOM 0 HA TYR A 84 32.846 4.714 -14.442 1.00 12.71 H new ATOM 0 HB2 TYR A 84 31.685 6.774 -14.611 1.00 13.42 H new ATOM 0 HB3 TYR A 84 30.463 6.023 -15.222 1.00 13.42 H new ATOM 0 HD1 TYR A 84 32.405 5.148 -12.363 1.00 14.10 H new ATOM 0 HD2 TYR A 84 28.749 6.149 -13.608 1.00 13.17 H new ATOM 0 HE1 TYR A 84 31.577 4.730 -10.247 1.00 17.18 H new ATOM 0 HE2 TYR A 84 27.911 5.734 -11.509 1.00 14.38 H new ATOM 0 HH TYR A 84 28.337 5.089 -9.430 1.00 14.30 H new ATOM 1486 N ARG A 85 30.751 3.202 -16.311 1.00 11.24 N ANISOU 1486 N ARG A 85 1764 1299 1209 -473 -130 217 N ATOM 1487 CA ARG A 85 30.198 1.867 -16.519 1.00 9.58 C ANISOU 1487 CA ARG A 85 1539 1121 980 -456 -136 208 C ATOM 1488 C ARG A 85 31.293 0.808 -16.435 1.00 9.46 C ANISOU 1488 C ARG A 85 1484 1133 976 -472 -70 188 C ATOM 1489 O ARG A 85 31.106 -0.238 -15.806 1.00 11.99 O ANISOU 1489 O ARG A 85 1753 1487 1316 -449 -74 168 O ATOM 1490 CB ARG A 85 29.478 1.804 -17.862 1.00 11.68 C ANISOU 1490 CB ARG A 85 1891 1363 1183 -466 -165 232 C ATOM 1491 CG ARG A 85 28.658 0.530 -18.072 1.00 14.06 C ANISOU 1491 CG ARG A 85 2188 1687 1468 -451 -198 226 C ATOM 1492 CD ARG A 85 29.438 -0.534 -18.822 1.00 12.89 C ANISOU 1492 CD ARG A 85 2079 1544 1274 -476 -137 211 C ATOM 1493 NE ARG A 85 29.840 -0.079 -20.149 1.00 12.62 N ANISOU 1493 NE ARG A 85 2158 1469 1169 -511 -107 231 N ATOM 1494 CZ ARG A 85 30.893 -0.534 -20.824 1.00 20.90 C ANISOU 1494 CZ ARG A 85 3253 2508 2181 -535 -14 224 C ATOM 1495 NH1 ARG A 85 31.676 -1.479 -20.307 1.00 20.74 N ANISOU 1495 NH1 ARG A 85 3165 2517 2198 -526 52 198 N ATOM 1496 NH2 ARG A 85 31.165 -0.034 -22.023 1.00 16.89 N ANISOU 1496 NH2 ARG A 85 2862 1956 1600 -564 18 246 N ATOM 0 H ARG A 85 30.613 3.761 -16.950 1.00 11.24 H new ATOM 0 HA ARG A 85 29.555 1.683 -15.816 1.00 9.58 H new ATOM 0 HB2 ARG A 85 28.890 2.572 -17.939 1.00 11.68 H new ATOM 0 HB3 ARG A 85 30.134 1.876 -18.573 1.00 11.68 H new ATOM 0 HG2 ARG A 85 28.381 0.180 -17.211 1.00 14.06 H new ATOM 0 HG3 ARG A 85 27.850 0.744 -18.564 1.00 14.06 H new ATOM 0 HD2 ARG A 85 30.226 -0.777 -18.311 1.00 12.89 H new ATOM 0 HD3 ARG A 85 28.896 -1.334 -18.905 1.00 12.89 H new ATOM 0 HE ARG A 85 29.360 0.529 -20.523 1.00 12.62 H new ATOM 0 HH11 ARG A 85 31.504 -1.802 -19.529 1.00 20.74 H new ATOM 0 HH12 ARG A 85 32.354 -1.766 -20.751 1.00 20.74 H new ATOM 0 HH21 ARG A 85 30.663 0.579 -22.357 1.00 16.89 H new ATOM 0 HH22 ARG A 85 31.844 -0.323 -22.465 1.00 16.89 H new ATOM 1510 N AGLU A 86 32.444 1.070 -17.067 0.57 12.91 N ANISOU 1510 N AGLU A 86 1941 1553 1410 -509 -3 197 N ATOM 1511 N BGLU A 86 32.455 1.070 -17.038 0.43 13.18 N ANISOU 1511 N BGLU A 86 1975 1588 1447 -509 -3 197 N ATOM 1512 CA AGLU A 86 33.568 0.141 -17.007 0.57 13.78 C ANISOU 1512 CA AGLU A 86 2003 1683 1551 -519 71 185 C ATOM 1513 CA BGLU A 86 33.561 0.123 -16.938 0.43 13.65 C ANISOU 1513 CA BGLU A 86 1982 1667 1536 -518 69 184 C ATOM 1514 C AGLU A 86 34.118 0.007 -15.593 0.57 12.75 C ANISOU 1514 C AGLU A 86 1773 1577 1497 -508 55 168 C ATOM 1515 C BGLU A 86 34.026 -0.038 -15.497 0.43 13.57 C ANISOU 1515 C BGLU A 86 1873 1682 1600 -504 49 166 C ATOM 1516 O AGLU A 86 34.596 -1.066 -15.215 0.57 13.22 O ANISOU 1516 O AGLU A 86 1776 1661 1585 -497 82 154 O ATOM 1517 O BGLU A 86 34.280 -1.159 -15.043 0.43 14.94 O ANISOU 1517 O BGLU A 86 1995 1884 1797 -487 64 149 O ATOM 1518 CB AGLU A 86 34.684 0.595 -17.953 0.57 13.06 C ANISOU 1518 CB AGLU A 86 1946 1561 1456 -559 158 208 C ATOM 1519 CB BGLU A 86 34.722 0.569 -17.824 0.43 11.60 C ANISOU 1519 CB BGLU A 86 1750 1378 1278 -558 156 206 C ATOM 1520 CG AGLU A 86 34.330 0.552 -19.437 0.57 14.13 C ANISOU 1520 CG AGLU A 86 2204 1666 1499 -572 190 224 C ATOM 1521 CG BGLU A 86 34.629 0.071 -19.251 0.43 19.88 C ANISOU 1521 CG BGLU A 86 2901 2406 2246 -567 212 216 C ATOM 1522 CD AGLU A 86 35.455 1.069 -20.324 0.57 21.27 C ANISOU 1522 CD AGLU A 86 3147 2535 2400 -611 294 252 C ATOM 1523 CD BGLU A 86 34.799 -1.434 -19.359 0.43 22.03 C ANISOU 1523 CD BGLU A 86 3161 2701 2510 -546 256 193 C ATOM 1524 OE1AGLU A 86 36.309 1.830 -19.827 0.57 30.49 O ANISOU 1524 OE1AGLU A 86 4248 3695 3642 -634 317 266 O ATOM 1525 OE1BGLU A 86 34.588 -1.976 -20.467 0.43 23.33 O ANISOU 1525 OE1BGLU A 86 3427 2843 2595 -550 292 193 O ATOM 1526 OE2AGLU A 86 35.487 0.708 -21.521 0.57 30.12 O ANISOU 1526 OE2AGLU A 86 4372 3629 3442 -620 354 261 O ATOM 1527 OE2BGLU A 86 35.139 -2.080 -18.340 0.43 14.68 O ANISOU 1527 OE2BGLU A 86 2128 1802 1646 -527 251 175 O ATOM 0 H AGLU A 86 32.589 1.778 -17.533 0.57 13.18 H new ATOM 0 H BGLU A 86 32.619 1.776 -17.500 0.43 13.18 H new ATOM 0 HA AGLU A 86 33.239 -0.728 -17.284 0.57 13.65 H new ATOM 0 HA BGLU A 86 33.243 -0.740 -17.246 0.43 13.65 H new ATOM 0 HB2AGLU A 86 34.937 1.502 -17.721 0.57 11.60 H new ATOM 0 HB2BGLU A 86 34.759 1.538 -17.830 0.43 11.60 H new ATOM 0 HB3AGLU A 86 35.463 0.036 -17.804 0.57 11.60 H new ATOM 0 HB3BGLU A 86 35.554 0.256 -17.435 0.43 11.60 H new ATOM 0 HG2AGLU A 86 34.118 -0.360 -19.689 0.57 19.88 H new ATOM 0 HG2BGLU A 86 33.769 0.323 -19.622 0.43 19.88 H new ATOM 0 HG3AGLU A 86 33.532 1.082 -19.591 0.57 19.88 H new ATOM 0 HG3BGLU A 86 35.309 0.509 -19.787 0.43 19.88 H new ATOM 1540 N ALYS A 87 34.082 1.084 -14.808 0.57 12.84 N ANISOU 1540 N ALYS A 87 1770 1573 1537 -512 8 170 N ATOM 1541 N BLYS A 87 34.154 1.069 -14.764 0.43 13.05 N ANISOU 1541 N BLYS A 87 1791 1599 1566 -513 10 170 N ATOM 1542 CA ALYS A 87 34.538 1.011 -13.422 0.57 11.90 C ANISOU 1542 CA ALYS A 87 1580 1466 1474 -504 -23 153 C ATOM 1543 CA BLYS A 87 34.571 0.990 -13.368 0.43 11.92 C ANISOU 1543 CA BLYS A 87 1580 1470 1480 -504 -24 152 C ATOM 1544 C ALYS A 87 33.656 0.072 -12.612 0.57 12.75 C ANISOU 1544 C ALYS A 87 1667 1607 1570 -458 -58 131 C ATOM 1545 C BLYS A 87 33.655 0.062 -12.582 0.43 12.76 C ANISOU 1545 C BLYS A 87 1667 1609 1572 -458 -59 130 C ATOM 1546 O ALYS A 87 34.150 -0.816 -11.906 0.57 10.86 O ANISOU 1546 O ALYS A 87 1372 1392 1364 -449 -54 118 O ATOM 1547 O BLYS A 87 34.121 -0.832 -11.864 0.43 9.60 O ANISOU 1547 O BLYS A 87 1211 1232 1203 -448 -56 117 O ATOM 1548 CB ALYS A 87 34.550 2.411 -12.806 0.57 12.41 C ANISOU 1548 CB ALYS A 87 1665 1495 1554 -518 -71 157 C ATOM 1549 CB BLYS A 87 34.586 2.388 -12.748 0.43 15.44 C ANISOU 1549 CB BLYS A 87 2045 1880 1940 -518 -72 156 C ATOM 1550 CG ALYS A 87 34.486 2.436 -11.280 0.57 27.86 C ANISOU 1550 CG ALYS A 87 3594 3456 3535 -497 -128 133 C ATOM 1551 CG BLYS A 87 35.050 2.435 -11.291 0.43 19.54 C ANISOU 1551 CG BLYS A 87 2521 2400 2504 -515 -120 137 C ATOM 1552 CD ALYS A 87 34.779 3.829 -10.736 0.57 28.68 C ANISOU 1552 CD ALYS A 87 3731 3511 3654 -520 -171 135 C ATOM 1553 CD BLYS A 87 34.528 3.684 -10.593 0.43 28.32 C ANISOU 1553 CD BLYS A 87 3688 3472 3601 -507 -176 130 C ATOM 1554 CE ALYS A 87 34.635 3.889 -9.222 0.57 29.87 C ANISOU 1554 CE ALYS A 87 3887 3654 3808 -497 -229 109 C ATOM 1555 CE BLYS A 87 34.727 3.608 -9.087 0.43 29.36 C ANISOU 1555 CE BLYS A 87 3808 3598 3747 -495 -229 106 C ATOM 1556 NZ ALYS A 87 35.318 5.085 -8.655 0.57 29.40 N ANISOU 1556 NZ ALYS A 87 3858 3541 3772 -536 -278 108 N ATOM 1557 NZ BLYS A 87 36.164 3.511 -8.721 0.43 25.73 N ANISOU 1557 NZ BLYS A 87 3291 3131 3353 -544 -247 113 N ATOM 0 H ALYS A 87 33.800 1.858 -15.056 0.57 13.05 H new ATOM 0 H BLYS A 87 34.006 1.865 -15.054 0.43 13.05 H new ATOM 0 HA ALYS A 87 35.440 0.655 -13.408 0.57 11.92 H new ATOM 0 HA BLYS A 87 35.468 0.623 -13.332 0.43 11.92 H new ATOM 0 HB2ALYS A 87 35.355 2.870 -13.092 0.57 15.44 H new ATOM 0 HB2BLYS A 87 35.165 2.958 -13.278 0.43 15.44 H new ATOM 0 HB3ALYS A 87 33.798 2.913 -13.158 0.57 15.44 H new ATOM 0 HB3BLYS A 87 33.693 2.763 -12.803 0.43 15.44 H new ATOM 0 HG2ALYS A 87 33.607 2.150 -10.986 0.57 19.54 H new ATOM 0 HG2BLYS A 87 34.738 1.645 -10.823 0.43 19.54 H new ATOM 0 HG3ALYS A 87 35.126 1.804 -10.917 0.57 19.54 H new ATOM 0 HG3BLYS A 87 36.019 2.422 -11.256 0.43 19.54 H new ATOM 0 HD2ALYS A 87 35.679 4.090 -10.986 0.57 28.32 H new ATOM 0 HD2BLYS A 87 34.985 4.465 -10.942 0.43 28.32 H new ATOM 0 HD3ALYS A 87 34.174 4.469 -11.144 0.57 28.32 H new ATOM 0 HD3BLYS A 87 33.585 3.796 -10.790 0.43 28.32 H new ATOM 0 HE2ALYS A 87 33.694 3.910 -8.986 0.57 29.36 H new ATOM 0 HE2BLYS A 87 34.340 4.394 -8.670 0.43 29.36 H new ATOM 0 HE3ALYS A 87 35.008 3.085 -8.828 0.57 29.36 H new ATOM 0 HE3BLYS A 87 34.252 2.838 -8.737 0.43 29.36 H new ATOM 0 HZ1ALYS A 87 35.908 4.827 -8.040 0.57 25.73 H new ATOM 0 HZ1BLYS A 87 36.251 3.585 -7.838 0.43 25.73 H new ATOM 0 HZ2ALYS A 87 35.740 5.522 -9.305 0.57 25.73 H new ATOM 0 HZ2BLYS A 87 36.486 2.724 -8.986 0.43 25.73 H new ATOM 0 HZ3ALYS A 87 34.715 5.622 -8.280 0.57 25.73 H new ATOM 0 HZ3BLYS A 87 36.617 4.165 -9.120 0.43 25.73 H new ATOM 1584 N VAL A 88 32.340 0.259 -12.703 1.00 10.40 N ANISOU 1584 N VAL A 88 1409 1308 1233 -429 -93 132 N ATOM 1585 CA VAL A 88 31.405 -0.615 -12.006 1.00 11.01 C ANISOU 1585 CA VAL A 88 1464 1413 1308 -387 -117 119 C ATOM 1586 C VAL A 88 31.535 -2.036 -12.528 1.00 13.52 C ANISOU 1586 C VAL A 88 1762 1757 1617 -388 -86 114 C ATOM 1587 O VAL A 88 31.568 -2.999 -11.753 1.00 10.83 O ANISOU 1587 O VAL A 88 1379 1442 1295 -369 -86 100 O ATOM 1588 CB VAL A 88 29.971 -0.077 -12.156 1.00 13.91 C ANISOU 1588 CB VAL A 88 1864 1766 1654 -358 -155 132 C ATOM 1589 CG1 VAL A 88 28.973 -1.044 -11.569 1.00 12.96 C ANISOU 1589 CG1 VAL A 88 1710 1672 1542 -319 -169 128 C ATOM 1590 CG2 VAL A 88 29.848 1.287 -11.494 1.00 15.50 C ANISOU 1590 CG2 VAL A 88 2089 1934 1865 -347 -177 133 C ATOM 0 H AVAL A 88 31.971 0.885 -13.163 0.57 10.40 H new ATOM 0 H BVAL A 88 31.978 0.881 -13.174 0.43 10.40 H new ATOM 0 HA VAL A 88 31.616 -0.629 -11.059 1.00 11.01 H new ATOM 0 HB VAL A 88 29.777 0.019 -13.101 1.00 13.91 H new ATOM 0 HG11 VAL A 88 28.077 -0.688 -11.673 1.00 12.96 H new ATOM 0 HG12 VAL A 88 29.037 -1.895 -12.030 1.00 12.96 H new ATOM 0 HG13 VAL A 88 29.162 -1.172 -10.626 1.00 12.96 H new ATOM 0 HG21 VAL A 88 28.941 1.615 -11.595 1.00 15.50 H new ATOM 0 HG22 VAL A 88 30.060 1.209 -10.551 1.00 15.50 H new ATOM 0 HG23 VAL A 88 30.464 1.907 -11.914 1.00 15.50 H new ATOM 1600 N GLU A 89 31.645 -2.187 -13.851 1.00 13.47 N ANISOU 1600 N GLU A 89 1801 1740 1576 -411 -57 125 N ATOM 1601 CA GLU A 89 31.748 -3.513 -14.448 1.00 15.07 C ANISOU 1601 CA GLU A 89 2010 1955 1760 -411 -25 117 C ATOM 1602 C GLU A 89 32.980 -4.255 -13.944 1.00 9.68 C ANISOU 1602 C GLU A 89 1267 1288 1123 -412 25 105 C ATOM 1603 O GLU A 89 32.916 -5.454 -13.643 1.00 9.83 O ANISOU 1603 O GLU A 89 1259 1326 1150 -394 32 92 O ATOM 1604 CB GLU A 89 31.778 -3.365 -15.964 1.00 12.25 C ANISOU 1604 CB GLU A 89 1739 1571 1345 -437 3 131 C ATOM 1605 CG GLU A 89 31.849 -4.643 -16.749 1.00 16.17 C ANISOU 1605 CG GLU A 89 2275 2065 1804 -439 39 120 C ATOM 1606 CD GLU A 89 31.812 -4.355 -18.230 1.00 16.87 C ANISOU 1606 CD GLU A 89 2478 2116 1817 -465 62 134 C ATOM 1607 OE1 GLU A 89 30.820 -3.744 -18.682 1.00 11.30 O ANISOU 1607 OE1 GLU A 89 1828 1393 1073 -471 -7 151 O ATOM 1608 OE2 GLU A 89 32.779 -4.713 -18.928 1.00 15.32 O ANISOU 1608 OE2 GLU A 89 2318 1903 1601 -478 151 131 O ATOM 0 H GLU A 89 31.661 -1.537 -14.413 1.00 13.47 H new ATOM 0 HA GLU A 89 30.977 -4.042 -14.189 1.00 15.07 H new ATOM 0 HB2 GLU A 89 30.984 -2.881 -16.240 1.00 12.25 H new ATOM 0 HB3 GLU A 89 32.542 -2.817 -16.203 1.00 12.25 H new ATOM 0 HG2 GLU A 89 32.663 -5.121 -16.527 1.00 16.17 H new ATOM 0 HG3 GLU A 89 31.107 -5.219 -16.507 1.00 16.17 H new ATOM 1615 N THR A 90 34.108 -3.555 -13.836 1.00 11.35 N ANISOU 1615 N THR A 90 1451 1488 1375 -435 56 113 N ATOM 1616 CA THR A 90 35.339 -4.177 -13.360 1.00 14.37 C ANISOU 1616 CA THR A 90 1759 1879 1821 -437 95 110 C ATOM 1617 C THR A 90 35.217 -4.593 -11.897 1.00 13.01 C ANISOU 1617 C THR A 90 1530 1728 1683 -413 38 97 C ATOM 1618 O THR A 90 35.713 -5.656 -11.503 1.00 10.84 O ANISOU 1618 O THR A 90 1208 1468 1443 -399 53 91 O ATOM 1619 CB THR A 90 36.512 -3.214 -13.560 1.00 15.54 C ANISOU 1619 CB THR A 90 1880 2003 2020 -474 129 131 C ATOM 1620 OG1 THR A 90 36.686 -2.962 -14.960 1.00 17.06 O ANISOU 1620 OG1 THR A 90 2135 2173 2175 -495 201 147 O ATOM 1621 CG2 THR A 90 37.797 -3.788 -12.991 1.00 21.63 C ANISOU 1621 CG2 THR A 90 2556 2780 2882 -478 155 138 C ATOM 0 H THR A 90 34.180 -2.721 -14.033 1.00 11.35 H new ATOM 0 HA THR A 90 35.501 -4.982 -13.876 1.00 14.37 H new ATOM 0 HB THR A 90 36.312 -2.388 -13.092 1.00 15.54 H new ATOM 0 HG1 THR A 90 36.111 -2.407 -15.219 1.00 17.06 H new ATOM 0 HG21 THR A 90 38.522 -3.159 -13.131 1.00 21.63 H new ATOM 0 HG22 THR A 90 37.687 -3.948 -12.041 1.00 21.63 H new ATOM 0 HG23 THR A 90 38.004 -4.624 -13.437 1.00 21.63 H new ATOM 1629 N GLU A 91 34.555 -3.776 -11.079 1.00 10.65 N ANISOU 1629 N GLU A 91 1247 1428 1373 -406 -24 93 N ATOM 1630 CA AGLU A 91 34.355 -4.151 -9.684 0.55 15.59 C ANISOU 1630 CA AGLU A 91 1844 2066 2012 -381 -72 80 C ATOM 1631 CA BGLU A 91 34.334 -4.134 -9.680 0.45 14.57 C ANISOU 1631 CA BGLU A 91 1716 1937 1882 -381 -73 80 C ATOM 1632 C GLU A 91 33.433 -5.359 -9.572 1.00 10.81 C ANISOU 1632 C GLU A 91 1242 1486 1381 -348 -70 71 C ATOM 1633 O GLU A 91 33.691 -6.266 -8.771 1.00 9.86 O ANISOU 1633 O GLU A 91 1086 1378 1281 -331 -78 64 O ATOM 1634 CB AGLU A 91 33.812 -2.958 -8.896 0.55 9.92 C ANISOU 1634 CB AGLU A 91 1163 1330 1278 -376 -123 76 C ATOM 1635 CB BGLU A 91 33.727 -2.940 -8.934 0.45 11.70 C ANISOU 1635 CB BGLU A 91 1391 1555 1499 -374 -123 76 C ATOM 1636 CG AGLU A 91 34.841 -1.862 -8.720 0.55 13.71 C ANISOU 1636 CG AGLU A 91 1637 1779 1793 -414 -142 83 C ATOM 1637 CG BGLU A 91 33.626 -3.100 -7.420 0.45 14.28 C ANISOU 1637 CG BGLU A 91 1715 1882 1828 -351 -167 63 C ATOM 1638 CD AGLU A 91 34.330 -0.667 -7.940 0.55 21.05 C ANISOU 1638 CD AGLU A 91 2622 2679 2698 -408 -192 75 C ATOM 1639 CD BGLU A 91 32.772 -2.017 -6.765 0.45 14.46 C ANISOU 1639 CD BGLU A 91 1798 1880 1817 -332 -197 57 C ATOM 1640 OE1AGLU A 91 33.269 -0.779 -7.292 0.55 17.22 O ANISOU 1640 OE1AGLU A 91 2169 2199 2176 -366 -205 64 O ATOM 1641 OE1BGLU A 91 33.270 -0.881 -6.625 0.45 15.57 O ANISOU 1641 OE1BGLU A 91 1966 1988 1964 -356 -222 56 O ATOM 1642 OE2AGLU A 91 34.998 0.391 -7.981 0.55 18.68 O ANISOU 1642 OE2AGLU A 91 2333 2344 2419 -444 -212 82 O ATOM 1643 OE2BGLU A 91 31.606 -2.295 -6.400 0.45 7.57 O ANISOU 1643 OE2BGLU A 91 944 1016 916 -291 -190 54 O ATOM 0 H AGLU A 91 34.221 -3.017 -11.307 0.55 10.65 H new ATOM 0 H BGLU A 91 34.228 -3.016 -11.313 0.45 10.65 H new ATOM 0 HA AGLU A 91 35.210 -4.405 -9.302 0.55 14.57 H new ATOM 0 HA BGLU A 91 35.185 -4.358 -9.272 0.45 14.57 H new ATOM 0 HB2AGLU A 91 33.036 -2.598 -9.354 0.55 11.70 H new ATOM 0 HB2BGLU A 91 34.260 -2.153 -9.126 0.45 11.70 H new ATOM 0 HB3AGLU A 91 33.513 -3.260 -8.024 0.55 11.70 H new ATOM 0 HB3BGLU A 91 32.839 -2.775 -9.287 0.45 11.70 H new ATOM 0 HG2AGLU A 91 35.616 -2.227 -8.266 0.55 14.28 H new ATOM 0 HG2BGLU A 91 33.250 -3.970 -7.216 0.45 14.28 H new ATOM 0 HG3AGLU A 91 35.138 -1.565 -9.594 0.55 14.28 H new ATOM 0 HG3BGLU A 91 34.517 -3.079 -7.037 0.45 14.28 H new ATOM 1656 N LEU A 92 32.373 -5.398 -10.384 1.00 9.17 N ANISOU 1656 N LEU A 92 1075 1278 1132 -342 -65 75 N ATOM 1657 CA ALEU A 92 31.478 -6.549 -10.428 0.67 11.74 C ANISOU 1657 CA ALEU A 92 1400 1619 1441 -320 -69 72 C ATOM 1658 CA BLEU A 92 31.483 -6.552 -10.411 0.33 11.35 C ANISOU 1658 CA BLEU A 92 1350 1570 1392 -320 -69 72 C ATOM 1659 C LEU A 92 32.230 -7.814 -10.822 1.00 14.49 C ANISOU 1659 C LEU A 92 1730 1974 1801 -324 -29 64 C ATOM 1660 O LEU A 92 32.063 -8.875 -10.207 1.00 11.86 O ANISOU 1660 O LEU A 92 1372 1654 1479 -305 -34 58 O ATOM 1661 CB ALEU A 92 30.344 -6.256 -11.420 0.67 11.37 C ANISOU 1661 CB ALEU A 92 1400 1561 1358 -324 -86 84 C ATOM 1662 CB BLEU A 92 30.319 -6.286 -11.367 0.33 12.60 C ANISOU 1662 CB BLEU A 92 1555 1718 1515 -323 -87 84 C ATOM 1663 CG ALEU A 92 29.236 -7.274 -11.684 0.67 11.75 C ANISOU 1663 CG ALEU A 92 1454 1616 1394 -314 -107 89 C ATOM 1664 CG BLEU A 92 29.398 -7.476 -11.635 0.33 12.68 C ANISOU 1664 CG BLEU A 92 1567 1736 1514 -314 -101 86 C ATOM 1665 CD1ALEU A 92 28.009 -6.528 -12.191 0.67 15.32 C ANISOU 1665 CD1ALEU A 92 1932 2053 1835 -313 -151 111 C ATOM 1666 CD1BLEU A 92 28.769 -7.971 -10.343 0.33 10.82 C ANISOU 1666 CD1BLEU A 92 1288 1518 1307 -284 -116 87 C ATOM 1667 CD2ALEU A 92 29.657 -8.337 -12.694 0.67 16.89 C ANISOU 1667 CD2ALEU A 92 2136 2259 2020 -333 -79 80 C ATOM 1668 CD2BLEU A 92 28.336 -7.094 -12.650 0.33 10.40 C ANISOU 1668 CD2BLEU A 92 1324 1429 1199 -326 -138 104 C ATOM 0 H ALEU A 92 32.157 -4.761 -10.920 0.67 9.17 H new ATOM 0 H BLEU A 92 32.156 -4.766 -10.925 0.33 9.17 H new ATOM 0 HA ALEU A 92 31.106 -6.700 -9.545 0.67 11.35 H new ATOM 0 HA BLEU A 92 31.136 -6.692 -9.516 0.33 11.35 H new ATOM 0 HB2ALEU A 92 29.913 -5.440 -11.123 0.67 12.60 H new ATOM 0 HB2BLEU A 92 29.786 -5.560 -11.007 0.33 12.60 H new ATOM 0 HB3ALEU A 92 30.759 -6.062 -12.275 0.67 12.60 H new ATOM 0 HB3BLEU A 92 30.680 -5.980 -12.214 0.33 12.60 H new ATOM 0 HG ALEU A 92 29.039 -7.737 -10.855 0.67 12.68 H new ATOM 0 HG BLEU A 92 29.925 -8.203 -12.003 0.33 12.68 H new ATOM 0 HD11ALEU A 92 27.294 -7.160 -12.364 0.67 10.82 H new ATOM 0 HD11BLEU A 92 28.189 -8.725 -10.533 0.33 10.82 H new ATOM 0 HD12ALEU A 92 27.719 -5.889 -11.522 0.67 10.82 H new ATOM 0 HD12BLEU A 92 29.467 -8.247 -9.728 0.33 10.82 H new ATOM 0 HD13ALEU A 92 28.231 -6.059 -13.011 0.67 10.82 H new ATOM 0 HD13BLEU A 92 28.249 -7.257 -9.942 0.33 10.82 H new ATOM 0 HD21ALEU A 92 28.927 -8.960 -12.831 0.67 10.40 H new ATOM 0 HD21BLEU A 92 27.756 -7.854 -12.814 0.33 10.40 H new ATOM 0 HD22ALEU A 92 29.882 -7.912 -13.537 0.67 10.40 H new ATOM 0 HD22BLEU A 92 27.810 -6.355 -12.306 0.33 10.40 H new ATOM 0 HD23ALEU A 92 30.431 -8.815 -12.357 0.67 10.40 H new ATOM 0 HD23BLEU A 92 28.762 -6.828 -13.480 0.33 10.40 H new ATOM 1691 N GLN A 93 33.050 -7.722 -11.869 1.00 14.20 N ANISOU 1691 N GLN A 93 1712 1923 1761 -346 20 67 N ATOM 1692 CA GLN A 93 33.834 -8.870 -12.306 1.00 12.14 C ANISOU 1692 CA GLN A 93 1439 1659 1515 -342 76 60 C ATOM 1693 C GLN A 93 34.788 -9.323 -11.210 1.00 13.14 C ANISOU 1693 C GLN A 93 1488 1797 1709 -328 75 60 C ATOM 1694 O GLN A 93 35.024 -10.524 -11.038 1.00 13.24 O ANISOU 1694 O GLN A 93 1479 1812 1739 -309 94 53 O ATOM 1695 CB GLN A 93 34.603 -8.518 -13.579 1.00 12.80 C ANISOU 1695 CB GLN A 93 1560 1717 1586 -365 146 67 C ATOM 1696 CG GLN A 93 33.727 -8.407 -14.820 1.00 10.10 C ANISOU 1696 CG GLN A 93 1318 1356 1164 -378 145 67 C ATOM 1697 CD GLN A 93 34.431 -7.754 -15.991 1.00 15.88 C ANISOU 1697 CD GLN A 93 2106 2059 1870 -403 214 79 C ATOM 1698 OE1 GLN A 93 35.245 -6.844 -15.818 1.00 14.16 O ANISOU 1698 OE1 GLN A 93 1848 1837 1695 -418 239 94 O ATOM 1699 NE2 GLN A 93 34.110 -8.206 -17.193 1.00 16.62 N ANISOU 1699 NE2 GLN A 93 2300 2124 1889 -411 243 75 N ATOM 0 H GLN A 93 33.164 -7.008 -12.335 1.00 14.20 H new ATOM 0 HA GLN A 93 33.230 -9.605 -12.497 1.00 12.14 H new ATOM 0 HB2 GLN A 93 35.065 -7.676 -13.444 1.00 12.80 H new ATOM 0 HB3 GLN A 93 35.282 -9.193 -13.733 1.00 12.80 H new ATOM 0 HG2 GLN A 93 33.432 -9.294 -15.081 1.00 10.10 H new ATOM 0 HG3 GLN A 93 32.932 -7.896 -14.603 1.00 10.10 H new ATOM 0 HE21 GLN A 93 33.538 -8.843 -17.274 1.00 16.62 H new ATOM 0 HE22 GLN A 93 34.474 -7.863 -17.893 1.00 16.62 H new ATOM 1708 N GLY A 94 35.350 -8.374 -10.461 1.00 13.55 N ANISOU 1708 N GLY A 94 1502 1848 1799 -339 45 68 N ATOM 1709 CA GLY A 94 36.237 -8.735 -9.371 1.00 15.08 C ANISOU 1709 CA GLY A 94 1628 2046 2056 -331 20 72 C ATOM 1710 C GLY A 94 35.528 -9.516 -8.281 1.00 9.38 C ANISOU 1710 C GLY A 94 909 1340 1316 -302 -27 63 C ATOM 1711 O GLY A 94 36.077 -10.472 -7.733 1.00 13.46 O ANISOU 1711 O GLY A 94 1385 1859 1870 -286 -30 65 O ATOM 0 H GLY A 94 35.230 -7.529 -10.569 1.00 13.55 H new ATOM 0 HA2 GLY A 94 36.972 -9.264 -9.718 1.00 15.08 H new ATOM 0 HA3 GLY A 94 36.621 -7.930 -8.990 1.00 15.08 H new ATOM 1715 N VAL A 95 34.294 -9.129 -7.961 1.00 10.21 N ANISOU 1715 N VAL A 95 1059 1451 1369 -293 -58 57 N ATOM 1716 CA VAL A 95 33.522 -9.876 -6.971 1.00 11.77 C ANISOU 1716 CA VAL A 95 1263 1660 1549 -266 -86 53 C ATOM 1717 C VAL A 95 33.222 -11.279 -7.486 1.00 14.18 C ANISOU 1717 C VAL A 95 1565 1972 1851 -254 -55 51 C ATOM 1718 O VAL A 95 33.398 -12.271 -6.770 1.00 11.61 O ANISOU 1718 O VAL A 95 1220 1650 1543 -236 -63 52 O ATOM 1719 CB VAL A 95 32.234 -9.115 -6.605 1.00 10.71 C ANISOU 1719 CB VAL A 95 1170 1527 1374 -255 -107 54 C ATOM 1720 CG1 VAL A 95 31.321 -9.995 -5.763 1.00 16.24 C ANISOU 1720 CG1 VAL A 95 1874 2236 2059 -226 -113 57 C ATOM 1721 CG2 VAL A 95 32.571 -7.840 -5.851 1.00 13.62 C ANISOU 1721 CG2 VAL A 95 1557 1880 1740 -261 -141 52 C ATOM 0 H VAL A 95 33.892 -8.448 -8.299 1.00 10.21 H new ATOM 0 HA VAL A 95 34.048 -9.965 -6.161 1.00 11.77 H new ATOM 0 HB VAL A 95 31.771 -8.880 -7.425 1.00 10.71 H new ATOM 0 HG11 VAL A 95 30.515 -9.505 -5.540 1.00 16.24 H new ATOM 0 HG12 VAL A 95 31.086 -10.791 -6.265 1.00 16.24 H new ATOM 0 HG13 VAL A 95 31.780 -10.251 -4.947 1.00 16.24 H new ATOM 0 HG21 VAL A 95 31.752 -7.371 -5.627 1.00 13.62 H new ATOM 0 HG22 VAL A 95 33.049 -8.062 -5.037 1.00 13.62 H new ATOM 0 HG23 VAL A 95 33.127 -7.272 -6.407 1.00 13.62 H new ATOM 1731 N CYS A 96 32.771 -11.385 -8.741 1.00 10.28 N ANISOU 1731 N CYS A 96 1103 1473 1332 -266 -25 48 N ATOM 1732 CA CYS A 96 32.521 -12.699 -9.328 1.00 9.21 C ANISOU 1732 CA CYS A 96 982 1331 1187 -260 -1 43 C ATOM 1733 C CYS A 96 33.774 -13.566 -9.307 1.00 10.05 C ANISOU 1733 C CYS A 96 1053 1429 1336 -248 38 39 C ATOM 1734 O CYS A 96 33.709 -14.753 -8.968 1.00 11.21 O ANISOU 1734 O CYS A 96 1194 1573 1494 -230 39 37 O ATOM 1735 CB CYS A 96 32.005 -12.556 -10.758 1.00 8.14 C ANISOU 1735 CB CYS A 96 906 1181 1008 -281 16 40 C ATOM 1736 SG CYS A 96 30.372 -11.805 -10.855 1.00 12.43 S ANISOU 1736 SG CYS A 96 1476 1726 1518 -289 -41 53 S ATOM 0 H CYS A 96 32.607 -10.718 -9.259 1.00 10.28 H new ATOM 0 HA CYS A 96 31.844 -13.137 -8.790 1.00 9.21 H new ATOM 0 HB2 CYS A 96 32.631 -12.020 -11.269 1.00 8.14 H new ATOM 0 HB3 CYS A 96 31.976 -13.432 -11.174 1.00 8.14 H new ATOM 0 HG CYS A 96 30.460 -10.626 -10.648 1.00 12.43 H new ATOM 1742 N ASP A 97 34.920 -12.994 -9.681 1.00 7.82 N ANISOU 1742 N ASP A 97 745 1138 1088 -258 72 43 N ATOM 1743 CA ASP A 97 36.173 -13.740 -9.647 1.00 11.91 C ANISOU 1743 CA ASP A 97 1211 1645 1670 -242 115 48 C ATOM 1744 C ASP A 97 36.505 -14.200 -8.234 1.00 12.31 C ANISOU 1744 C ASP A 97 1208 1704 1765 -223 60 58 C ATOM 1745 O ASP A 97 37.039 -15.298 -8.039 1.00 9.75 O ANISOU 1745 O ASP A 97 855 1369 1481 -199 77 61 O ATOM 1746 CB ASP A 97 37.311 -12.883 -10.199 1.00 12.66 C ANISOU 1746 CB ASP A 97 1270 1727 1812 -259 160 61 C ATOM 1747 CG ASP A 97 37.252 -12.721 -11.713 1.00 25.23 C ANISOU 1747 CG ASP A 97 2926 3300 3359 -272 239 55 C ATOM 1748 OD1 ASP A 97 36.425 -13.382 -12.367 1.00 20.02 O ANISOU 1748 OD1 ASP A 97 2341 2631 2634 -268 250 39 O ATOM 1749 OD2 ASP A 97 38.039 -11.918 -12.245 1.00 22.17 O ANISOU 1749 OD2 ASP A 97 2521 2900 3001 -290 285 70 O ATOM 0 H ASP A 97 34.991 -12.182 -9.955 1.00 7.82 H new ATOM 0 HA ASP A 97 36.067 -14.528 -10.203 1.00 11.91 H new ATOM 0 HB2 ASP A 97 37.281 -12.007 -9.783 1.00 12.66 H new ATOM 0 HB3 ASP A 97 38.160 -13.284 -9.954 1.00 12.66 H new ATOM 1754 N THR A 98 36.205 -13.371 -7.237 1.00 11.49 N ANISOU 1754 N THR A 98 1102 1612 1650 -231 -6 62 N ATOM 1755 CA THR A 98 36.489 -13.744 -5.854 1.00 14.45 C ANISOU 1755 CA THR A 98 1451 1988 2050 -216 -66 71 C ATOM 1756 C THR A 98 35.658 -14.950 -5.433 1.00 9.44 C ANISOU 1756 C THR A 98 845 1357 1383 -192 -70 68 C ATOM 1757 O THR A 98 36.181 -15.910 -4.854 1.00 10.19 O ANISOU 1757 O THR A 98 914 1444 1515 -171 -83 77 O ATOM 1758 CB THR A 98 36.218 -12.556 -4.935 1.00 12.40 C ANISOU 1758 CB THR A 98 1216 1731 1765 -230 -129 72 C ATOM 1759 OG1 THR A 98 37.168 -11.525 -5.201 1.00 16.19 O ANISOU 1759 OG1 THR A 98 1663 2201 2290 -258 -138 80 O ATOM 1760 CG2 THR A 98 36.307 -12.976 -3.469 1.00 15.23 C ANISOU 1760 CG2 THR A 98 1583 2085 2120 -214 -195 80 C ATOM 0 H THR A 98 35.841 -12.598 -7.338 1.00 11.49 H new ATOM 0 HA THR A 98 37.424 -13.991 -5.784 1.00 14.45 H new ATOM 0 HB THR A 98 35.321 -12.227 -5.105 1.00 12.40 H new ATOM 0 HG1 THR A 98 36.929 -11.092 -5.880 1.00 16.19 H new ATOM 0 HG21 THR A 98 36.132 -12.209 -2.901 1.00 15.23 H new ATOM 0 HG22 THR A 98 35.650 -13.667 -3.290 1.00 15.23 H new ATOM 0 HG23 THR A 98 37.195 -13.319 -3.284 1.00 15.23 H new ATOM 1768 N VAL A 99 34.360 -14.922 -5.738 1.00 9.44 N ANISOU 1768 N VAL A 99 894 1367 1327 -195 -60 59 N ATOM 1769 CA VAL A 99 33.478 -16.033 -5.397 1.00 8.51 C ANISOU 1769 CA VAL A 99 798 1248 1186 -179 -62 61 C ATOM 1770 C VAL A 99 33.920 -17.302 -6.111 1.00 10.22 C ANISOU 1770 C VAL A 99 1008 1448 1427 -170 -23 56 C ATOM 1771 O VAL A 99 34.044 -18.371 -5.501 1.00 10.99 O ANISOU 1771 O VAL A 99 1098 1536 1541 -150 -31 63 O ATOM 1772 CB VAL A 99 32.022 -15.676 -5.737 1.00 6.66 C ANISOU 1772 CB VAL A 99 601 1023 907 -190 -61 60 C ATOM 1773 CG1 VAL A 99 31.123 -16.885 -5.554 1.00 8.81 C ANISOU 1773 CG1 VAL A 99 886 1289 1171 -183 -59 68 C ATOM 1774 CG2 VAL A 99 31.553 -14.501 -4.865 1.00 13.80 C ANISOU 1774 CG2 VAL A 99 1517 1936 1790 -187 -89 66 C ATOM 0 H VAL A 99 33.973 -14.269 -6.142 1.00 9.44 H new ATOM 0 HA VAL A 99 33.532 -16.198 -4.443 1.00 8.51 H new ATOM 0 HB VAL A 99 31.971 -15.406 -6.667 1.00 6.66 H new ATOM 0 HG11 VAL A 99 30.209 -16.645 -5.772 1.00 8.81 H new ATOM 0 HG12 VAL A 99 31.418 -17.599 -6.140 1.00 8.81 H new ATOM 0 HG13 VAL A 99 31.167 -17.185 -4.633 1.00 8.81 H new ATOM 0 HG21 VAL A 99 30.634 -14.281 -5.085 1.00 13.80 H new ATOM 0 HG22 VAL A 99 31.611 -14.749 -3.929 1.00 13.80 H new ATOM 0 HG23 VAL A 99 32.118 -13.730 -5.030 1.00 13.80 H new ATOM 1784 N LEU A 100 34.159 -17.204 -7.421 1.00 8.82 N ANISOU 1784 N LEU A 100 845 1260 1245 -181 25 44 N ATOM 1785 CA LEU A 100 34.588 -18.375 -8.175 1.00 8.26 C ANISOU 1785 CA LEU A 100 788 1163 1189 -168 75 35 C ATOM 1786 C LEU A 100 35.919 -18.904 -7.667 1.00 8.04 C ANISOU 1786 C LEU A 100 698 1122 1234 -139 90 46 C ATOM 1787 O LEU A 100 36.151 -20.120 -7.692 1.00 9.97 O ANISOU 1787 O LEU A 100 946 1343 1499 -115 112 45 O ATOM 1788 CB LEU A 100 34.670 -18.037 -9.662 1.00 9.84 C ANISOU 1788 CB LEU A 100 1034 1346 1359 -185 130 20 C ATOM 1789 CG LEU A 100 33.313 -17.689 -10.288 1.00 9.29 C ANISOU 1789 CG LEU A 100 1030 1279 1221 -213 100 14 C ATOM 1790 CD1 LEU A 100 33.516 -17.023 -11.640 1.00 12.17 C ANISOU 1790 CD1 LEU A 100 1449 1627 1549 -233 143 4 C ATOM 1791 CD2 LEU A 100 32.443 -18.933 -10.429 1.00 8.84 C ANISOU 1791 CD2 LEU A 100 1018 1202 1141 -215 83 8 C ATOM 0 H LEU A 100 34.080 -16.482 -7.881 1.00 8.82 H new ATOM 0 HA LEU A 100 33.930 -19.076 -8.049 1.00 8.26 H new ATOM 0 HB2 LEU A 100 35.275 -17.289 -9.783 1.00 9.84 H new ATOM 0 HB3 LEU A 100 35.053 -18.791 -10.137 1.00 9.84 H new ATOM 0 HG LEU A 100 32.854 -17.069 -9.700 1.00 9.29 H new ATOM 0 HD11 LEU A 100 32.653 -16.807 -12.027 1.00 12.17 H new ATOM 0 HD12 LEU A 100 34.032 -16.209 -11.526 1.00 12.17 H new ATOM 0 HD13 LEU A 100 33.993 -17.627 -12.230 1.00 12.17 H new ATOM 0 HD21 LEU A 100 31.592 -18.690 -10.826 1.00 8.84 H new ATOM 0 HD22 LEU A 100 32.891 -19.579 -10.997 1.00 8.84 H new ATOM 0 HD23 LEU A 100 32.291 -19.323 -9.554 1.00 8.84 H new ATOM 1803 N GLY A 101 36.793 -18.015 -7.192 1.00 11.31 N ANISOU 1803 N GLY A 101 1055 1547 1695 -143 70 60 N ATOM 1804 CA GLY A 101 38.048 -18.456 -6.605 1.00 13.38 C ANISOU 1804 CA GLY A 101 1244 1795 2044 -119 63 80 C ATOM 1805 C GLY A 101 37.863 -19.224 -5.310 1.00 11.13 C ANISOU 1805 C GLY A 101 956 1510 1764 -100 -3 93 C ATOM 1806 O GLY A 101 38.584 -20.192 -5.046 1.00 13.50 O ANISOU 1806 O GLY A 101 1220 1788 2123 -70 1 107 O ATOM 0 H GLY A 101 36.676 -17.163 -7.202 1.00 11.31 H new ATOM 0 HA2 GLY A 101 38.518 -19.016 -7.243 1.00 13.38 H new ATOM 0 HA3 GLY A 101 38.610 -17.683 -6.439 1.00 13.38 H new ATOM 1810 N LEU A 102 36.912 -18.795 -4.474 1.00 9.42 N ANISOU 1810 N LEU A 102 781 1312 1485 -114 -60 92 N ATOM 1811 CA LEU A 102 36.609 -19.544 -3.259 1.00 9.88 C ANISOU 1811 CA LEU A 102 858 1366 1531 -96 -112 106 C ATOM 1812 C LEU A 102 36.045 -20.912 -3.593 1.00 10.41 C ANISOU 1812 C LEU A 102 954 1416 1584 -80 -75 101 C ATOM 1813 O LEU A 102 36.401 -21.914 -2.961 1.00 12.02 O ANISOU 1813 O LEU A 102 1149 1600 1816 -55 -94 117 O ATOM 1814 CB LEU A 102 35.610 -18.779 -2.392 1.00 12.77 C ANISOU 1814 CB LEU A 102 1276 1750 1828 -111 -154 106 C ATOM 1815 CG LEU A 102 36.111 -17.449 -1.832 1.00 15.47 C ANISOU 1815 CG LEU A 102 1611 2097 2171 -127 -205 109 C ATOM 1816 CD1 LEU A 102 34.964 -16.700 -1.167 1.00 19.96 C ANISOU 1816 CD1 LEU A 102 2246 2676 2662 -134 -220 103 C ATOM 1817 CD2 LEU A 102 37.257 -17.682 -0.856 1.00 15.13 C ANISOU 1817 CD2 LEU A 102 1537 2033 2177 -118 -276 131 C ATOM 0 H LEU A 102 36.441 -18.085 -4.592 1.00 9.42 H new ATOM 0 HA LEU A 102 37.437 -19.658 -2.767 1.00 9.88 H new ATOM 0 HB2 LEU A 102 34.812 -18.611 -2.917 1.00 12.77 H new ATOM 0 HB3 LEU A 102 35.348 -19.346 -1.650 1.00 12.77 H new ATOM 0 HG LEU A 102 36.448 -16.904 -2.560 1.00 15.47 H new ATOM 0 HD11 LEU A 102 35.289 -15.857 -0.814 1.00 19.96 H new ATOM 0 HD12 LEU A 102 34.267 -16.529 -1.820 1.00 19.96 H new ATOM 0 HD13 LEU A 102 34.604 -17.236 -0.443 1.00 19.96 H new ATOM 0 HD21 LEU A 102 37.565 -16.830 -0.509 1.00 15.13 H new ATOM 0 HD22 LEU A 102 36.950 -18.238 -0.123 1.00 15.13 H new ATOM 0 HD23 LEU A 102 37.987 -18.127 -1.314 1.00 15.13 H new ATOM 1829 N LEU A 103 35.127 -20.964 -4.561 1.00 8.84 N ANISOU 1829 N LEU A 103 796 1221 1343 -96 -32 82 N ATOM 1830 CA LEU A 103 34.534 -22.235 -4.956 1.00 14.05 C ANISOU 1830 CA LEU A 103 1493 1857 1988 -90 -7 76 C ATOM 1831 C LEU A 103 35.596 -23.185 -5.490 1.00 10.09 C ANISOU 1831 C LEU A 103 973 1321 1541 -60 37 73 C ATOM 1832 O LEU A 103 35.552 -24.391 -5.228 1.00 11.49 O ANISOU 1832 O LEU A 103 1165 1470 1730 -40 38 78 O ATOM 1833 CB LEU A 103 33.441 -21.996 -6.002 1.00 11.67 C ANISOU 1833 CB LEU A 103 1240 1559 1636 -120 14 59 C ATOM 1834 CG LEU A 103 32.222 -21.186 -5.544 1.00 10.44 C ANISOU 1834 CG LEU A 103 1097 1431 1440 -143 -21 68 C ATOM 1835 CD1 LEU A 103 31.349 -20.787 -6.738 1.00 12.93 C ANISOU 1835 CD1 LEU A 103 1447 1745 1722 -173 -12 55 C ATOM 1836 CD2 LEU A 103 31.388 -21.960 -4.536 1.00 10.56 C ANISOU 1836 CD2 LEU A 103 1123 1442 1448 -138 -43 88 C ATOM 0 H LEU A 103 34.839 -20.280 -4.995 1.00 8.84 H new ATOM 0 HA LEU A 103 34.134 -22.649 -4.175 1.00 14.05 H new ATOM 0 HB2 LEU A 103 33.840 -21.541 -6.760 1.00 11.67 H new ATOM 0 HB3 LEU A 103 33.131 -22.858 -6.320 1.00 11.67 H new ATOM 0 HG LEU A 103 32.557 -20.383 -5.115 1.00 10.44 H new ATOM 0 HD11 LEU A 103 30.586 -20.277 -6.425 1.00 12.93 H new ATOM 0 HD12 LEU A 103 31.869 -20.246 -7.353 1.00 12.93 H new ATOM 0 HD13 LEU A 103 31.039 -21.585 -7.193 1.00 12.93 H new ATOM 0 HD21 LEU A 103 30.626 -21.423 -4.266 1.00 10.56 H new ATOM 0 HD22 LEU A 103 31.075 -22.785 -4.940 1.00 10.56 H new ATOM 0 HD23 LEU A 103 31.930 -22.167 -3.758 1.00 10.56 H new ATOM 1848 N ASP A 104 36.564 -22.657 -6.232 1.00 12.28 N ANISOU 1848 N ASP A 104 1215 1594 1856 -54 81 67 N ATOM 1849 CA ASP A 104 37.605 -23.497 -6.812 1.00 13.92 C ANISOU 1849 CA ASP A 104 1400 1763 2125 -19 145 66 C ATOM 1850 C ASP A 104 38.734 -23.805 -5.837 1.00 18.41 C ANISOU 1850 C ASP A 104 1887 2323 2786 15 112 97 C ATOM 1851 O ASP A 104 39.486 -24.762 -6.064 1.00 15.40 O ANISOU 1851 O ASP A 104 1481 1903 2466 55 156 104 O ATOM 1852 CB ASP A 104 38.181 -22.828 -8.055 1.00 16.91 C ANISOU 1852 CB ASP A 104 1776 2136 2512 -24 224 53 C ATOM 1853 CG ASP A 104 38.919 -23.803 -8.938 1.00 29.37 C ANISOU 1853 CG ASP A 104 3368 3663 4127 15 320 44 C ATOM 1854 OD1 ASP A 104 38.330 -24.854 -9.273 1.00 29.75 O ANISOU 1854 OD1 ASP A 104 3492 3679 4132 23 335 25 O ATOM 1855 OD2 ASP A 104 40.078 -23.523 -9.294 1.00 27.32 O ANISOU 1855 OD2 ASP A 104 3045 3391 3944 37 383 57 O ATOM 0 H ASP A 104 36.636 -21.819 -6.411 1.00 12.28 H new ATOM 0 HA ASP A 104 37.185 -24.340 -7.043 1.00 13.92 H new ATOM 0 HB2 ASP A 104 37.463 -22.416 -8.561 1.00 16.91 H new ATOM 0 HB3 ASP A 104 38.784 -22.117 -7.787 1.00 16.91 H new ATOM 1860 N SER A 105 38.859 -23.031 -4.752 1.00 17.78 N ANISOU 1860 N SER A 105 1769 2270 2715 1 30 118 N ATOM 1861 CA SER A 105 39.952 -23.169 -3.787 1.00 19.40 C ANISOU 1861 CA SER A 105 1899 2463 3007 24 -29 153 C ATOM 1862 C SER A 105 39.378 -23.016 -2.369 1.00 17.90 C ANISOU 1862 C SER A 105 1746 2288 2766 10 -130 167 C ATOM 1863 O SER A 105 39.551 -21.977 -1.730 1.00 19.92 O ANISOU 1863 O SER A 105 1991 2562 3015 -13 -194 176 O ATOM 1864 CB SER A 105 41.047 -22.129 -4.047 1.00 22.58 C ANISOU 1864 CB SER A 105 2217 2872 3489 13 -25 168 C ATOM 1865 OG SER A 105 41.594 -22.234 -5.347 1.00 24.87 O ANISOU 1865 OG SER A 105 2481 3144 3824 28 87 159 O ATOM 0 H SER A 105 38.303 -22.404 -4.556 1.00 17.78 H new ATOM 0 HA SER A 105 40.359 -24.045 -3.881 1.00 19.40 H new ATOM 0 HB2 SER A 105 40.680 -21.239 -3.924 1.00 22.58 H new ATOM 0 HB3 SER A 105 41.754 -22.237 -3.392 1.00 22.58 H new ATOM 0 HG SER A 105 41.380 -21.557 -5.797 1.00 24.87 H new ATOM 1871 N HIS A 106 38.724 -24.055 -1.836 1.00 14.57 N ANISOU 1871 N HIS A 106 1377 1853 2306 25 -145 171 N ATOM 1872 CA HIS A 106 38.626 -25.403 -2.395 1.00 16.80 C ANISOU 1872 CA HIS A 106 1678 2102 2604 53 -88 165 C ATOM 1873 C HIS A 106 37.264 -25.984 -2.029 1.00 11.83 C ANISOU 1873 C HIS A 106 1131 1474 1890 38 -96 158 C ATOM 1874 O HIS A 106 37.134 -27.174 -1.743 1.00 14.20 O ANISOU 1874 O HIS A 106 1457 1743 2197 59 -97 169 O ATOM 1875 CB HIS A 106 39.752 -26.302 -1.859 1.00 18.58 C ANISOU 1875 CB HIS A 106 1848 2289 2923 98 -115 197 C ATOM 1876 CG HIS A 106 41.120 -25.844 -2.256 1.00 18.37 C ANISOU 1876 CG HIS A 106 1720 2253 3006 116 -99 213 C ATOM 1877 ND1 HIS A 106 41.696 -26.178 -3.464 1.00 17.58 N ANISOU 1877 ND1 HIS A 106 1586 2129 2964 142 7 201 N ATOM 1878 CD2 HIS A 106 42.006 -25.037 -1.625 1.00 22.52 C ANISOU 1878 CD2 HIS A 106 2172 2787 3597 107 -172 242 C ATOM 1879 CE1 HIS A 106 42.886 -25.608 -3.552 1.00 22.68 C ANISOU 1879 CE1 HIS A 106 2129 2772 3718 152 9 226 C ATOM 1880 NE2 HIS A 106 43.100 -24.915 -2.447 1.00 23.70 N ANISOU 1880 NE2 HIS A 106 2227 2920 3857 128 -107 253 N ATOM 0 H HIS A 106 38.300 -23.983 -1.091 1.00 14.57 H new ATOM 0 HA HIS A 106 38.719 -25.359 -3.360 1.00 16.80 H new ATOM 0 HB2 HIS A 106 39.698 -26.334 -0.891 1.00 18.58 H new ATOM 0 HB3 HIS A 106 39.615 -27.207 -2.181 1.00 18.58 H new ATOM 0 HD2 HIS A 106 41.895 -24.640 -0.791 1.00 22.52 H new ATOM 0 HE1 HIS A 106 43.473 -25.682 -4.270 1.00 22.68 H new ATOM 0 HE2 HIS A 106 43.809 -24.461 -2.271 1.00 23.70 H new ATOM 1888 N LEU A 107 36.240 -25.129 -2.045 1.00 10.23 N ANISOU 1888 N LEU A 107 964 1305 1616 2 -100 145 N ATOM 1889 CA LEU A 107 34.925 -25.541 -1.559 1.00 8.69 C ANISOU 1889 CA LEU A 107 831 1113 1358 -15 -109 150 C ATOM 1890 C LEU A 107 34.366 -26.709 -2.366 1.00 9.07 C ANISOU 1890 C LEU A 107 913 1131 1404 -16 -64 138 C ATOM 1891 O LEU A 107 33.895 -27.699 -1.797 1.00 11.88 O ANISOU 1891 O LEU A 107 1301 1463 1751 -12 -76 156 O ATOM 1892 CB LEU A 107 33.958 -24.358 -1.597 1.00 9.37 C ANISOU 1892 CB LEU A 107 936 1237 1388 -47 -109 141 C ATOM 1893 CG LEU A 107 34.207 -23.231 -0.597 1.00 13.93 C ANISOU 1893 CG LEU A 107 1511 1836 1946 -49 -157 152 C ATOM 1894 CD1 LEU A 107 33.308 -22.047 -0.911 1.00 11.76 C ANISOU 1894 CD1 LEU A 107 1252 1591 1627 -75 -141 138 C ATOM 1895 CD2 LEU A 107 33.960 -23.718 0.821 1.00 17.14 C ANISOU 1895 CD2 LEU A 107 1962 2229 2322 -37 -197 180 C ATOM 0 H LEU A 107 36.285 -24.318 -2.329 1.00 10.23 H new ATOM 0 HA LEU A 107 35.028 -25.841 -0.642 1.00 8.69 H new ATOM 0 HB2 LEU A 107 33.979 -23.980 -2.490 1.00 9.37 H new ATOM 0 HB3 LEU A 107 33.061 -24.697 -1.453 1.00 9.37 H new ATOM 0 HG LEU A 107 35.132 -22.949 -0.669 1.00 13.93 H new ATOM 0 HD11 LEU A 107 33.473 -21.337 -0.271 1.00 11.76 H new ATOM 0 HD12 LEU A 107 33.497 -21.725 -1.806 1.00 11.76 H new ATOM 0 HD13 LEU A 107 32.379 -22.322 -0.856 1.00 11.76 H new ATOM 0 HD21 LEU A 107 34.122 -22.993 1.445 1.00 17.14 H new ATOM 0 HD22 LEU A 107 33.041 -24.018 0.905 1.00 17.14 H new ATOM 0 HD23 LEU A 107 34.559 -24.454 1.019 1.00 17.14 H new ATOM 1907 N ILE A 108 34.391 -26.612 -3.697 1.00 13.19 N ANISOU 1907 N ILE A 108 1440 1645 1926 -26 -15 110 N ATOM 1908 CA ILE A 108 33.727 -27.637 -4.497 1.00 13.11 C ANISOU 1908 CA ILE A 108 1485 1599 1898 -37 14 95 C ATOM 1909 C ILE A 108 34.433 -28.983 -4.353 1.00 11.16 C ANISOU 1909 C ILE A 108 1245 1300 1694 2 29 101 C ATOM 1910 O ILE A 108 33.782 -30.023 -4.183 1.00 12.69 O ANISOU 1910 O ILE A 108 1483 1461 1876 -5 20 108 O ATOM 1911 CB ILE A 108 33.629 -27.196 -5.968 1.00 11.28 C ANISOU 1911 CB ILE A 108 1282 1362 1642 -56 57 61 C ATOM 1912 CG1 ILE A 108 32.567 -26.104 -6.113 1.00 13.19 C ANISOU 1912 CG1 ILE A 108 1530 1644 1837 -99 31 60 C ATOM 1913 CG2 ILE A 108 33.266 -28.377 -6.845 1.00 13.86 C ANISOU 1913 CG2 ILE A 108 1681 1634 1952 -62 84 42 C ATOM 1914 CD1 ILE A 108 32.582 -25.420 -7.456 1.00 12.23 C ANISOU 1914 CD1 ILE A 108 1437 1522 1686 -118 62 34 C ATOM 0 H ILE A 108 34.773 -25.983 -4.142 1.00 13.19 H new ATOM 0 HA ILE A 108 32.823 -27.750 -4.165 1.00 13.11 H new ATOM 0 HB ILE A 108 34.490 -26.847 -6.247 1.00 11.28 H new ATOM 0 HG12 ILE A 108 31.691 -26.494 -5.967 1.00 13.19 H new ATOM 0 HG13 ILE A 108 32.701 -25.440 -5.419 1.00 13.19 H new ATOM 0 HG21 ILE A 108 33.207 -28.088 -7.769 1.00 13.86 H new ATOM 0 HG22 ILE A 108 33.948 -29.062 -6.764 1.00 13.86 H new ATOM 0 HG23 ILE A 108 32.411 -28.738 -6.564 1.00 13.86 H new ATOM 0 HD11 ILE A 108 31.888 -24.742 -7.482 1.00 12.23 H new ATOM 0 HD12 ILE A 108 33.446 -25.003 -7.597 1.00 12.23 H new ATOM 0 HD13 ILE A 108 32.421 -26.074 -8.154 1.00 12.23 H new ATOM 1926 N LYS A 109 35.766 -29.001 -4.407 1.00 13.02 N ANISOU 1926 N LYS A 109 1432 1524 1992 44 51 104 N ATOM 1927 CA LYS A 109 36.442 -30.294 -4.416 1.00 13.98 C ANISOU 1927 CA LYS A 109 1559 1588 2164 88 74 110 C ATOM 1928 C LYS A 109 36.277 -31.037 -3.095 1.00 14.89 C ANISOU 1928 C LYS A 109 1677 1690 2288 100 13 146 C ATOM 1929 O LYS A 109 36.341 -32.270 -3.077 1.00 18.22 O ANISOU 1929 O LYS A 109 2132 2059 2730 124 24 152 O ATOM 1930 CB LYS A 109 37.927 -30.134 -4.759 1.00 20.97 C ANISOU 1930 CB LYS A 109 2374 2458 3134 136 118 114 C ATOM 1931 CG LYS A 109 38.784 -29.467 -3.702 1.00 23.50 C ANISOU 1931 CG LYS A 109 2606 2808 3516 150 55 150 C ATOM 1932 CD LYS A 109 40.278 -29.602 -4.021 1.00 27.13 C ANISOU 1932 CD LYS A 109 2979 3238 4090 201 98 166 C ATOM 1933 CE LYS A 109 40.647 -29.052 -5.397 1.00 22.03 C ANISOU 1933 CE LYS A 109 2325 2591 3454 201 201 138 C ATOM 1934 NZ LYS A 109 40.316 -27.614 -5.556 1.00 21.62 N ANISOU 1934 NZ LYS A 109 2264 2595 3357 152 182 128 N ATOM 0 H LYS A 109 36.276 -28.309 -4.438 1.00 13.02 H new ATOM 0 HA LYS A 109 36.019 -30.829 -5.106 1.00 13.98 H new ATOM 0 HB2 LYS A 109 38.295 -31.013 -4.942 1.00 20.97 H new ATOM 0 HB3 LYS A 109 37.998 -29.621 -5.579 1.00 20.97 H new ATOM 0 HG2 LYS A 109 38.549 -28.528 -3.639 1.00 23.50 H new ATOM 0 HG3 LYS A 109 38.600 -29.864 -2.837 1.00 23.50 H new ATOM 0 HD2 LYS A 109 40.792 -29.135 -3.343 1.00 27.13 H new ATOM 0 HD3 LYS A 109 40.530 -30.537 -3.974 1.00 27.13 H new ATOM 0 HE2 LYS A 109 41.597 -29.178 -5.546 1.00 22.03 H new ATOM 0 HE3 LYS A 109 40.183 -29.563 -6.079 1.00 22.03 H new ATOM 0 HZ1 LYS A 109 40.536 -27.347 -6.376 1.00 21.62 H new ATOM 0 HZ2 LYS A 109 39.443 -27.494 -5.430 1.00 21.62 H new ATOM 0 HZ3 LYS A 109 40.770 -27.137 -4.957 1.00 21.62 H new ATOM 1948 N GLU A 110 36.074 -30.328 -1.983 1.00 10.60 N ANISOU 1948 N GLU A 110 1114 1188 1725 85 -49 171 N ATOM 1949 CA AGLU A 110 35.857 -31.005 -0.709 0.53 14.44 C ANISOU 1949 CA AGLU A 110 1625 1658 2204 94 -104 208 C ATOM 1950 CA BGLU A 110 35.855 -30.968 -0.692 0.47 14.47 C ANISOU 1950 CA BGLU A 110 1627 1663 2206 93 -105 208 C ATOM 1951 C GLU A 110 34.386 -31.272 -0.423 1.00 16.31 C ANISOU 1951 C GLU A 110 1924 1900 2372 53 -104 213 C ATOM 1952 O GLU A 110 34.078 -31.920 0.582 1.00 17.24 O ANISOU 1952 O GLU A 110 2075 1999 2476 57 -134 246 O ATOM 1953 CB AGLU A 110 36.464 -30.196 0.444 0.53 15.91 C ANISOU 1953 CB AGLU A 110 1777 1872 2397 102 -174 236 C ATOM 1954 CB BGLU A 110 36.413 -30.084 0.437 0.47 16.27 C ANISOU 1954 CB BGLU A 110 1822 1921 2437 98 -174 235 C ATOM 1955 CG AGLU A 110 37.988 -30.142 0.431 0.53 12.80 C ANISOU 1955 CG AGLU A 110 1307 1461 2096 142 -196 250 C ATOM 1956 CG BGLU A 110 37.896 -29.739 0.276 0.47 13.04 C ANISOU 1956 CG BGLU A 110 1332 1507 2116 132 -190 242 C ATOM 1957 CD AGLU A 110 38.633 -31.517 0.521 0.53 19.65 C ANISOU 1957 CD AGLU A 110 2167 2269 3030 190 -194 271 C ATOM 1958 CD BGLU A 110 38.493 -29.030 1.485 0.47 22.60 C ANISOU 1958 CD BGLU A 110 2521 2731 3334 132 -285 273 C ATOM 1959 OE1AGLU A 110 37.994 -32.456 1.047 0.53 24.79 O ANISOU 1959 OE1AGLU A 110 2882 2893 3645 190 -207 285 O ATOM 1960 OE1BGLU A 110 37.733 -28.595 2.379 0.47 25.57 O ANISOU 1960 OE1BGLU A 110 2958 3127 3629 106 -325 282 O ATOM 1961 OE2AGLU A 110 39.785 -31.659 0.059 0.53 29.82 O ANISOU 1961 OE2AGLU A 110 3382 3534 4413 230 -173 276 O ATOM 1962 OE2BGLU A 110 39.736 -28.912 1.543 0.47 20.88 O ANISOU 1962 OE2BGLU A 110 2228 2500 3206 158 -319 292 O ATOM 0 H AGLU A 110 36.059 -29.469 -1.947 0.53 10.60 H new ATOM 0 H BGLU A 110 36.060 -29.468 -1.959 0.47 10.60 H new ATOM 0 HA AGLU A 110 36.301 -31.864 -0.779 0.53 14.47 H new ATOM 0 HA BGLU A 110 36.325 -31.816 -0.718 0.47 14.47 H new ATOM 0 HB2AGLU A 110 36.117 -29.291 0.409 0.53 16.27 H new ATOM 0 HB2BGLU A 110 35.901 -29.261 0.476 0.47 16.27 H new ATOM 0 HB3AGLU A 110 36.171 -30.580 1.285 0.53 16.27 H new ATOM 0 HB3BGLU A 110 36.285 -30.538 1.285 0.47 16.27 H new ATOM 0 HG2AGLU A 110 38.284 -29.704 -0.382 0.53 13.04 H new ATOM 0 HG2BGLU A 110 38.394 -30.555 0.111 0.47 13.04 H new ATOM 0 HG3AGLU A 110 38.294 -29.598 1.174 0.53 13.04 H new ATOM 0 HG3BGLU A 110 38.006 -29.176 -0.506 0.47 13.04 H new ATOM 1975 N ALA A 111 33.478 -30.828 -1.292 1.00 11.93 N ANISOU 1975 N ALA A 111 1386 1366 1783 14 -72 187 N ATOM 1976 CA ALA A 111 32.042 -31.010 -1.093 1.00 14.14 C ANISOU 1976 CA ALA A 111 1703 1648 2020 -28 -72 199 C ATOM 1977 C ALA A 111 31.618 -32.367 -1.647 1.00 16.54 C ANISOU 1977 C ALA A 111 2053 1896 2336 -38 -56 195 C ATOM 1978 O ALA A 111 31.556 -32.560 -2.865 1.00 25.00 O ANISOU 1978 O ALA A 111 3146 2946 3409 -51 -32 162 O ATOM 1979 CB ALA A 111 31.266 -29.880 -1.761 1.00 16.31 C ANISOU 1979 CB ALA A 111 1966 1965 2265 -65 -60 180 C ATOM 0 H ALA A 111 33.680 -30.411 -2.017 1.00 11.93 H new ATOM 0 HA ALA A 111 31.843 -30.986 -0.144 1.00 14.14 H new ATOM 0 HB1 ALA A 111 30.315 -30.013 -1.621 1.00 16.31 H new ATOM 0 HB2 ALA A 111 31.533 -29.031 -1.375 1.00 16.31 H new ATOM 0 HB3 ALA A 111 31.455 -29.876 -2.712 1.00 16.31 H new ATOM 1985 N GLY A 112 31.317 -33.300 -0.751 1.00 18.76 N ANISOU 1985 N GLY A 112 2363 2146 2621 -35 -72 230 N ATOM 1986 CA GLY A 112 30.929 -34.642 -1.137 1.00 23.21 C ANISOU 1986 CA GLY A 112 2974 2646 3198 -47 -64 231 C ATOM 1987 C GLY A 112 29.441 -34.912 -1.027 1.00 28.02 C ANISOU 1987 C GLY A 112 3604 3249 3791 -105 -68 254 C ATOM 1988 O GLY A 112 28.894 -35.700 -1.803 1.00 26.62 O ANISOU 1988 O GLY A 112 3465 3025 3624 -138 -69 243 O ATOM 0 H GLY A 112 31.333 -33.169 0.099 1.00 18.76 H new ATOM 0 HA2 GLY A 112 31.210 -34.799 -2.052 1.00 23.21 H new ATOM 0 HA3 GLY A 112 31.405 -35.279 -0.581 1.00 23.21 H new ATOM 1992 N ASP A 113 28.768 -34.282 -0.067 1.00 15.13 N ANISOU 1992 N ASP A 113 1952 1657 2139 -119 -69 289 N ATOM 1993 CA ASP A 113 27.329 -34.465 0.055 1.00 19.67 C ANISOU 1993 CA ASP A 113 2527 2227 2719 -173 -61 320 C ATOM 1994 C ASP A 113 26.610 -33.723 -1.061 1.00 18.97 C ANISOU 1994 C ASP A 113 2412 2163 2635 -214 -66 295 C ATOM 1995 O ASP A 113 27.063 -32.679 -1.532 1.00 15.29 O ANISOU 1995 O ASP A 113 1921 1736 2150 -199 -66 264 O ATOM 1996 CB ASP A 113 26.829 -33.972 1.411 1.00 16.69 C ANISOU 1996 CB ASP A 113 2142 1881 2320 -167 -41 366 C ATOM 1997 CG ASP A 113 27.308 -34.833 2.540 1.00 22.50 C ANISOU 1997 CG ASP A 113 2923 2581 3043 -138 -45 401 C ATOM 1998 OD1 ASP A 113 27.959 -35.858 2.241 1.00 23.40 O ANISOU 1998 OD1 ASP A 113 3064 2646 3179 -122 -64 391 O ATOM 1999 OD2 ASP A 113 27.045 -34.494 3.715 1.00 19.34 O ANISOU 1999 OD2 ASP A 113 2542 2196 2609 -128 -26 438 O ATOM 0 H ASP A 113 29.120 -33.754 0.513 1.00 15.13 H new ATOM 0 HA ASP A 113 27.138 -35.413 -0.016 1.00 19.67 H new ATOM 0 HB2 ASP A 113 27.129 -33.060 1.552 1.00 16.69 H new ATOM 0 HB3 ASP A 113 25.859 -33.954 1.409 1.00 16.69 H new ATOM 2004 N ALA A 114 25.468 -34.274 -1.477 1.00 16.32 N ANISOU 2004 N ALA A 114 2079 1796 2327 -269 -78 314 N ATOM 2005 CA ALA A 114 24.724 -33.681 -2.583 1.00 21.98 C ANISOU 2005 CA ALA A 114 2776 2523 3052 -314 -103 296 C ATOM 2006 C ALA A 114 24.279 -32.261 -2.262 1.00 18.42 C ANISOU 2006 C ALA A 114 2265 2138 2596 -309 -86 309 C ATOM 2007 O ALA A 114 24.359 -31.373 -3.118 1.00 17.05 O ANISOU 2007 O ALA A 114 2080 1991 2408 -314 -102 278 O ATOM 2008 CB ALA A 114 23.518 -34.553 -2.934 1.00 28.95 C ANISOU 2008 CB ALA A 114 3665 3355 3981 -380 -134 326 C ATOM 0 H ALA A 114 25.114 -34.980 -1.137 1.00 16.32 H new ATOM 0 HA ALA A 114 25.316 -33.635 -3.350 1.00 21.98 H new ATOM 0 HB1 ALA A 114 23.031 -34.150 -3.670 1.00 28.95 H new ATOM 0 HB2 ALA A 114 23.822 -35.437 -3.193 1.00 28.95 H new ATOM 0 HB3 ALA A 114 22.935 -34.626 -2.162 1.00 28.95 H new ATOM 2014 N AGLU A 115 23.828 -32.030 -1.025 0.53 16.41 N ANISOU 2014 N AGLU A 115 1983 1906 2347 -297 -50 354 N ATOM 2015 N BGLU A 115 23.793 -32.011 -1.043 0.47 17.00 N ANISOU 2015 N BGLU A 115 2056 1981 2423 -299 -50 354 N ATOM 2016 CA AGLU A 115 23.321 -30.718 -0.638 0.53 17.93 C ANISOU 2016 CA AGLU A 115 2127 2150 2534 -288 -24 368 C ATOM 2017 CA BGLU A 115 23.309 -30.666 -0.741 0.47 19.30 C ANISOU 2017 CA BGLU A 115 2300 2325 2709 -290 -27 366 C ATOM 2018 C AGLU A 115 24.402 -29.648 -0.746 0.53 25.86 C ANISOU 2018 C AGLU A 115 3139 3196 3491 -246 -26 325 C ATOM 2019 C BGLU A 115 24.432 -29.639 -0.835 0.47 26.24 C ANISOU 2019 C BGLU A 115 3187 3245 3539 -247 -28 322 C ATOM 2020 O AGLU A 115 24.127 -28.514 -1.156 0.53 21.67 O ANISOU 2020 O AGLU A 115 2577 2701 2957 -249 -27 313 O ATOM 2021 O BGLU A 115 24.225 -28.534 -1.348 0.47 22.26 O ANISOU 2021 O BGLU A 115 2654 2774 3031 -251 -33 306 O ATOM 2022 CB AGLU A 115 22.767 -30.778 0.787 0.53 34.05 C ANISOU 2022 CB AGLU A 115 4165 4195 4577 -274 32 423 C ATOM 2023 CB BGLU A 115 22.648 -30.614 0.637 0.47 30.76 C ANISOU 2023 CB BGLU A 115 3738 3783 4165 -278 30 421 C ATOM 2024 CG AGLU A 115 21.449 -31.545 0.929 0.53 36.38 C ANISOU 2024 CG AGLU A 115 4427 4456 4939 -322 50 480 C ATOM 2025 CG BGLU A 115 21.141 -30.898 0.610 0.47 35.15 C ANISOU 2025 CG BGLU A 115 4241 4321 4794 -327 48 476 C ATOM 2026 CD AGLU A 115 21.589 -33.052 0.744 0.53 29.93 C ANISOU 2026 CD AGLU A 115 3650 3579 4142 -349 21 486 C ATOM 2027 CD BGLU A 115 20.338 -30.009 1.553 0.47 38.99 C ANISOU 2027 CD BGLU A 115 4688 4835 5291 -307 121 520 C ATOM 2028 OE1AGLU A 115 22.673 -33.619 1.028 0.53 13.70 O ANISOU 2028 OE1AGLU A 115 1654 1508 2045 -315 12 463 O ATOM 2029 OE1BGLU A 115 20.936 -29.192 2.289 0.47 31.56 O ANISOU 2029 OE1BGLU A 115 3780 3924 4286 -258 154 505 O ATOM 2030 OE2AGLU A 115 20.594 -33.673 0.316 0.53 29.49 O ANISOU 2030 OE2AGLU A 115 3564 3488 4152 -406 3 518 O ATOM 2031 OE2BGLU A 115 19.093 -30.128 1.553 0.47 37.09 O ANISOU 2031 OE2BGLU A 115 4384 4582 5127 -342 146 572 O ATOM 0 H AGLU A 115 23.809 -32.620 -0.400 0.53 17.00 H new ATOM 0 H BGLU A 115 23.736 -32.582 -0.402 0.47 17.00 H new ATOM 0 HA AGLU A 115 22.608 -30.475 -1.249 0.53 19.30 H new ATOM 0 HA BGLU A 115 22.640 -30.442 -1.407 0.47 19.30 H new ATOM 0 HB2AGLU A 115 23.431 -31.190 1.362 0.53 30.76 H new ATOM 0 HB2BGLU A 115 23.080 -31.259 1.219 0.47 30.76 H new ATOM 0 HB3AGLU A 115 22.636 -29.872 1.109 0.53 30.76 H new ATOM 0 HB3BGLU A 115 22.797 -29.738 1.025 0.47 30.76 H new ATOM 0 HG2AGLU A 115 21.075 -31.369 1.807 0.53 35.15 H new ATOM 0 HG2BGLU A 115 20.813 -30.778 -0.295 0.47 35.15 H new ATOM 0 HG3AGLU A 115 20.815 -31.205 0.278 0.53 35.15 H new ATOM 0 HG3BGLU A 115 20.990 -31.827 0.845 0.47 35.15 H new ATOM 2044 N SER A 116 25.636 -29.983 -0.368 1.00 12.23 N ANISOU 2044 N SER A 116 1447 1463 1735 -208 -30 305 N ATOM 2045 CA SER A 116 26.730 -29.019 -0.456 1.00 9.48 C ANISOU 2045 CA SER A 116 1096 1149 1358 -173 -38 270 C ATOM 2046 C SER A 116 27.260 -28.913 -1.882 1.00 10.24 C ANISOU 2046 C SER A 116 1191 1240 1460 -182 -55 225 C ATOM 2047 O SER A 116 27.508 -27.810 -2.377 1.00 13.20 O ANISOU 2047 O SER A 116 1547 1647 1821 -179 -56 202 O ATOM 2048 CB SER A 116 27.855 -29.399 0.509 1.00 18.45 C ANISOU 2048 CB SER A 116 2259 2274 2477 -130 -47 276 C ATOM 2049 OG SER A 116 28.427 -30.645 0.167 1.00 23.75 O ANISOU 2049 OG SER A 116 2952 2900 3172 -123 -58 269 O ATOM 0 H ASER A 116 25.858 -30.755 -0.061 0.53 12.23 H new ATOM 0 H BSER A 116 25.833 -30.740 -0.010 0.47 12.23 H new ATOM 0 HA SER A 116 26.384 -28.149 -0.203 1.00 9.48 H new ATOM 0 HB2 SER A 116 28.540 -28.712 0.497 1.00 18.45 H new ATOM 0 HB3 SER A 116 27.508 -29.438 1.414 1.00 18.45 H new ATOM 0 HG SER A 116 27.875 -31.094 -0.280 1.00 23.75 H new ATOM 2055 N ARG A 117 27.439 -30.044 -2.564 1.00 12.84 N ANISOU 2055 N ARG A 117 1551 1521 1804 -192 -63 212 N ATOM 2056 CA ARG A 117 28.018 -29.983 -3.900 1.00 12.65 C ANISOU 2056 CA ARG A 117 1550 1484 1774 -194 -64 168 C ATOM 2057 C ARG A 117 27.096 -29.244 -4.861 1.00 12.39 C ANISOU 2057 C ARG A 117 1513 1465 1731 -238 -83 159 C ATOM 2058 O ARG A 117 27.547 -28.392 -5.637 1.00 10.56 O ANISOU 2058 O ARG A 117 1283 1252 1478 -234 -78 130 O ATOM 2059 CB ARG A 117 28.318 -31.383 -4.413 1.00 14.34 C ANISOU 2059 CB ARG A 117 1817 1633 1999 -194 -64 154 C ATOM 2060 CG ARG A 117 29.128 -31.352 -5.664 1.00 21.17 C ANISOU 2060 CG ARG A 117 2719 2475 2848 -181 -44 108 C ATOM 2061 CD ARG A 117 29.777 -32.677 -5.970 1.00 29.20 C ANISOU 2061 CD ARG A 117 3792 3425 3878 -157 -24 92 C ATOM 2062 NE ARG A 117 30.721 -32.507 -7.067 1.00 27.83 N ANISOU 2062 NE ARG A 117 3652 3232 3690 -130 20 50 N ATOM 2063 CZ ARG A 117 31.987 -32.131 -6.917 1.00 27.38 C ANISOU 2063 CZ ARG A 117 3553 3191 3659 -76 62 44 C ATOM 2064 NH1 ARG A 117 32.486 -31.900 -5.706 1.00 28.57 N ANISOU 2064 NH1 ARG A 117 3634 3376 3847 -46 48 74 N ATOM 2065 NH2 ARG A 117 32.756 -31.992 -7.986 1.00 33.12 N ANISOU 2065 NH2 ARG A 117 4311 3895 4378 -54 118 10 N ATOM 0 H ARG A 117 27.239 -30.831 -2.281 1.00 12.84 H new ATOM 0 HA ARG A 117 28.851 -29.489 -3.847 1.00 12.65 H new ATOM 0 HB2 ARG A 117 28.795 -31.882 -3.731 1.00 14.34 H new ATOM 0 HB3 ARG A 117 27.485 -31.852 -4.578 1.00 14.34 H new ATOM 0 HG2 ARG A 117 28.559 -31.096 -6.407 1.00 21.17 H new ATOM 0 HG3 ARG A 117 29.814 -30.671 -5.584 1.00 21.17 H new ATOM 0 HD2 ARG A 117 30.235 -33.014 -5.184 1.00 29.20 H new ATOM 0 HD3 ARG A 117 29.103 -33.332 -6.208 1.00 29.20 H new ATOM 0 HE ARG A 117 30.440 -32.660 -7.865 1.00 27.83 H new ATOM 0 HH11 ARG A 117 31.988 -31.994 -5.011 1.00 28.57 H new ATOM 0 HH12 ARG A 117 33.306 -31.657 -5.618 1.00 28.57 H new ATOM 0 HH21 ARG A 117 32.435 -32.145 -8.769 1.00 33.12 H new ATOM 0 HH22 ARG A 117 33.576 -31.749 -7.897 1.00 33.12 H new ATOM 2079 N VAL A 118 25.797 -29.554 -4.817 1.00 10.72 N ANISOU 2079 N VAL A 118 1292 1239 1541 -282 -107 189 N ATOM 2080 CA VAL A 118 24.824 -28.862 -5.655 1.00 9.50 C ANISOU 2080 CA VAL A 118 1124 1094 1392 -325 -141 192 C ATOM 2081 C VAL A 118 24.787 -27.379 -5.316 1.00 8.58 C ANISOU 2081 C VAL A 118 957 1036 1266 -306 -125 197 C ATOM 2082 O VAL A 118 24.712 -26.521 -6.206 1.00 9.83 O ANISOU 2082 O VAL A 118 1119 1208 1408 -318 -143 178 O ATOM 2083 CB VAL A 118 23.438 -29.512 -5.498 1.00 10.97 C ANISOU 2083 CB VAL A 118 1287 1252 1627 -375 -172 237 C ATOM 2084 CG1 VAL A 118 22.373 -28.678 -6.210 1.00 12.90 C ANISOU 2084 CG1 VAL A 118 1497 1509 1896 -417 -216 252 C ATOM 2085 CG2 VAL A 118 23.447 -30.951 -6.018 1.00 13.58 C ANISOU 2085 CG2 VAL A 118 1682 1514 1963 -405 -201 227 C ATOM 0 H VAL A 118 25.463 -30.162 -4.308 1.00 10.72 H new ATOM 0 HA VAL A 118 25.091 -28.942 -6.584 1.00 9.50 H new ATOM 0 HB VAL A 118 23.220 -29.541 -4.553 1.00 10.97 H new ATOM 0 HG11 VAL A 118 21.506 -29.100 -6.102 1.00 12.90 H new ATOM 0 HG12 VAL A 118 22.349 -27.788 -5.826 1.00 12.90 H new ATOM 0 HG13 VAL A 118 22.587 -28.617 -7.154 1.00 12.90 H new ATOM 0 HG21 VAL A 118 22.565 -31.340 -5.909 1.00 13.58 H new ATOM 0 HG22 VAL A 118 23.688 -30.954 -6.958 1.00 13.58 H new ATOM 0 HG23 VAL A 118 24.094 -31.472 -5.517 1.00 13.58 H new ATOM 2095 N APHE A 119 24.832 -27.051 -4.024 0.63 10.06 N ANISOU 2095 N APHE A 119 1111 1253 1458 -275 -91 222 N ATOM 2096 N BPHE A 119 24.837 -27.053 -4.021 0.37 9.62 N ANISOU 2096 N BPHE A 119 1056 1197 1402 -275 -91 222 N ATOM 2097 CA APHE A 119 24.813 -25.650 -3.618 0.63 8.08 C ANISOU 2097 CA APHE A 119 829 1049 1194 -254 -74 224 C ATOM 2098 CA BPHE A 119 24.819 -25.656 -3.594 0.37 8.08 C ANISOU 2098 CA BPHE A 119 829 1049 1194 -253 -74 225 C ATOM 2099 C APHE A 119 25.971 -24.880 -4.241 0.63 7.75 C ANISOU 2099 C APHE A 119 802 1024 1117 -234 -76 181 C ATOM 2100 C BPHE A 119 25.971 -24.876 -4.217 0.37 7.83 C ANISOU 2100 C BPHE A 119 812 1035 1127 -234 -76 181 C ATOM 2101 O APHE A 119 25.785 -23.780 -4.779 0.63 7.84 O ANISOU 2101 O APHE A 119 801 1058 1119 -241 -84 172 O ATOM 2102 O BPHE A 119 25.781 -23.767 -4.733 0.37 8.53 O ANISOU 2102 O BPHE A 119 888 1147 1207 -240 -83 173 O ATOM 2103 CB APHE A 119 24.864 -25.557 -2.094 0.63 9.03 C ANISOU 2103 CB APHE A 119 942 1183 1305 -220 -37 252 C ATOM 2104 CB BPHE A 119 24.884 -25.591 -2.065 0.37 8.97 C ANISOU 2104 CB BPHE A 119 935 1174 1297 -220 -37 252 C ATOM 2105 CG APHE A 119 24.793 -24.159 -1.577 0.63 11.17 C ANISOU 2105 CG APHE A 119 1198 1491 1556 -197 -17 253 C ATOM 2106 CG BPHE A 119 24.520 -24.252 -1.489 0.37 14.76 C ANISOU 2106 CG BPHE A 119 1648 1942 2018 -201 -13 263 C ATOM 2107 CD1APHE A 119 25.944 -23.400 -1.437 0.63 15.09 C ANISOU 2107 CD1APHE A 119 1712 2006 2016 -170 -24 223 C ATOM 2108 CD1BPHE A 119 23.246 -24.024 -0.989 0.37 13.69 C ANISOU 2108 CD1BPHE A 119 1480 1808 1914 -207 20 305 C ATOM 2109 CD2APHE A 119 23.575 -23.600 -1.228 0.63 12.75 C ANISOU 2109 CD2APHE A 119 1365 1700 1781 -202 10 288 C ATOM 2110 CD2BPHE A 119 25.453 -23.231 -1.424 0.37 15.60 C ANISOU 2110 CD2BPHE A 119 1766 2073 2088 -176 -18 233 C ATOM 2111 CE1APHE A 119 25.880 -22.108 -0.956 0.63 12.41 C ANISOU 2111 CE1APHE A 119 1370 1690 1653 -152 -12 222 C ATOM 2112 CE1BPHE A 119 22.908 -22.800 -0.445 0.37 8.23 C ANISOU 2112 CE1BPHE A 119 778 1139 1209 -181 53 314 C ATOM 2113 CE2APHE A 119 23.509 -22.313 -0.746 0.63 19.82 C ANISOU 2113 CE2APHE A 119 2257 2619 2654 -175 35 287 C ATOM 2114 CE2BPHE A 119 25.119 -22.001 -0.881 0.37 9.29 C ANISOU 2114 CE2BPHE A 119 962 1296 1272 -158 3 240 C ATOM 2115 CZ APHE A 119 24.662 -21.568 -0.612 0.63 9.58 C ANISOU 2115 CZ APHE A 119 993 1338 1310 -152 20 251 C ATOM 2116 CZ BPHE A 119 23.845 -21.788 -0.391 0.37 11.77 C ANISOU 2116 CZ BPHE A 119 1254 1609 1610 -157 42 278 C ATOM 0 H APHE A 119 24.873 -27.617 -3.377 0.63 9.62 H new ATOM 0 H BPHE A 119 24.881 -27.624 -3.380 0.37 9.62 H new ATOM 0 HA APHE A 119 23.989 -25.247 -3.935 0.63 8.08 H new ATOM 0 HA BPHE A 119 23.993 -25.246 -3.897 0.37 8.08 H new ATOM 0 HB2APHE A 119 24.129 -26.069 -1.722 0.63 8.97 H new ATOM 0 HB2BPHE A 119 24.288 -26.263 -1.697 0.37 8.97 H new ATOM 0 HB3APHE A 119 25.684 -25.969 -1.780 0.63 8.97 H new ATOM 0 HB3BPHE A 119 25.782 -25.821 -1.780 0.37 8.97 H new ATOM 0 HD1APHE A 119 26.767 -23.765 -1.669 0.63 13.69 H new ATOM 0 HD1BPHE A 119 22.612 -24.704 -1.020 0.37 13.69 H new ATOM 0 HD2APHE A 119 22.795 -24.099 -1.320 0.63 15.60 H new ATOM 0 HD2BPHE A 119 26.313 -23.372 -1.748 0.37 15.60 H new ATOM 0 HE1APHE A 119 26.657 -21.605 -0.865 0.63 8.23 H new ATOM 0 HE1BPHE A 119 22.050 -22.658 -0.116 0.37 8.23 H new ATOM 0 HE2APHE A 119 22.688 -21.946 -0.511 0.63 9.29 H new ATOM 0 HE2BPHE A 119 25.751 -21.320 -0.846 0.37 9.29 H new ATOM 0 HZ APHE A 119 24.616 -20.697 -0.288 0.63 11.77 H new ATOM 0 HZ BPHE A 119 23.619 -20.963 -0.025 0.37 11.77 H new ATOM 2135 N TYR A 120 27.181 -25.442 -4.178 1.00 8.01 N ANISOU 2135 N TYR A 120 859 1045 1141 -209 -67 159 N ATOM 2136 CA TYR A 120 28.344 -24.729 -4.694 1.00 7.57 C ANISOU 2136 CA TYR A 120 804 1003 1069 -190 -58 127 C ATOM 2137 C TYR A 120 28.338 -24.671 -6.215 1.00 7.66 C ANISOU 2137 C TYR A 120 848 997 1067 -214 -61 99 C ATOM 2138 O TYR A 120 28.740 -23.658 -6.800 1.00 8.73 O ANISOU 2138 O TYR A 120 982 1151 1185 -214 -53 82 O ATOM 2139 CB TYR A 120 29.633 -25.380 -4.196 1.00 7.71 C ANISOU 2139 CB TYR A 120 824 1007 1100 -153 -47 121 C ATOM 2140 CG TYR A 120 29.853 -25.259 -2.699 1.00 10.14 C ANISOU 2140 CG TYR A 120 1116 1328 1407 -128 -57 147 C ATOM 2141 CD1 TYR A 120 29.651 -24.051 -2.036 1.00 12.17 C ANISOU 2141 CD1 TYR A 120 1362 1619 1643 -125 -64 154 C ATOM 2142 CD2 TYR A 120 30.256 -26.357 -1.948 1.00 9.45 C ANISOU 2142 CD2 TYR A 120 1042 1214 1333 -107 -63 163 C ATOM 2143 CE1 TYR A 120 29.842 -23.946 -0.670 1.00 10.57 C ANISOU 2143 CE1 TYR A 120 1173 1420 1424 -104 -77 176 C ATOM 2144 CE2 TYR A 120 30.453 -26.259 -0.583 1.00 8.11 C ANISOU 2144 CE2 TYR A 120 880 1051 1151 -87 -81 189 C ATOM 2145 CZ TYR A 120 30.252 -25.054 0.048 1.00 9.41 C ANISOU 2145 CZ TYR A 120 1044 1246 1284 -86 -88 194 C ATOM 2146 OH TYR A 120 30.446 -24.958 1.403 1.00 12.59 O ANISOU 2146 OH TYR A 120 1479 1645 1658 -67 -108 217 O ATOM 0 H ATYR A 120 27.345 -26.219 -3.847 0.63 8.01 H new ATOM 0 H BTYR A 120 27.345 -26.225 -3.862 0.37 8.01 H new ATOM 0 HA TYR A 120 28.300 -23.819 -4.362 1.00 7.57 H new ATOM 0 HB2 TYR A 120 29.623 -26.320 -4.436 1.00 7.71 H new ATOM 0 HB3 TYR A 120 30.386 -24.978 -4.657 1.00 7.71 H new ATOM 0 HD1 TYR A 120 29.383 -23.303 -2.519 1.00 12.17 H new ATOM 0 HD2 TYR A 120 30.396 -27.173 -2.372 1.00 9.45 H new ATOM 0 HE1 TYR A 120 29.696 -23.136 -0.238 1.00 10.57 H new ATOM 0 HE2 TYR A 120 30.720 -27.004 -0.094 1.00 8.11 H new ATOM 0 HH TYR A 120 30.819 -25.656 1.683 1.00 12.59 H new ATOM 2156 N LEU A 121 27.913 -25.751 -6.878 1.00 10.96 N ANISOU 2156 N LEU A 121 1309 1372 1485 -238 -72 94 N ATOM 2157 CA LEU A 121 27.872 -25.738 -8.334 1.00 11.95 C ANISOU 2157 CA LEU A 121 1492 1468 1579 -263 -80 66 C ATOM 2158 C LEU A 121 26.829 -24.755 -8.844 1.00 10.28 C ANISOU 2158 C LEU A 121 1273 1276 1358 -300 -121 77 C ATOM 2159 O LEU A 121 27.036 -24.107 -9.875 1.00 12.66 O ANISOU 2159 O LEU A 121 1612 1573 1624 -311 -122 56 O ATOM 2160 CB LEU A 121 27.593 -27.138 -8.871 1.00 10.15 C ANISOU 2160 CB LEU A 121 1330 1180 1348 -284 -94 57 C ATOM 2161 CG LEU A 121 28.771 -28.114 -8.798 1.00 14.68 C ANISOU 2161 CG LEU A 121 1932 1718 1927 -243 -46 37 C ATOM 2162 CD1 LEU A 121 28.290 -29.541 -9.057 1.00 14.20 C ANISOU 2162 CD1 LEU A 121 1935 1593 1868 -265 -68 35 C ATOM 2163 CD2 LEU A 121 29.848 -27.707 -9.797 1.00 16.83 C ANISOU 2163 CD2 LEU A 121 2243 1980 2171 -219 6 0 C ATOM 0 H LEU A 121 27.651 -26.483 -6.510 1.00 10.96 H new ATOM 0 HA LEU A 121 28.740 -25.448 -8.656 1.00 11.95 H new ATOM 0 HB2 LEU A 121 26.848 -27.515 -8.377 1.00 10.15 H new ATOM 0 HB3 LEU A 121 27.311 -27.063 -9.796 1.00 10.15 H new ATOM 0 HG LEU A 121 29.156 -28.084 -7.908 1.00 14.68 H new ATOM 0 HD11 LEU A 121 29.043 -30.150 -9.009 1.00 14.20 H new ATOM 0 HD12 LEU A 121 27.632 -29.787 -8.388 1.00 14.20 H new ATOM 0 HD13 LEU A 121 27.889 -29.593 -9.939 1.00 14.20 H new ATOM 0 HD21 LEU A 121 30.590 -28.330 -9.745 1.00 16.83 H new ATOM 0 HD22 LEU A 121 29.479 -27.719 -10.694 1.00 16.83 H new ATOM 0 HD23 LEU A 121 30.161 -26.813 -9.589 1.00 16.83 H new ATOM 2175 N LYS A 122 25.691 -24.648 -8.151 1.00 8.12 N ANISOU 2175 N LYS A 122 949 1017 1119 -317 -150 115 N ATOM 2176 CA LYS A 122 24.726 -23.600 -8.472 1.00 9.74 C ANISOU 2176 CA LYS A 122 1126 1242 1333 -340 -185 135 C ATOM 2177 C LYS A 122 25.366 -22.222 -8.355 1.00 13.17 C ANISOU 2177 C LYS A 122 1541 1717 1746 -311 -157 122 C ATOM 2178 O LYS A 122 25.200 -21.374 -9.236 1.00 10.89 O ANISOU 2178 O LYS A 122 1271 1431 1436 -327 -178 115 O ATOM 2179 CB LYS A 122 23.505 -23.693 -7.554 1.00 11.19 C ANISOU 2179 CB LYS A 122 1242 1434 1574 -350 -196 184 C ATOM 2180 CG LYS A 122 22.508 -22.542 -7.710 1.00 11.85 C ANISOU 2180 CG LYS A 122 1278 1538 1686 -361 -221 212 C ATOM 2181 CD LYS A 122 21.438 -22.607 -6.636 1.00 12.50 C ANISOU 2181 CD LYS A 122 1286 1629 1834 -356 -201 265 C ATOM 2182 CE LYS A 122 20.448 -21.448 -6.724 1.00 15.51 C ANISOU 2182 CE LYS A 122 1608 2026 2259 -355 -213 298 C ATOM 2183 NZ LYS A 122 21.074 -20.135 -6.403 1.00 15.42 N ANISOU 2183 NZ LYS A 122 1602 2049 2207 -313 -175 276 N ATOM 0 H LYS A 122 25.464 -25.165 -7.502 1.00 8.12 H new ATOM 0 HA LYS A 122 24.437 -23.729 -9.389 1.00 9.74 H new ATOM 0 HB2 LYS A 122 23.046 -24.530 -7.728 1.00 11.19 H new ATOM 0 HB3 LYS A 122 23.808 -23.722 -6.633 1.00 11.19 H new ATOM 0 HG2 LYS A 122 22.976 -21.694 -7.656 1.00 11.85 H new ATOM 0 HG3 LYS A 122 22.095 -22.583 -8.587 1.00 11.85 H new ATOM 0 HD2 LYS A 122 20.957 -23.446 -6.714 1.00 12.50 H new ATOM 0 HD3 LYS A 122 21.860 -22.602 -5.763 1.00 12.50 H new ATOM 0 HE2 LYS A 122 20.074 -21.414 -7.618 1.00 15.51 H new ATOM 0 HE3 LYS A 122 19.711 -21.609 -6.114 1.00 15.51 H new ATOM 0 HZ1 LYS A 122 20.439 -19.518 -6.310 1.00 15.42 H new ATOM 0 HZ2 LYS A 122 21.535 -20.203 -5.645 1.00 15.42 H new ATOM 0 HZ3 LYS A 122 21.623 -19.898 -7.063 1.00 15.42 H new ATOM 2197 N MET A 123 26.076 -21.971 -7.250 1.00 10.39 N ANISOU 2197 N MET A 123 1158 1393 1398 -273 -117 123 N ATOM 2198 CA AMET A 123 26.765 -20.694 -7.088 0.62 9.07 C ANISOU 2198 CA AMET A 123 977 1256 1213 -251 -98 110 C ATOM 2199 CA BMET A 123 26.762 -20.696 -7.088 0.38 9.67 C ANISOU 2199 CA BMET A 123 1053 1332 1289 -251 -98 111 C ATOM 2200 C MET A 123 27.726 -20.449 -8.241 1.00 7.83 C ANISOU 2200 C MET A 123 860 1088 1027 -256 -86 78 C ATOM 2201 O MET A 123 27.798 -19.335 -8.777 1.00 8.26 O ANISOU 2201 O MET A 123 919 1155 1063 -262 -88 72 O ATOM 2202 CB AMET A 123 27.526 -20.654 -5.760 0.62 10.93 C ANISOU 2202 CB AMET A 123 1190 1510 1454 -215 -74 114 C ATOM 2203 CB BMET A 123 27.498 -20.677 -5.748 0.38 11.26 C ANISOU 2203 CB BMET A 123 1232 1551 1497 -215 -74 115 C ATOM 2204 CG AMET A 123 26.663 -20.488 -4.518 0.62 10.54 C ANISOU 2204 CG AMET A 123 1117 1472 1416 -202 -68 146 C ATOM 2205 CG BMET A 123 27.890 -19.298 -5.267 0.38 16.76 C ANISOU 2205 CG BMET A 123 1913 2274 2180 -198 -69 111 C ATOM 2206 SD AMET A 123 27.659 -20.172 -3.044 0.62 10.73 S ANISOU 2206 SD AMET A 123 1147 1508 1421 -164 -56 146 S ATOM 2207 SD BMET A 123 28.458 -19.315 -3.555 0.38 12.17 S ANISOU 2207 SD BMET A 123 1328 1701 1595 -164 -63 123 S ATOM 2208 CE AMET A 123 28.209 -18.505 -3.379 0.62 13.27 C ANISOU 2208 CE AMET A 123 1466 1850 1725 -162 -63 125 C ATOM 2209 CE BMET A 123 28.341 -17.572 -3.156 0.38 23.30 C ANISOU 2209 CE BMET A 123 2740 3130 2983 -156 -66 121 C ATOM 0 H AMET A 123 26.168 -22.520 -6.594 0.62 10.39 H new ATOM 0 H BMET A 123 26.169 -22.520 -6.594 0.38 10.39 H new ATOM 0 HA AMET A 123 26.095 -19.993 -7.086 0.62 9.67 H new ATOM 0 HA BMET A 123 26.106 -19.982 -7.096 0.38 9.67 H new ATOM 0 HB2AMET A 123 28.037 -21.474 -5.673 0.62 11.26 H new ATOM 0 HB2BMET A 123 26.935 -21.093 -5.077 0.38 11.26 H new ATOM 0 HB3AMET A 123 28.164 -19.924 -5.792 0.62 11.26 H new ATOM 0 HB3BMET A 123 28.298 -21.220 -5.824 0.38 11.26 H new ATOM 0 HG2AMET A 123 26.042 -19.755 -4.652 0.62 16.76 H new ATOM 0 HG2BMET A 123 28.592 -18.945 -5.836 0.38 16.76 H new ATOM 0 HG3AMET A 123 26.132 -21.289 -4.384 0.62 16.76 H new ATOM 0 HG3BMET A 123 27.131 -18.700 -5.349 0.38 16.76 H new ATOM 0 HE1AMET A 123 28.460 -18.073 -2.547 0.62 23.30 H new ATOM 0 HE1BMET A 123 28.232 -17.466 -2.198 0.38 23.30 H new ATOM 0 HE2AMET A 123 28.975 -18.530 -3.973 0.62 23.30 H new ATOM 0 HE2BMET A 123 29.150 -17.120 -3.441 0.38 23.30 H new ATOM 0 HE3AMET A 123 27.491 -18.005 -3.798 0.62 23.30 H new ATOM 0 HE3BMET A 123 27.577 -17.186 -3.613 0.38 23.30 H new ATOM 2228 N LYS A 124 28.475 -21.480 -8.638 1.00 7.38 N ANISOU 2228 N LYS A 124 837 1003 965 -250 -64 59 N ATOM 2229 CA LYS A 124 29.412 -21.321 -9.741 1.00 8.64 C ANISOU 2229 CA LYS A 124 1040 1145 1098 -249 -29 30 C ATOM 2230 C LYS A 124 28.679 -20.923 -11.017 1.00 8.07 C ANISOU 2230 C LYS A 124 1030 1054 983 -286 -58 24 C ATOM 2231 O LYS A 124 29.111 -20.012 -11.731 1.00 11.11 O ANISOU 2231 O LYS A 124 1438 1443 1340 -290 -39 14 O ATOM 2232 CB LYS A 124 30.204 -22.613 -9.934 1.00 10.16 C ANISOU 2232 CB LYS A 124 1262 1300 1298 -229 8 13 C ATOM 2233 CG LYS A 124 31.276 -22.536 -11.024 1.00 12.11 C ANISOU 2233 CG LYS A 124 1556 1522 1525 -218 71 -13 C ATOM 2234 CD LYS A 124 32.125 -23.805 -11.023 1.00 11.28 C ANISOU 2234 CD LYS A 124 1466 1377 1443 -185 120 -25 C ATOM 2235 CE LYS A 124 33.253 -23.729 -12.029 1.00 20.09 C ANISOU 2235 CE LYS A 124 2620 2464 2551 -163 205 -47 C ATOM 2236 NZ LYS A 124 34.107 -24.952 -11.958 1.00 21.48 N ANISOU 2236 NZ LYS A 124 2801 2597 2763 -120 262 -55 N ATOM 0 H LYS A 124 28.454 -22.265 -8.287 1.00 7.38 H new ATOM 0 HA LYS A 124 30.035 -20.608 -9.530 1.00 8.64 H new ATOM 0 HB2 LYS A 124 30.628 -22.849 -9.094 1.00 10.16 H new ATOM 0 HB3 LYS A 124 29.587 -23.329 -10.152 1.00 10.16 H new ATOM 0 HG2 LYS A 124 30.857 -22.421 -11.891 1.00 12.11 H new ATOM 0 HG3 LYS A 124 31.841 -21.761 -10.877 1.00 12.11 H new ATOM 0 HD2 LYS A 124 32.492 -23.948 -10.136 1.00 11.28 H new ATOM 0 HD3 LYS A 124 31.563 -24.570 -11.224 1.00 11.28 H new ATOM 0 HE2 LYS A 124 32.889 -23.634 -12.923 1.00 20.09 H new ATOM 0 HE3 LYS A 124 33.793 -22.942 -11.858 1.00 20.09 H new ATOM 0 HZ1 LYS A 124 34.535 -25.060 -12.731 1.00 21.48 H new ATOM 0 HZ2 LYS A 124 34.700 -24.863 -11.300 1.00 21.48 H new ATOM 0 HZ3 LYS A 124 33.595 -25.663 -11.801 1.00 21.48 H new ATOM 2250 N GLY A 125 27.551 -21.575 -11.305 1.00 8.73 N ANISOU 2250 N GLY A 125 1142 1113 1064 -318 -111 35 N ATOM 2251 CA GLY A 125 26.750 -21.175 -12.450 1.00 11.07 C ANISOU 2251 CA GLY A 125 1497 1387 1324 -358 -163 36 C ATOM 2252 C GLY A 125 26.243 -19.752 -12.331 1.00 8.84 C ANISOU 2252 C GLY A 125 1168 1140 1050 -361 -188 57 C ATOM 2253 O GLY A 125 26.269 -18.989 -13.299 1.00 8.45 O ANISOU 2253 O GLY A 125 1171 1081 959 -378 -201 51 O ATOM 0 H GLY A 125 27.240 -22.239 -10.856 1.00 8.73 H new ATOM 0 HA2 GLY A 125 27.280 -21.260 -13.258 1.00 11.07 H new ATOM 0 HA3 GLY A 125 25.996 -21.778 -12.540 1.00 11.07 H new ATOM 2257 N ASP A 126 25.792 -19.369 -11.134 1.00 8.91 N ANISOU 2257 N ASP A 126 1092 1185 1110 -343 -189 83 N ATOM 2258 CA ASP A 126 25.275 -18.019 -10.921 1.00 10.12 C ANISOU 2258 CA ASP A 126 1203 1365 1277 -338 -205 104 C ATOM 2259 C ASP A 126 26.334 -16.963 -11.215 1.00 10.52 C ANISOU 2259 C ASP A 126 1272 1430 1293 -323 -167 83 C ATOM 2260 O ASP A 126 26.068 -15.976 -11.915 1.00 8.87 O ANISOU 2260 O ASP A 126 1087 1219 1065 -337 -190 88 O ATOM 2261 CB ASP A 126 24.766 -17.861 -9.486 1.00 8.17 C ANISOU 2261 CB ASP A 126 878 1146 1080 -311 -190 131 C ATOM 2262 CG ASP A 126 23.480 -18.622 -9.227 1.00 9.56 C ANISOU 2262 CG ASP A 126 1018 1307 1306 -330 -225 167 C ATOM 2263 OD1 ASP A 126 22.768 -18.977 -10.197 1.00 9.80 O ANISOU 2263 OD1 ASP A 126 1074 1308 1342 -370 -285 177 O ATOM 2264 OD2 ASP A 126 23.168 -18.855 -8.041 1.00 10.93 O ANISOU 2264 OD2 ASP A 126 1143 1495 1515 -308 -194 188 O ATOM 0 H ASP A 126 25.777 -19.874 -10.438 1.00 8.91 H new ATOM 0 HA ASP A 126 24.538 -17.887 -11.537 1.00 10.12 H new ATOM 0 HB2 ASP A 126 25.449 -18.170 -8.870 1.00 8.17 H new ATOM 0 HB3 ASP A 126 24.622 -16.920 -9.301 1.00 8.17 H new ATOM 2269 N TYR A 127 27.542 -17.139 -10.682 1.00 8.87 N ANISOU 2269 N TYR A 127 1051 1234 1086 -298 -113 64 N ATOM 2270 CA TYR A 127 28.526 -16.077 -10.831 1.00 10.43 C ANISOU 2270 CA TYR A 127 1248 1444 1271 -288 -80 52 C ATOM 2271 C TYR A 127 29.147 -16.065 -12.225 1.00 9.40 C ANISOU 2271 C TYR A 127 1189 1286 1097 -306 -52 33 C ATOM 2272 O TYR A 127 29.537 -14.995 -12.701 1.00 10.25 O ANISOU 2272 O TYR A 127 1311 1396 1186 -312 -38 33 O ATOM 2273 CB TYR A 127 29.557 -16.163 -9.696 1.00 10.93 C ANISOU 2273 CB TYR A 127 1262 1526 1366 -258 -47 48 C ATOM 2274 CG TYR A 127 28.904 -15.629 -8.438 1.00 9.10 C ANISOU 2274 CG TYR A 127 989 1317 1153 -243 -71 66 C ATOM 2275 CD1 TYR A 127 28.139 -16.452 -7.629 1.00 10.13 C ANISOU 2275 CD1 TYR A 127 1100 1448 1300 -234 -82 82 C ATOM 2276 CD2 TYR A 127 28.948 -14.274 -8.138 1.00 10.06 C ANISOU 2276 CD2 TYR A 127 1100 1451 1271 -239 -77 70 C ATOM 2277 CE1 TYR A 127 27.483 -15.952 -6.519 1.00 9.66 C ANISOU 2277 CE1 TYR A 127 1017 1402 1251 -216 -86 101 C ATOM 2278 CE2 TYR A 127 28.301 -13.764 -7.038 1.00 8.56 C ANISOU 2278 CE2 TYR A 127 892 1272 1089 -220 -88 85 C ATOM 2279 CZ TYR A 127 27.567 -14.603 -6.233 1.00 11.98 C ANISOU 2279 CZ TYR A 127 1310 1706 1536 -206 -87 100 C ATOM 2280 OH TYR A 127 26.921 -14.082 -5.144 1.00 13.40 O ANISOU 2280 OH TYR A 127 1482 1890 1718 -183 -79 116 O ATOM 0 H TYR A 127 27.802 -17.835 -10.249 1.00 8.87 H new ATOM 0 HA TYR A 127 28.082 -15.218 -10.751 1.00 10.43 H new ATOM 0 HB2 TYR A 127 29.845 -17.080 -9.567 1.00 10.93 H new ATOM 0 HB3 TYR A 127 30.348 -15.646 -9.915 1.00 10.93 H new ATOM 0 HD1 TYR A 127 28.065 -17.356 -7.835 1.00 10.13 H new ATOM 0 HD2 TYR A 127 29.425 -13.700 -8.693 1.00 10.06 H new ATOM 0 HE1 TYR A 127 26.990 -16.518 -5.970 1.00 9.66 H new ATOM 0 HE2 TYR A 127 28.359 -12.857 -6.839 1.00 8.56 H new ATOM 0 HH TYR A 127 26.468 -14.684 -4.772 1.00 13.40 H new ATOM 2290 N TYR A 128 29.194 -17.200 -12.927 1.00 10.78 N ANISOU 2290 N TYR A 128 1422 1427 1247 -315 -42 19 N ATOM 2291 CA TYR A 128 29.503 -17.120 -14.353 1.00 9.96 C ANISOU 2291 CA TYR A 128 1416 1287 1082 -334 -19 3 C ATOM 2292 C TYR A 128 28.365 -16.458 -15.129 1.00 10.84 C ANISOU 2292 C TYR A 128 1579 1386 1155 -369 -93 18 C ATOM 2293 O TYR A 128 28.614 -15.740 -16.107 1.00 9.33 O ANISOU 2293 O TYR A 128 1457 1177 913 -384 -80 14 O ATOM 2294 CB TYR A 128 29.812 -18.508 -14.923 1.00 8.89 C ANISOU 2294 CB TYR A 128 1351 1106 920 -332 12 -20 C ATOM 2295 CG TYR A 128 31.262 -18.917 -14.760 1.00 11.60 C ANISOU 2295 CG TYR A 128 1673 1445 1290 -295 110 -36 C ATOM 2296 CD1 TYR A 128 32.277 -18.229 -15.420 1.00 12.84 C ANISOU 2296 CD1 TYR A 128 1850 1595 1433 -287 187 -41 C ATOM 2297 CD2 TYR A 128 31.620 -19.975 -13.942 1.00 17.77 C ANISOU 2297 CD2 TYR A 128 2407 2226 2119 -267 126 -39 C ATOM 2298 CE1 TYR A 128 33.614 -18.593 -15.271 1.00 16.74 C ANISOU 2298 CE1 TYR A 128 2305 2082 1974 -251 279 -47 C ATOM 2299 CE2 TYR A 128 32.953 -20.342 -13.784 1.00 14.96 C ANISOU 2299 CE2 TYR A 128 2018 1862 1804 -229 209 -46 C ATOM 2300 CZ TYR A 128 33.938 -19.651 -14.453 1.00 16.08 C ANISOU 2300 CZ TYR A 128 2168 1997 1945 -221 286 -48 C ATOM 2301 OH TYR A 128 35.257 -20.020 -14.303 1.00 18.48 O ANISOU 2301 OH TYR A 128 2422 2289 2310 -182 371 -47 O ATOM 0 H TYR A 128 29.057 -17.989 -12.614 1.00 10.78 H new ATOM 0 HA TYR A 128 30.294 -16.567 -14.454 1.00 9.96 H new ATOM 0 HB2 TYR A 128 29.247 -19.163 -14.485 1.00 8.89 H new ATOM 0 HB3 TYR A 128 29.583 -18.521 -15.866 1.00 8.89 H new ATOM 0 HD1 TYR A 128 32.058 -17.512 -15.971 1.00 12.84 H new ATOM 0 HD2 TYR A 128 30.959 -20.448 -13.491 1.00 17.77 H new ATOM 0 HE1 TYR A 128 34.281 -18.125 -15.720 1.00 16.74 H new ATOM 0 HE2 TYR A 128 33.178 -21.053 -13.228 1.00 14.96 H new ATOM 0 HH TYR A 128 35.749 -19.345 -14.393 1.00 18.48 H new ATOM 2311 N ARG A 129 27.114 -16.676 -14.714 1.00 9.00 N ANISOU 2311 N ARG A 129 1311 1157 951 -383 -170 40 N ATOM 2312 CA ARG A 129 26.001 -15.984 -15.360 1.00 9.62 C ANISOU 2312 CA ARG A 129 1416 1223 1015 -414 -252 64 C ATOM 2313 C ARG A 129 26.122 -14.469 -15.201 1.00 9.36 C ANISOU 2313 C ARG A 129 1349 1217 990 -401 -243 77 C ATOM 2314 O ARG A 129 25.876 -13.720 -16.152 1.00 9.30 O ANISOU 2314 O ARG A 129 1404 1188 940 -422 -276 86 O ATOM 2315 CB ARG A 129 24.667 -16.480 -14.800 1.00 8.63 C ANISOU 2315 CB ARG A 129 1230 1099 950 -426 -327 95 C ATOM 2316 CG ARG A 129 23.460 -15.670 -15.262 1.00 8.96 C ANISOU 2316 CG ARG A 129 1263 1131 1010 -450 -416 132 C ATOM 2317 CD ARG A 129 22.153 -16.451 -15.107 1.00 9.34 C ANISOU 2317 CD ARG A 129 1269 1160 1119 -477 -499 166 C ATOM 2318 NE ARG A 129 21.905 -16.836 -13.721 1.00 9.49 N ANISOU 2318 NE ARG A 129 1179 1211 1213 -448 -457 182 N ATOM 2319 CZ ARG A 129 21.260 -16.082 -12.834 1.00 12.48 C ANISOU 2319 CZ ARG A 129 1462 1620 1661 -421 -447 216 C ATOM 2320 NH1 ARG A 129 20.786 -14.893 -13.179 1.00 11.37 N ANISOU 2320 NH1 ARG A 129 1308 1480 1532 -417 -480 238 N ATOM 2321 NH2 ARG A 129 21.081 -16.522 -11.599 1.00 9.91 N ANISOU 2321 NH2 ARG A 129 1061 1315 1387 -395 -399 229 N ATOM 0 H ARG A 129 26.894 -17.208 -14.075 1.00 9.00 H new ATOM 0 HA ARG A 129 26.034 -16.185 -16.308 1.00 9.62 H new ATOM 0 HB2 ARG A 129 24.542 -17.406 -15.060 1.00 8.63 H new ATOM 0 HB3 ARG A 129 24.706 -16.460 -13.831 1.00 8.63 H new ATOM 0 HG2 ARG A 129 23.408 -14.848 -14.750 1.00 8.96 H new ATOM 0 HG3 ARG A 129 23.577 -15.418 -16.191 1.00 8.96 H new ATOM 0 HD2 ARG A 129 21.414 -15.910 -15.428 1.00 9.34 H new ATOM 0 HD3 ARG A 129 22.185 -17.246 -15.662 1.00 9.34 H new ATOM 0 HE ARG A 129 22.195 -17.602 -13.460 1.00 9.49 H new ATOM 0 HH11 ARG A 129 20.894 -14.603 -13.981 1.00 11.37 H new ATOM 0 HH12 ARG A 129 20.370 -14.411 -12.600 1.00 11.37 H new ATOM 0 HH21 ARG A 129 21.381 -17.295 -11.370 1.00 9.91 H new ATOM 0 HH22 ARG A 129 20.664 -16.035 -11.025 1.00 9.91 H new ATOM 2335 N TYR A 130 26.503 -13.997 -14.010 1.00 10.25 N ANISOU 2335 N TYR A 130 1375 1369 1151 -368 -203 80 N ATOM 2336 CA TYR A 130 26.661 -12.555 -13.817 1.00 10.72 C ANISOU 2336 CA TYR A 130 1411 1445 1215 -358 -195 90 C ATOM 2337 C TYR A 130 27.805 -12.020 -14.667 1.00 8.56 C ANISOU 2337 C TYR A 130 1199 1159 894 -367 -144 72 C ATOM 2338 O TYR A 130 27.692 -10.944 -15.266 1.00 13.56 O ANISOU 2338 O TYR A 130 1867 1783 1503 -379 -159 84 O ATOM 2339 CB TYR A 130 26.881 -12.231 -12.334 1.00 9.56 C ANISOU 2339 CB TYR A 130 1181 1333 1119 -324 -167 93 C ATOM 2340 CG TYR A 130 25.818 -12.806 -11.417 1.00 8.04 C ANISOU 2340 CG TYR A 130 931 1150 973 -310 -194 113 C ATOM 2341 CD1 TYR A 130 24.498 -12.926 -11.831 1.00 8.50 C ANISOU 2341 CD1 TYR A 130 982 1193 1053 -326 -253 142 C ATOM 2342 CD2 TYR A 130 26.141 -13.240 -10.143 1.00 10.60 C ANISOU 2342 CD2 TYR A 130 1210 1495 1324 -283 -160 109 C ATOM 2343 CE1 TYR A 130 23.533 -13.468 -11.002 1.00 10.86 C ANISOU 2343 CE1 TYR A 130 1219 1498 1408 -315 -265 168 C ATOM 2344 CE2 TYR A 130 25.188 -13.780 -9.307 1.00 11.22 C ANISOU 2344 CE2 TYR A 130 1244 1578 1441 -271 -169 132 C ATOM 2345 CZ TYR A 130 23.885 -13.887 -9.734 1.00 13.11 C ANISOU 2345 CZ TYR A 130 1466 1803 1711 -286 -214 162 C ATOM 2346 OH TYR A 130 22.940 -14.427 -8.888 1.00 12.03 O ANISOU 2346 OH TYR A 130 1275 1669 1627 -275 -211 192 O ATOM 0 H TYR A 130 26.671 -14.481 -13.319 1.00 10.25 H new ATOM 0 HA TYR A 130 25.845 -12.117 -14.104 1.00 10.72 H new ATOM 0 HB2 TYR A 130 27.748 -12.570 -12.063 1.00 9.56 H new ATOM 0 HB3 TYR A 130 26.906 -11.268 -12.222 1.00 9.56 H new ATOM 0 HD1 TYR A 130 24.258 -12.636 -12.682 1.00 8.50 H new ATOM 0 HD2 TYR A 130 27.019 -13.166 -9.845 1.00 10.60 H new ATOM 0 HE1 TYR A 130 22.654 -13.550 -11.296 1.00 10.86 H new ATOM 0 HE2 TYR A 130 25.425 -14.071 -8.456 1.00 11.22 H new ATOM 0 HH TYR A 130 22.174 -14.311 -9.213 1.00 12.03 H new ATOM 2356 N LEU A 131 28.911 -12.764 -14.751 1.00 8.57 N ANISOU 2356 N LEU A 131 1213 1156 887 -360 -77 49 N ATOM 2357 CA LEU A 131 29.958 -12.403 -15.699 1.00 8.77 C ANISOU 2357 CA LEU A 131 1299 1160 872 -369 -11 38 C ATOM 2358 C LEU A 131 29.407 -12.342 -17.118 1.00 12.40 C ANISOU 2358 C LEU A 131 1879 1578 1253 -400 -40 40 C ATOM 2359 O LEU A 131 29.743 -11.432 -17.884 1.00 9.84 O ANISOU 2359 O LEU A 131 1611 1238 889 -414 -18 47 O ATOM 2360 CB LEU A 131 31.110 -13.402 -15.615 1.00 8.43 C ANISOU 2360 CB LEU A 131 1248 1111 846 -351 69 18 C ATOM 2361 CG LEU A 131 31.951 -13.349 -14.334 1.00 8.19 C ANISOU 2361 CG LEU A 131 1108 1113 891 -324 96 19 C ATOM 2362 CD1 LEU A 131 33.007 -14.452 -14.342 1.00 14.27 C ANISOU 2362 CD1 LEU A 131 1866 1869 1688 -301 168 6 C ATOM 2363 CD2 LEU A 131 32.599 -11.996 -14.172 1.00 9.36 C ANISOU 2363 CD2 LEU A 131 1221 1273 1061 -330 113 31 C ATOM 0 H LEU A 131 29.069 -13.465 -14.278 1.00 8.57 H new ATOM 0 HA LEU A 131 30.291 -11.522 -15.468 1.00 8.77 H new ATOM 0 HB2 LEU A 131 30.746 -14.297 -15.706 1.00 8.43 H new ATOM 0 HB3 LEU A 131 31.697 -13.256 -16.373 1.00 8.43 H new ATOM 0 HG LEU A 131 31.361 -13.493 -13.578 1.00 8.19 H new ATOM 0 HD11 LEU A 131 33.530 -14.405 -13.526 1.00 14.27 H new ATOM 0 HD12 LEU A 131 32.571 -15.317 -14.397 1.00 14.27 H new ATOM 0 HD13 LEU A 131 33.591 -14.335 -15.107 1.00 14.27 H new ATOM 0 HD21 LEU A 131 33.125 -11.984 -13.357 1.00 9.36 H new ATOM 0 HD22 LEU A 131 33.176 -11.820 -14.932 1.00 9.36 H new ATOM 0 HD23 LEU A 131 31.913 -11.312 -14.123 1.00 9.36 H new ATOM 2375 N ALA A 132 28.546 -13.298 -17.483 1.00 14.05 N ANISOU 2375 N ALA A 132 2138 1764 1438 -415 -98 37 N ATOM 2376 CA ALA A 132 28.017 -13.341 -18.843 1.00 15.34 C ANISOU 2376 CA ALA A 132 2433 1877 1517 -450 -144 39 C ATOM 2377 C ALA A 132 27.131 -12.140 -19.144 1.00 13.83 C ANISOU 2377 C ALA A 132 2248 1685 1320 -468 -227 71 C ATOM 2378 O ALA A 132 27.108 -11.668 -20.286 1.00 13.58 O ANISOU 2378 O ALA A 132 2332 1615 1213 -493 -242 76 O ATOM 2379 CB ALA A 132 27.233 -14.638 -19.075 1.00 12.65 C ANISOU 2379 CB ALA A 132 2140 1506 1162 -469 -208 32 C ATOM 0 H ALA A 132 28.261 -13.921 -16.963 1.00 14.05 H new ATOM 0 HA ALA A 132 28.775 -13.312 -19.447 1.00 15.34 H new ATOM 0 HB1 ALA A 132 26.889 -14.651 -19.982 1.00 12.65 H new ATOM 0 HB2 ALA A 132 27.819 -15.399 -18.942 1.00 12.65 H new ATOM 0 HB3 ALA A 132 26.494 -14.686 -18.449 1.00 12.65 H new ATOM 2385 N GLU A 133 26.409 -11.631 -18.139 1.00 13.04 N ANISOU 2385 N GLU A 133 2035 1622 1298 -453 -274 94 N ATOM 2386 CA GLU A 133 25.538 -10.480 -18.345 1.00 17.51 C ANISOU 2386 CA GLU A 133 2594 2184 1875 -461 -349 128 C ATOM 2387 C GLU A 133 26.301 -9.273 -18.873 1.00 14.98 C ANISOU 2387 C GLU A 133 2324 1856 1512 -463 -302 129 C ATOM 2388 O GLU A 133 25.722 -8.443 -19.581 1.00 12.93 O ANISOU 2388 O GLU A 133 2118 1571 1224 -480 -364 154 O ATOM 2389 CB GLU A 133 24.832 -10.110 -17.038 1.00 15.01 C ANISOU 2389 CB GLU A 133 2145 1906 1653 -431 -371 149 C ATOM 2390 CG GLU A 133 23.757 -11.092 -16.596 1.00 15.53 C ANISOU 2390 CG GLU A 133 2155 1972 1774 -435 -431 166 C ATOM 2391 CD GLU A 133 23.141 -10.739 -15.238 1.00 15.83 C ANISOU 2391 CD GLU A 133 2068 2045 1902 -398 -424 188 C ATOM 2392 OE1 GLU A 133 23.729 -9.939 -14.476 1.00 13.96 O ANISOU 2392 OE1 GLU A 133 1795 1833 1677 -367 -365 179 O ATOM 2393 OE2 GLU A 133 22.054 -11.267 -14.935 1.00 17.14 O ANISOU 2393 OE2 GLU A 133 2177 2206 2128 -401 -476 217 O ATOM 0 H GLU A 133 26.413 -11.939 -17.336 1.00 13.04 H new ATOM 0 HA GLU A 133 24.881 -10.732 -19.013 1.00 17.51 H new ATOM 0 HB2 GLU A 133 25.496 -10.038 -16.335 1.00 15.01 H new ATOM 0 HB3 GLU A 133 24.430 -9.233 -17.139 1.00 15.01 H new ATOM 0 HG2 GLU A 133 23.056 -11.119 -17.266 1.00 15.53 H new ATOM 0 HG3 GLU A 133 24.139 -11.982 -16.550 1.00 15.53 H new ATOM 2400 N VAL A 134 27.583 -9.142 -18.536 1.00 12.60 N ANISOU 2400 N VAL A 134 2001 1572 1213 -448 -198 107 N ATOM 2401 CA VAL A 134 28.373 -7.979 -18.930 1.00 13.06 C ANISOU 2401 CA VAL A 134 2091 1624 1249 -453 -147 113 C ATOM 2402 C VAL A 134 29.433 -8.311 -19.962 1.00 20.38 C ANISOU 2402 C VAL A 134 3118 2518 2106 -469 -57 97 C ATOM 2403 O VAL A 134 30.157 -7.407 -20.399 1.00 18.71 O ANISOU 2403 O VAL A 134 2939 2294 1875 -478 0 106 O ATOM 2404 CB VAL A 134 29.020 -7.306 -17.702 1.00 11.51 C ANISOU 2404 CB VAL A 134 1783 1465 1126 -429 -104 111 C ATOM 2405 CG1 VAL A 134 27.980 -7.071 -16.625 1.00 14.06 C ANISOU 2405 CG1 VAL A 134 2021 1812 1509 -406 -171 124 C ATOM 2406 CG2 VAL A 134 30.179 -8.143 -17.156 1.00 12.74 C ANISOU 2406 CG2 VAL A 134 1889 1638 1313 -415 -21 87 C ATOM 0 H VAL A 134 28.017 -9.723 -18.074 1.00 12.60 H new ATOM 0 HA VAL A 134 27.753 -7.358 -19.343 1.00 13.06 H new ATOM 0 HB VAL A 134 29.380 -6.450 -17.982 1.00 11.51 H new ATOM 0 HG11 VAL A 134 28.398 -6.648 -15.858 1.00 14.06 H new ATOM 0 HG12 VAL A 134 27.280 -6.495 -16.971 1.00 14.06 H new ATOM 0 HG13 VAL A 134 27.595 -7.920 -16.356 1.00 14.06 H new ATOM 0 HG21 VAL A 134 30.566 -7.697 -16.386 1.00 12.74 H new ATOM 0 HG22 VAL A 134 29.851 -9.017 -16.892 1.00 12.74 H new ATOM 0 HG23 VAL A 134 30.856 -8.246 -17.843 1.00 12.74 H new ATOM 2416 N ALA A 135 29.535 -9.563 -20.388 1.00 16.96 N ANISOU 2416 N ALA A 135 2742 2065 1636 -471 -36 76 N ATOM 2417 CA ALA A 135 30.604 -9.974 -21.284 1.00 16.15 C ANISOU 2417 CA ALA A 135 2736 1929 1474 -474 75 59 C ATOM 2418 C ALA A 135 30.286 -9.568 -22.713 1.00 23.30 C ANISOU 2418 C ALA A 135 3811 2777 2265 -506 54 69 C ATOM 2419 O ALA A 135 29.126 -9.597 -23.135 1.00 22.50 O ANISOU 2419 O ALA A 135 3772 2654 2123 -529 -65 81 O ATOM 2420 CB ALA A 135 30.807 -11.485 -21.213 1.00 18.67 C ANISOU 2420 CB ALA A 135 3069 2236 1790 -459 108 29 C ATOM 0 H ALA A 135 28.992 -10.192 -20.168 1.00 16.96 H new ATOM 0 HA ALA A 135 31.420 -9.531 -21.004 1.00 16.15 H new ATOM 0 HB1 ALA A 135 31.522 -11.744 -21.815 1.00 18.67 H new ATOM 0 HB2 ALA A 135 31.041 -11.738 -20.306 1.00 18.67 H new ATOM 0 HB3 ALA A 135 29.988 -11.934 -21.473 1.00 18.67 H new ATOM 2426 N THR A 136 31.331 -9.198 -23.457 1.00 21.48 N ANISOU 2426 N THR A 136 3655 2519 1988 -509 171 69 N ATOM 2427 CA THR A 136 31.185 -8.807 -24.858 1.00 32.89 C ANISOU 2427 CA THR A 136 5285 3903 3309 -539 173 80 C ATOM 2428 C THR A 136 32.319 -9.269 -25.762 1.00 46.23 C ANISOU 2428 C THR A 136 7078 5545 4942 -528 327 62 C ATOM 2429 O THR A 136 32.209 -9.090 -26.978 1.00 52.52 O ANISOU 2429 O THR A 136 8008 6280 5668 -535 322 57 O ATOM 2430 CB THR A 136 31.080 -7.279 -24.990 1.00 37.32 C ANISOU 2430 CB THR A 136 5840 4468 3873 -556 146 116 C ATOM 2431 OG1 THR A 136 32.216 -6.665 -24.366 1.00 36.52 O ANISOU 2431 OG1 THR A 136 5623 4397 3854 -541 255 123 O ATOM 2432 CG2 THR A 136 29.800 -6.756 -24.349 1.00 42.19 C ANISOU 2432 CG2 THR A 136 6377 5112 4541 -559 -12 136 C ATOM 0 H THR A 136 32.139 -9.167 -23.164 1.00 21.48 H new ATOM 0 HA THR A 136 30.372 -9.249 -25.149 1.00 32.89 H new ATOM 0 HB THR A 136 31.059 -7.056 -25.934 1.00 37.32 H new ATOM 0 HG1 THR A 136 31.967 -5.990 -23.933 1.00 36.52 H new ATOM 0 HG21 THR A 136 29.760 -5.792 -24.447 1.00 42.19 H new ATOM 0 HG22 THR A 136 29.032 -7.157 -24.785 1.00 42.19 H new ATOM 0 HG23 THR A 136 29.793 -6.986 -23.407 1.00 42.19 H new ATOM 2440 N GLY A 137 33.393 -9.859 -25.234 1.00 49.21 N ANISOU 2440 N GLY A 137 7377 5943 5379 -500 457 49 N ATOM 2441 CA GLY A 137 34.603 -10.073 -25.987 1.00 50.60 C ANISOU 2441 CA GLY A 137 7592 6076 5557 -471 611 37 C ATOM 2442 C GLY A 137 34.822 -11.514 -26.402 1.00 48.92 C ANISOU 2442 C GLY A 137 7454 5820 5314 -443 665 1 C ATOM 2443 O GLY A 137 33.884 -12.317 -26.507 1.00 47.43 O ANISOU 2443 O GLY A 137 7340 5613 5070 -455 565 -19 O ATOM 0 H GLY A 137 33.429 -10.144 -24.423 1.00 49.21 H new ATOM 0 HA2 GLY A 137 34.582 -9.517 -26.781 1.00 50.60 H new ATOM 0 HA3 GLY A 137 35.360 -9.780 -25.456 1.00 50.60 H new ATOM 2447 N ASP A 138 36.097 -11.848 -26.637 1.00 35.35 N ANISOU 2447 N ASP A 138 5709 4080 3644 -404 822 -5 N ATOM 2448 CA ASP A 138 36.464 -13.135 -27.222 1.00 45.86 C ANISOU 2448 CA ASP A 138 7129 5351 4945 -370 897 -36 C ATOM 2449 C ASP A 138 36.015 -14.318 -26.369 1.00 36.27 C ANISOU 2449 C ASP A 138 5871 4159 3749 -360 847 -59 C ATOM 2450 O ASP A 138 35.807 -15.414 -26.901 1.00 32.30 O ANISOU 2450 O ASP A 138 5483 3600 3191 -347 848 -88 O ATOM 2451 CB ASP A 138 37.984 -13.203 -27.426 1.00 53.04 C ANISOU 2451 CB ASP A 138 7976 6241 5935 -323 1075 -27 C ATOM 2452 CG ASP A 138 38.431 -12.621 -28.761 1.00 68.02 C ANISOU 2452 CG ASP A 138 10000 8071 7772 -323 1151 -19 C ATOM 2453 OD1 ASP A 138 37.577 -12.082 -29.496 1.00 71.12 O ANISOU 2453 OD1 ASP A 138 10525 8436 8063 -361 1061 -20 O ATOM 2454 OD2 ASP A 138 39.641 -12.711 -29.078 1.00 50.98 O ANISOU 2454 OD2 ASP A 138 7809 5886 5676 -285 1300 -9 O ATOM 0 H ASP A 138 36.765 -11.336 -26.462 1.00 35.35 H new ATOM 0 HA ASP A 138 36.005 -13.199 -28.074 1.00 45.86 H new ATOM 0 HB2 ASP A 138 38.424 -12.724 -26.706 1.00 53.04 H new ATOM 0 HB3 ASP A 138 38.272 -14.127 -27.369 1.00 53.04 H new ATOM 2459 N AASP A 139 35.867 -14.133 -25.057 0.46 39.92 N ANISOU 2459 N AASP A 139 6180 4699 4289 -367 806 -46 N ATOM 2460 N BASP A 139 35.865 -14.125 -25.059 0.54 39.50 N ANISOU 2460 N BASP A 139 6127 4645 4236 -367 805 -46 N ATOM 2461 CA AASP A 139 35.561 -15.249 -24.169 0.46 43.66 C ANISOU 2461 CA AASP A 139 6586 5195 4808 -349 760 -67 C ATOM 2462 CA BASP A 139 35.574 -15.226 -24.148 0.54 44.17 C ANISOU 2462 CA BASP A 139 6646 5261 4876 -349 760 -66 C ATOM 2463 C AASP A 139 34.137 -15.197 -23.623 0.46 36.84 C ANISOU 2463 C AASP A 139 5695 4364 3938 -383 567 -66 C ATOM 2464 C BASP A 139 34.131 -15.231 -23.656 0.54 37.52 C ANISOU 2464 C BASP A 139 5788 4448 4021 -383 568 -67 C ATOM 2465 O AASP A 139 33.836 -15.871 -22.635 0.46 33.33 O ANISOU 2465 O AASP A 139 5143 3953 3568 -369 507 -74 O ATOM 2466 O BASP A 139 33.809 -15.990 -22.739 0.54 30.85 O ANISOU 2466 O BASP A 139 4848 3631 3243 -369 509 -77 O ATOM 2467 CB AASP A 139 36.575 -15.308 -23.023 0.46 40.80 C ANISOU 2467 CB AASP A 139 6016 4882 4602 -310 826 -53 C ATOM 2468 CB BASP A 139 36.533 -15.190 -22.954 0.54 40.78 C ANISOU 2468 CB BASP A 139 6003 4886 4605 -313 816 -50 C ATOM 2469 CG AASP A 139 36.696 -13.997 -22.275 0.46 36.66 C ANISOU 2469 CG AASP A 139 5349 4418 4160 -329 779 -20 C ATOM 2470 CG BASP A 139 37.913 -15.726 -23.295 0.54 40.26 C ANISOU 2470 CG BASP A 139 5930 4784 4584 -267 1003 -51 C ATOM 2471 OD1AASP A 139 35.861 -13.094 -22.497 0.46 34.20 O ANISOU 2471 OD1AASP A 139 5083 4117 3793 -367 685 -9 O ATOM 2472 OD1BASP A 139 38.018 -16.593 -24.191 0.54 45.00 O ANISOU 2472 OD1BASP A 139 6664 5315 5116 -244 1060 -77 O ATOM 2473 OD2AASP A 139 37.635 -13.871 -21.461 0.46 43.20 O ANISOU 2473 OD2AASP A 139 6024 5278 5111 -306 832 -3 O ATOM 2474 OD2BASP A 139 38.893 -15.282 -22.661 0.54 45.56 O ANISOU 2474 OD2BASP A 139 6443 5488 5381 -249 1067 -23 O ATOM 0 H AASP A 139 35.940 -13.371 -24.664 0.46 39.50 H new ATOM 0 H BASP A 139 35.929 -13.357 -24.677 0.54 39.50 H new ATOM 0 HA AASP A 139 35.626 -16.059 -24.699 0.46 44.17 H new ATOM 0 HA BASP A 139 35.702 -16.045 -24.652 0.54 44.17 H new ATOM 0 HB2AASP A 139 36.314 -16.006 -22.402 0.46 40.78 H new ATOM 0 HB2BASP A 139 36.614 -14.277 -22.636 0.54 40.78 H new ATOM 0 HB3AASP A 139 37.444 -15.554 -23.378 0.46 40.78 H new ATOM 0 HB3BASP A 139 36.158 -15.711 -22.227 0.54 40.78 H new ATOM 2483 N LYS A 140 33.248 -14.424 -24.252 1.00 29.51 N ANISOU 2483 N LYS A 140 3919 4107 3185 -702 367 259 N ATOM 2484 CA LYS A 140 31.842 -14.465 -23.861 1.00 27.34 C ANISOU 2484 CA LYS A 140 3720 3739 2930 -630 277 219 C ATOM 2485 C LYS A 140 31.269 -15.868 -24.026 1.00 21.15 C ANISOU 2485 C LYS A 140 2923 3000 2112 -537 280 136 C ATOM 2486 O LYS A 140 30.517 -16.348 -23.170 1.00 18.30 O ANISOU 2486 O LYS A 140 2550 2593 1810 -474 222 81 O ATOM 2487 CB LYS A 140 31.031 -13.468 -24.683 1.00 27.36 C ANISOU 2487 CB LYS A 140 3828 3680 2889 -647 237 314 C ATOM 2488 CG LYS A 140 29.547 -13.442 -24.343 1.00 33.89 C ANISOU 2488 CG LYS A 140 4691 4423 3763 -558 155 323 C ATOM 2489 CD LYS A 140 28.796 -12.447 -25.224 1.00 55.19 C ANISOU 2489 CD LYS A 140 7456 7074 6440 -563 116 473 C ATOM 2490 CE LYS A 140 27.282 -12.569 -25.066 1.00 56.49 C ANISOU 2490 CE LYS A 140 7605 7199 6660 -463 36 531 C ATOM 2491 NZ LYS A 140 26.832 -12.412 -23.653 1.00 61.92 N ANISOU 2491 NZ LYS A 140 8279 7757 7489 -380 59 471 N ATOM 0 H ALYS A 140 33.435 -13.882 -24.893 0.46 29.51 H new ATOM 0 H BLYS A 140 33.440 -13.859 -24.871 0.54 29.51 H new ATOM 0 HA LYS A 140 31.785 -14.221 -22.924 1.00 27.34 H new ATOM 0 HB2 LYS A 140 31.399 -12.580 -24.551 1.00 27.36 H new ATOM 0 HB3 LYS A 140 31.134 -13.680 -25.624 1.00 27.36 H new ATOM 0 HG2 LYS A 140 29.171 -14.328 -24.459 1.00 33.89 H new ATOM 0 HG3 LYS A 140 29.431 -13.204 -23.410 1.00 33.89 H new ATOM 0 HD2 LYS A 140 29.072 -11.545 -24.999 1.00 55.19 H new ATOM 0 HD3 LYS A 140 29.036 -12.593 -26.152 1.00 55.19 H new ATOM 0 HE2 LYS A 140 26.849 -11.897 -25.615 1.00 56.49 H new ATOM 0 HE3 LYS A 140 26.995 -13.434 -25.398 1.00 56.49 H new ATOM 0 HZ1 LYS A 140 25.997 -12.103 -23.640 1.00 61.92 H new ATOM 0 HZ2 LYS A 140 26.863 -13.201 -23.242 1.00 61.92 H new ATOM 0 HZ3 LYS A 140 27.367 -11.838 -23.233 1.00 61.92 H new ATOM 2505 N LYS A 141 31.607 -16.548 -25.122 1.00 18.65 N ANISOU 2505 N LYS A 141 2632 2763 1691 -540 361 120 N ATOM 2506 CA LYS A 141 31.053 -17.880 -25.336 1.00 27.18 C ANISOU 2506 CA LYS A 141 3749 3857 2720 -482 376 26 C ATOM 2507 C LYS A 141 31.573 -18.868 -24.304 1.00 21.32 C ANISOU 2507 C LYS A 141 2905 3107 2087 -403 426 -42 C ATOM 2508 O LYS A 141 30.832 -19.750 -23.856 1.00 14.42 O ANISOU 2508 O LYS A 141 2048 2198 1234 -349 385 -111 O ATOM 2509 CB LYS A 141 31.366 -18.361 -26.752 1.00 22.79 C ANISOU 2509 CB LYS A 141 3296 3363 1999 -527 486 6 C ATOM 2510 CG LYS A 141 30.417 -17.794 -27.781 1.00 24.30 C ANISOU 2510 CG LYS A 141 3611 3579 2045 -615 388 72 C ATOM 2511 CD LYS A 141 30.745 -18.286 -29.191 1.00 31.06 C ANISOU 2511 CD LYS A 141 4609 4503 2689 -698 501 40 C ATOM 2512 CE LYS A 141 29.764 -17.722 -30.206 1.00 41.54 C ANISOU 2512 CE LYS A 141 6039 5873 3870 -806 359 138 C ATOM 2513 NZ LYS A 141 30.199 -17.989 -31.605 1.00 49.25 N ANISOU 2513 NZ LYS A 141 7122 6883 4708 -868 444 110 N ATOM 0 H LYS A 141 32.139 -16.265 -25.736 1.00 18.65 H new ATOM 0 HA LYS A 141 30.090 -17.827 -25.231 1.00 27.18 H new ATOM 0 HB2 LYS A 141 32.274 -18.110 -26.982 1.00 22.79 H new ATOM 0 HB3 LYS A 141 31.324 -19.330 -26.778 1.00 22.79 H new ATOM 0 HG2 LYS A 141 29.508 -18.045 -27.555 1.00 24.30 H new ATOM 0 HG3 LYS A 141 30.458 -16.825 -27.759 1.00 24.30 H new ATOM 0 HD2 LYS A 141 31.648 -18.022 -29.428 1.00 31.06 H new ATOM 0 HD3 LYS A 141 30.718 -19.255 -29.214 1.00 31.06 H new ATOM 0 HE2 LYS A 141 28.888 -18.112 -30.060 1.00 41.54 H new ATOM 0 HE3 LYS A 141 29.675 -16.765 -30.072 1.00 41.54 H new ATOM 0 HZ1 LYS A 141 29.507 -17.890 -32.155 1.00 49.25 H new ATOM 0 HZ2 LYS A 141 30.842 -17.416 -31.831 1.00 49.25 H new ATOM 0 HZ3 LYS A 141 30.509 -18.821 -31.666 1.00 49.25 H new ATOM 2527 N ARG A 142 32.842 -18.739 -23.912 1.00 16.97 N ANISOU 2527 N ARG A 142 2234 2599 1614 -404 504 1 N ATOM 2528 CA ARG A 142 33.390 -19.638 -22.904 1.00 22.19 C ANISOU 2528 CA ARG A 142 2769 3272 2392 -330 536 -14 C ATOM 2529 C ARG A 142 32.809 -19.333 -21.529 1.00 14.62 C ANISOU 2529 C ARG A 142 1780 2267 1508 -343 391 -20 C ATOM 2530 O ARG A 142 32.569 -20.249 -20.736 1.00 14.56 O ANISOU 2530 O ARG A 142 1730 2242 1560 -277 373 -58 O ATOM 2531 CB ARG A 142 34.919 -19.552 -22.885 1.00 20.33 C ANISOU 2531 CB ARG A 142 2373 3126 2225 -340 646 84 C ATOM 2532 CG ARG A 142 35.587 -20.580 -23.813 1.00 32.18 C ANISOU 2532 CG ARG A 142 3864 4651 3712 -244 863 70 C ATOM 2533 CD ARG A 142 37.103 -20.451 -23.818 1.00 45.65 C ANISOU 2533 CD ARG A 142 5366 6463 5515 -236 990 209 C ATOM 2534 NE ARG A 142 37.549 -19.289 -24.584 1.00 46.03 N ANISOU 2534 NE ARG A 142 5430 6571 5488 -357 1006 278 N ATOM 2535 CZ ARG A 142 37.848 -19.309 -25.881 1.00 49.49 C ANISOU 2535 CZ ARG A 142 5952 7031 5823 -353 1178 269 C ATOM 2536 NH1 ARG A 142 37.759 -20.436 -26.578 1.00 39.40 N ANISOU 2536 NH1 ARG A 142 4775 5705 4492 -241 1365 177 N ATOM 2537 NH2 ARG A 142 38.239 -18.195 -26.484 1.00 46.02 N ANISOU 2537 NH2 ARG A 142 5520 6647 5318 -475 1175 351 N ATOM 0 H ARG A 142 33.390 -18.149 -24.212 1.00 16.97 H new ATOM 0 HA ARG A 142 33.139 -20.546 -23.136 1.00 22.19 H new ATOM 0 HB2 ARG A 142 35.192 -18.659 -23.149 1.00 20.33 H new ATOM 0 HB3 ARG A 142 35.235 -19.688 -21.978 1.00 20.33 H new ATOM 0 HG2 ARG A 142 35.341 -21.475 -23.531 1.00 32.18 H new ATOM 0 HG3 ARG A 142 35.251 -20.464 -24.716 1.00 32.18 H new ATOM 0 HD2 ARG A 142 37.424 -20.379 -22.906 1.00 45.65 H new ATOM 0 HD3 ARG A 142 37.494 -21.255 -24.194 1.00 45.65 H new ATOM 0 HE ARG A 142 37.623 -18.540 -24.168 1.00 46.03 H new ATOM 0 HH11 ARG A 142 37.506 -21.162 -26.192 1.00 39.40 H new ATOM 0 HH12 ARG A 142 37.954 -20.440 -27.416 1.00 39.40 H new ATOM 0 HH21 ARG A 142 38.299 -17.463 -26.037 1.00 46.02 H new ATOM 0 HH22 ARG A 142 38.433 -18.205 -27.322 1.00 46.02 H new ATOM 2551 N ILE A 143 32.559 -18.057 -21.234 1.00 15.99 N ANISOU 2551 N ILE A 143 1997 2405 1675 -431 307 17 N ATOM 2552 CA ILE A 143 31.897 -17.708 -19.981 1.00 13.63 C ANISOU 2552 CA ILE A 143 1721 2036 1423 -446 208 -9 C ATOM 2553 C ILE A 143 30.504 -18.327 -19.937 1.00 14.09 C ANISOU 2553 C ILE A 143 1843 2035 1474 -357 169 -73 C ATOM 2554 O ILE A 143 30.111 -18.953 -18.944 1.00 13.67 O ANISOU 2554 O ILE A 143 1762 1963 1468 -317 134 -113 O ATOM 2555 CB ILE A 143 31.852 -16.179 -19.810 1.00 12.45 C ANISOU 2555 CB ILE A 143 1654 1814 1263 -551 173 32 C ATOM 2556 CG1 ILE A 143 33.269 -15.636 -19.597 1.00 21.62 C ANISOU 2556 CG1 ILE A 143 2737 3045 2431 -685 185 102 C ATOM 2557 CG2 ILE A 143 30.942 -15.791 -18.665 1.00 15.38 C ANISOU 2557 CG2 ILE A 143 2105 2075 1666 -548 120 -14 C ATOM 2558 CD1 ILE A 143 33.392 -14.140 -19.820 1.00 30.49 C ANISOU 2558 CD1 ILE A 143 3970 4089 3527 -811 179 148 C ATOM 0 H ILE A 143 32.761 -17.390 -21.737 1.00 15.99 H new ATOM 0 HA ILE A 143 32.404 -18.069 -19.237 1.00 13.63 H new ATOM 0 HB ILE A 143 31.489 -15.785 -20.618 1.00 12.45 H new ATOM 0 HG12 ILE A 143 33.554 -15.844 -18.693 1.00 21.62 H new ATOM 0 HG13 ILE A 143 33.876 -16.095 -20.198 1.00 21.62 H new ATOM 0 HG21 ILE A 143 30.928 -14.825 -18.575 1.00 15.38 H new ATOM 0 HG22 ILE A 143 30.044 -16.111 -18.842 1.00 15.38 H new ATOM 0 HG23 ILE A 143 31.270 -16.187 -17.842 1.00 15.38 H new ATOM 0 HD11 ILE A 143 34.310 -13.865 -19.669 1.00 30.49 H new ATOM 0 HD12 ILE A 143 33.136 -13.926 -20.731 1.00 30.49 H new ATOM 0 HD13 ILE A 143 32.809 -13.672 -19.202 1.00 30.49 H new ATOM 2570 N ILE A 144 29.745 -18.180 -21.023 1.00 13.09 N ANISOU 2570 N ILE A 144 1794 1896 1282 -343 164 -64 N ATOM 2571 CA ILE A 144 28.413 -18.775 -21.089 1.00 11.52 C ANISOU 2571 CA ILE A 144 1634 1672 1073 -289 107 -92 C ATOM 2572 C ILE A 144 28.491 -20.285 -20.909 1.00 15.80 C ANISOU 2572 C ILE A 144 2148 2238 1616 -243 137 -169 C ATOM 2573 O ILE A 144 27.688 -20.883 -20.183 1.00 12.77 O ANISOU 2573 O ILE A 144 1753 1825 1276 -205 89 -201 O ATOM 2574 CB ILE A 144 27.729 -18.402 -22.418 1.00 17.31 C ANISOU 2574 CB ILE A 144 2439 2426 1711 -322 75 -33 C ATOM 2575 CG1 ILE A 144 27.445 -16.897 -22.474 1.00 16.45 C ANISOU 2575 CG1 ILE A 144 2355 2259 1636 -339 47 71 C ATOM 2576 CG2 ILE A 144 26.450 -19.226 -22.609 1.00 16.61 C ANISOU 2576 CG2 ILE A 144 2368 2351 1592 -306 -1 -44 C ATOM 2577 CD1 ILE A 144 26.826 -16.434 -23.785 1.00 19.99 C ANISOU 2577 CD1 ILE A 144 2854 2744 1996 -375 -1 179 C ATOM 0 H ILE A 144 29.981 -17.744 -21.725 1.00 13.09 H new ATOM 0 HA ILE A 144 27.875 -18.420 -20.364 1.00 11.52 H new ATOM 0 HB ILE A 144 28.329 -18.613 -23.150 1.00 17.31 H new ATOM 0 HG12 ILE A 144 26.850 -16.662 -21.745 1.00 16.45 H new ATOM 0 HG13 ILE A 144 28.274 -16.415 -22.330 1.00 16.45 H new ATOM 0 HG21 ILE A 144 26.030 -18.982 -23.448 1.00 16.61 H new ATOM 0 HG22 ILE A 144 26.672 -20.170 -22.622 1.00 16.61 H new ATOM 0 HG23 ILE A 144 25.838 -19.048 -21.878 1.00 16.61 H new ATOM 0 HD11 ILE A 144 26.674 -15.477 -23.751 1.00 19.99 H new ATOM 0 HD12 ILE A 144 27.428 -16.640 -24.518 1.00 19.99 H new ATOM 0 HD13 ILE A 144 25.981 -16.890 -23.923 1.00 19.99 H new ATOM 2589 N ASP A 145 29.452 -20.933 -21.566 1.00 12.09 N ANISOU 2589 N ASP A 145 1675 1809 1109 -240 239 -194 N ATOM 2590 CA AASP A 145 29.594 -22.383 -21.467 0.30 16.95 C ANISOU 2590 CA AASP A 145 2290 2409 1740 -180 309 -262 C ATOM 2591 CA BASP A 145 29.511 -22.382 -21.445 0.70 15.60 C ANISOU 2591 CA BASP A 145 2122 2236 1569 -181 301 -263 C ATOM 2592 C ASP A 145 29.982 -22.811 -20.059 1.00 17.85 C ANISOU 2592 C ASP A 145 2287 2514 1981 -125 294 -249 C ATOM 2593 O ASP A 145 29.608 -23.901 -19.605 1.00 14.02 O ANISOU 2593 O ASP A 145 1805 1990 1534 -73 299 -291 O ATOM 2594 CB AASP A 145 30.646 -22.864 -22.465 0.30 17.97 C ANISOU 2594 CB AASP A 145 2447 2561 1821 -166 475 -278 C ATOM 2595 CB BASP A 145 30.404 -22.986 -22.523 0.70 20.18 C ANISOU 2595 CB BASP A 145 2752 2832 2086 -170 463 -292 C ATOM 2596 CG AASP A 145 31.148 -24.260 -22.155 0.30 25.53 C ANISOU 2596 CG AASP A 145 3379 3472 2851 -69 599 -321 C ATOM 2597 CG BASP A 145 30.047 -24.441 -22.815 0.70 27.05 C ANISOU 2597 CG BASP A 145 3724 3633 2921 -135 540 -390 C ATOM 2598 OD1AASP A 145 30.513 -25.235 -22.608 0.30 25.64 O ANISOU 2598 OD1AASP A 145 3528 3416 2798 -69 638 -412 O ATOM 2599 OD1BASP A 145 28.899 -24.706 -23.245 0.70 22.16 O ANISOU 2599 OD1BASP A 145 3227 2993 2200 -207 455 -439 O ATOM 2600 OD2AASP A 145 32.171 -24.381 -21.448 0.30 26.80 O ANISOU 2600 OD2AASP A 145 3385 3662 3137 -2 656 -249 O ATOM 2601 OD2BASP A 145 30.907 -25.319 -22.599 0.70 25.99 O ANISOU 2601 OD2BASP A 145 3546 3462 2867 -43 687 -401 O ATOM 0 H AASP A 145 30.031 -20.551 -22.074 0.30 12.09 H new ATOM 0 H BASP A 145 30.052 -20.571 -22.064 0.70 12.09 H new ATOM 0 HA AASP A 145 28.736 -22.785 -21.674 0.30 15.60 H new ATOM 0 HA BASP A 145 28.610 -22.718 -21.570 0.70 15.60 H new ATOM 0 HB2AASP A 145 30.269 -22.850 -23.359 0.30 20.18 H new ATOM 0 HB2BASP A 145 30.324 -22.465 -23.337 0.70 20.18 H new ATOM 0 HB3AASP A 145 31.394 -22.247 -22.463 0.30 20.18 H new ATOM 0 HB3BASP A 145 31.331 -22.932 -22.242 0.70 20.18 H new ATOM 2610 N SER A 146 30.763 -21.978 -19.365 1.00 12.88 N ANISOU 2610 N SER A 146 1563 1926 1406 -158 270 -180 N ATOM 2611 CA SER A 146 31.150 -22.309 -17.998 1.00 10.49 C ANISOU 2611 CA SER A 146 1155 1640 1191 -146 229 -145 C ATOM 2612 C SER A 146 29.944 -22.262 -17.066 1.00 10.95 C ANISOU 2612 C SER A 146 1266 1643 1251 -152 132 -188 C ATOM 2613 O SER A 146 29.797 -23.118 -16.184 1.00 13.84 O ANISOU 2613 O SER A 146 1590 2004 1665 -114 112 -191 O ATOM 2614 CB SER A 146 32.242 -21.357 -17.513 1.00 15.90 C ANISOU 2614 CB SER A 146 1748 2396 1897 -239 204 -55 C ATOM 2615 OG SER A 146 33.488 -21.633 -18.132 1.00 15.80 O ANISOU 2615 OG SER A 146 1623 2460 1922 -216 308 21 O ATOM 0 H SER A 146 31.072 -21.233 -19.663 1.00 12.88 H new ATOM 0 HA SER A 146 31.501 -23.213 -17.989 1.00 10.49 H new ATOM 0 HB2 SER A 146 31.982 -20.442 -17.702 1.00 15.90 H new ATOM 0 HB3 SER A 146 32.334 -21.433 -16.550 1.00 15.90 H new ATOM 0 HG SER A 146 33.485 -21.331 -18.916 1.00 15.80 H new ATOM 2621 N ALA A 147 29.070 -21.268 -17.242 1.00 9.30 N ANISOU 2621 N ALA A 147 1143 1390 1000 -188 86 -203 N ATOM 2622 CA ALA A 147 27.825 -21.243 -16.480 1.00 11.57 C ANISOU 2622 CA ALA A 147 1471 1622 1304 -168 33 -230 C ATOM 2623 C ALA A 147 26.983 -22.479 -16.781 1.00 13.07 C ANISOU 2623 C ALA A 147 1667 1803 1496 -111 25 -265 C ATOM 2624 O ALA A 147 26.522 -23.172 -15.864 1.00 12.23 O ANISOU 2624 O ALA A 147 1537 1682 1428 -86 3 -281 O ATOM 2625 CB ALA A 147 27.045 -19.965 -16.793 1.00 11.92 C ANISOU 2625 CB ALA A 147 1589 1608 1334 -183 21 -206 C ATOM 0 H ALA A 147 29.178 -20.612 -17.787 1.00 9.30 H new ATOM 0 HA ALA A 147 28.039 -21.251 -15.534 1.00 11.57 H new ATOM 0 HB1 ALA A 147 26.220 -19.956 -16.283 1.00 11.92 H new ATOM 0 HB2 ALA A 147 27.580 -19.192 -16.554 1.00 11.92 H new ATOM 0 HB3 ALA A 147 26.839 -19.935 -17.740 1.00 11.92 H new ATOM 2631 N ARG A 148 26.781 -22.774 -18.071 1.00 12.81 N ANISOU 2631 N ARG A 148 1683 1780 1404 -116 42 -278 N ATOM 2632 CA AARG A 148 25.965 -23.921 -18.456 0.50 9.33 C ANISOU 2632 CA AARG A 148 1285 1325 937 -112 26 -319 C ATOM 2633 CA BARG A 148 25.971 -23.923 -18.465 0.50 9.72 C ANISOU 2633 CA BARG A 148 1334 1374 984 -112 27 -319 C ATOM 2634 C ARG A 148 26.518 -25.212 -17.865 1.00 13.07 C ANISOU 2634 C ARG A 148 1734 1770 1463 -65 83 -358 C ATOM 2635 O ARG A 148 25.765 -26.039 -17.342 1.00 11.42 O ANISOU 2635 O ARG A 148 1530 1527 1280 -58 50 -377 O ATOM 2636 CB AARG A 148 25.892 -24.033 -19.981 0.50 11.56 C ANISOU 2636 CB AARG A 148 1662 1627 1103 -170 44 -335 C ATOM 2637 CB BARG A 148 25.927 -24.027 -19.993 0.50 11.39 C ANISOU 2637 CB BARG A 148 1641 1606 1081 -170 46 -335 C ATOM 2638 CG AARG A 148 25.000 -25.179 -20.467 0.50 15.83 C ANISOU 2638 CG AARG A 148 2288 2150 1577 -225 12 -383 C ATOM 2639 CG BARG A 148 25.135 -25.219 -20.523 0.50 13.31 C ANISOU 2639 CG BARG A 148 1974 1828 1254 -223 26 -390 C ATOM 2640 CD AARG A 148 25.459 -25.769 -21.795 0.50 17.46 C ANISOU 2640 CD AARG A 148 2640 2348 1647 -291 97 -452 C ATOM 2641 CD BARG A 148 25.253 -25.349 -22.038 0.50 20.25 C ANISOU 2641 CD BARG A 148 2991 2729 1973 -317 60 -422 C ATOM 2642 NE AARG A 148 26.876 -26.122 -21.798 0.50 15.32 N ANISOU 2642 NE AARG A 148 2365 2038 1416 -210 266 -493 N ATOM 2643 NE BARG A 148 25.227 -24.049 -22.702 0.50 22.91 N ANISOU 2643 NE BARG A 148 3315 3133 2257 -354 11 -337 N ATOM 2644 CZ AARG A 148 27.384 -27.226 -21.259 0.50 17.23 C ANISOU 2644 CZ AARG A 148 2602 2203 1741 -131 369 -538 C ATOM 2645 CZ BARG A 148 24.133 -23.446 -23.157 0.50 23.27 C ANISOU 2645 CZ BARG A 148 3354 3236 2253 -425 -122 -241 C ATOM 2646 NH1AARG A 148 26.599 -28.116 -20.655 0.50 11.89 N ANISOU 2646 NH1AARG A 148 1948 1470 1101 -138 318 -567 N ATOM 2647 NH1BARG A 148 22.940 -24.022 -23.046 0.50 12.48 N ANISOU 2647 NH1BARG A 148 1979 1888 876 -483 -231 -216 N ATOM 2648 NH2AARG A 148 28.690 -27.437 -21.326 0.50 12.80 N ANISOU 2648 NH2AARG A 148 1999 1624 1240 -40 531 -530 N ATOM 2649 NH2BARG A 148 24.241 -22.256 -23.735 0.50 12.58 N ANISOU 2649 NH2BARG A 148 1988 1924 869 -441 -148 -145 N ATOM 0 H AARG A 148 27.106 -22.325 -18.729 0.50 12.81 H new ATOM 0 H BARG A 148 27.104 -22.321 -18.727 0.50 12.81 H new ATOM 0 HA AARG A 148 25.072 -23.784 -18.104 0.50 9.72 H new ATOM 0 HA BARG A 148 25.071 -23.794 -18.126 0.50 9.72 H new ATOM 0 HB2AARG A 148 25.559 -23.197 -20.344 0.50 11.39 H new ATOM 0 HB2BARG A 148 25.541 -23.212 -20.350 0.50 11.39 H new ATOM 0 HB3AARG A 148 26.787 -24.158 -20.332 0.50 11.39 H new ATOM 0 HB3BARG A 148 26.835 -24.082 -20.329 0.50 11.39 H new ATOM 0 HG2AARG A 148 24.986 -25.879 -19.795 0.50 13.31 H new ATOM 0 HG2BARG A 148 25.455 -26.033 -20.103 0.50 13.31 H new ATOM 0 HG3AARG A 148 24.090 -24.857 -20.559 0.50 13.31 H new ATOM 0 HG3BARG A 148 24.201 -25.122 -20.278 0.50 13.31 H new ATOM 0 HD2AARG A 148 24.933 -26.560 -21.992 0.50 20.25 H new ATOM 0 HD2BARG A 148 26.079 -25.808 -22.259 0.50 20.25 H new ATOM 0 HD3AARG A 148 25.288 -25.130 -22.504 0.50 20.25 H new ATOM 0 HD3BARG A 148 24.526 -25.897 -22.372 0.50 20.25 H new ATOM 0 HE AARG A 148 27.422 -25.576 -22.176 0.50 22.91 H new ATOM 0 HE BARG A 148 25.977 -23.642 -22.807 0.50 22.91 H new ATOM 0 HH11AARG A 148 25.751 -27.981 -20.610 0.50 12.48 H new ATOM 0 HH11BARG A 148 22.868 -24.795 -22.676 0.50 12.48 H new ATOM 0 HH12AARG A 148 26.940 -28.826 -20.310 0.50 12.48 H new ATOM 0 HH12BARG A 148 22.240 -23.622 -23.344 0.50 12.48 H new ATOM 0 HH21AARG A 148 29.199 -26.863 -21.715 0.50 12.58 H new ATOM 0 HH21BARG A 148 25.012 -21.884 -23.812 0.50 12.58 H new ATOM 0 HH22AARG A 148 29.029 -28.148 -20.981 0.50 12.58 H new ATOM 0 HH22BARG A 148 23.540 -21.857 -24.033 0.50 12.58 H new ATOM 2676 N ASER A 149 27.835 -25.410 -17.967 0.78 12.23 N ANISOU 2676 N ASER A 149 1588 1675 1385 -28 177 -347 N ATOM 2677 N BSER A 149 27.836 -25.412 -17.958 0.22 13.77 N ANISOU 2677 N BSER A 149 1782 1870 1581 -28 177 -347 N ATOM 2678 CA ASER A 149 28.448 -26.637 -17.471 0.78 13.03 C ANISOU 2678 CA ASER A 149 1646 1740 1566 45 253 -345 C ATOM 2679 CA BSER A 149 28.430 -26.651 -17.468 0.22 14.31 C ANISOU 2679 CA BSER A 149 1809 1900 1727 45 252 -346 C ATOM 2680 C ASER A 149 28.237 -26.793 -15.968 0.78 11.94 C ANISOU 2680 C ASER A 149 1422 1612 1503 57 173 -298 C ATOM 2681 C BSER A 149 28.240 -26.799 -15.964 0.22 11.59 C ANISOU 2681 C BSER A 149 1377 1567 1459 58 173 -297 C ATOM 2682 O ASER A 149 27.928 -27.888 -15.484 0.78 10.19 O ANISOU 2682 O ASER A 149 1206 1338 1329 96 183 -304 O ATOM 2683 O BSER A 149 27.933 -27.892 -15.474 0.22 10.87 O ANISOU 2683 O BSER A 149 1291 1424 1416 96 183 -303 O ATOM 2684 CB ASER A 149 29.939 -26.640 -17.806 0.78 16.91 C ANISOU 2684 CB ASER A 149 2058 2263 2103 97 375 -290 C ATOM 2685 CB BSER A 149 29.915 -26.697 -17.827 0.22 18.89 C ANISOU 2685 CB BSER A 149 2314 2510 2354 99 378 -293 C ATOM 2686 OG ASER A 149 30.548 -27.847 -17.390 0.78 20.11 O ANISOU 2686 OG ASER A 149 2406 2621 2616 198 472 -253 O ATOM 2687 OG BSER A 149 30.100 -26.703 -19.232 0.22 24.75 O ANISOU 2687 OG BSER A 149 3163 3231 3008 88 486 -349 O ATOM 0 H ASER A 149 28.384 -24.849 -18.318 0.78 13.77 H new ATOM 0 H BSER A 149 28.393 -24.851 -18.296 0.22 13.77 H new ATOM 0 HA ASER A 149 28.021 -27.391 -17.907 0.78 14.31 H new ATOM 0 HA BSER A 149 27.978 -27.394 -17.897 0.22 14.31 H new ATOM 0 HB2ASER A 149 30.060 -26.525 -18.762 0.78 18.89 H new ATOM 0 HB2BSER A 149 30.368 -25.931 -17.441 0.22 18.89 H new ATOM 0 HB3ASER A 149 30.373 -25.888 -17.373 0.78 18.89 H new ATOM 0 HB3BSER A 149 30.320 -27.490 -17.441 0.22 18.89 H new ATOM 0 HG ASER A 149 29.962 -28.444 -17.312 0.78 24.75 H new ATOM 0 HG BSER A 149 30.002 -25.924 -19.531 0.22 24.75 H new ATOM 2698 N ALA A 150 28.420 -25.712 -15.212 1.00 9.45 N ANISOU 2698 N ALA A 150 1050 1355 1186 9 103 -252 N ATOM 2699 CA ALA A 150 28.249 -25.783 -13.764 1.00 11.32 C ANISOU 2699 CA ALA A 150 1237 1610 1454 -11 34 -214 C ATOM 2700 C ALA A 150 26.801 -26.082 -13.399 1.00 12.01 C ANISOU 2700 C ALA A 150 1389 1648 1528 -11 -7 -262 C ATOM 2701 O ALA A 150 26.527 -26.949 -12.559 1.00 10.31 O ANISOU 2701 O ALA A 150 1151 1418 1349 7 -23 -244 O ATOM 2702 CB ALA A 150 28.711 -24.480 -13.116 1.00 14.11 C ANISOU 2702 CB ALA A 150 1575 2016 1769 -103 -16 -180 C ATOM 0 H AALA A 150 28.641 -24.938 -15.514 0.78 9.45 H new ATOM 0 H BALA A 150 28.638 -24.937 -15.516 0.22 9.45 H new ATOM 0 HA ALA A 150 28.796 -26.510 -13.426 1.00 11.32 H new ATOM 0 HB1 ALA A 150 28.594 -24.537 -12.155 1.00 14.11 H new ATOM 0 HB2 ALA A 150 29.648 -24.332 -13.319 1.00 14.11 H new ATOM 0 HB3 ALA A 150 28.185 -23.742 -13.462 1.00 14.11 H new ATOM 2708 N TYR A 151 25.857 -25.365 -14.019 1.00 10.69 N ANISOU 2708 N TYR A 151 1282 1461 1317 -30 -25 -296 N ATOM 2709 CA TYR A 151 24.441 -25.624 -13.780 1.00 10.52 C ANISOU 2709 CA TYR A 151 1281 1413 1301 -29 -60 -306 C ATOM 2710 C TYR A 151 24.068 -27.058 -14.141 1.00 16.37 C ANISOU 2710 C TYR A 151 2043 2123 2053 -23 -59 -330 C ATOM 2711 O TYR A 151 23.271 -27.695 -13.440 1.00 8.53 O ANISOU 2711 O TYR A 151 1037 1115 1090 -27 -85 -319 O ATOM 2712 CB TYR A 151 23.579 -24.660 -14.590 1.00 9.59 C ANISOU 2712 CB TYR A 151 1191 1297 1158 -41 -81 -289 C ATOM 2713 CG TYR A 151 23.433 -23.249 -14.055 1.00 10.50 C ANISOU 2713 CG TYR A 151 1316 1391 1283 -35 -59 -263 C ATOM 2714 CD1 TYR A 151 23.170 -23.002 -12.715 1.00 11.31 C ANISOU 2714 CD1 TYR A 151 1426 1467 1405 -31 -32 -268 C ATOM 2715 CD2 TYR A 151 23.530 -22.159 -14.910 1.00 9.32 C ANISOU 2715 CD2 TYR A 151 1195 1231 1115 -41 -51 -234 C ATOM 2716 CE1 TYR A 151 23.012 -21.706 -12.247 1.00 8.84 C ANISOU 2716 CE1 TYR A 151 1174 1096 1091 -33 26 -265 C ATOM 2717 CE2 TYR A 151 23.373 -20.870 -14.453 1.00 9.17 C ANISOU 2717 CE2 TYR A 151 1217 1151 1115 -32 -5 -212 C ATOM 2718 CZ TYR A 151 23.109 -20.647 -13.121 1.00 10.17 C ANISOU 2718 CZ TYR A 151 1375 1229 1260 -27 44 -237 C ATOM 2719 OH TYR A 151 22.954 -19.365 -12.664 1.00 12.71 O ANISOU 2719 OH TYR A 151 1784 1454 1590 -25 126 -236 O ATOM 0 H TYR A 151 26.018 -24.730 -14.576 1.00 10.69 H new ATOM 0 HA TYR A 151 24.277 -25.491 -12.833 1.00 10.52 H new ATOM 0 HB2 TYR A 151 23.948 -24.606 -15.485 1.00 9.59 H new ATOM 0 HB3 TYR A 151 22.692 -25.045 -14.671 1.00 9.59 H new ATOM 0 HD1 TYR A 151 23.099 -23.715 -12.123 1.00 11.31 H new ATOM 0 HD2 TYR A 151 23.705 -22.303 -15.812 1.00 9.32 H new ATOM 0 HE1 TYR A 151 22.841 -21.553 -11.346 1.00 8.84 H new ATOM 0 HE2 TYR A 151 23.445 -20.153 -15.041 1.00 9.17 H new ATOM 0 HH TYR A 151 22.561 -19.377 -11.922 1.00 12.71 H new ATOM 2729 N GLN A 152 24.613 -27.570 -15.250 1.00 11.81 N ANISOU 2729 N GLN A 152 1520 1523 1446 -24 -12 -367 N ATOM 2730 CA GLN A 152 24.253 -28.907 -15.713 1.00 10.98 C ANISOU 2730 CA GLN A 152 1492 1350 1329 -44 13 -412 C ATOM 2731 C GLN A 152 24.752 -29.983 -14.755 1.00 14.31 C ANISOU 2731 C GLN A 152 1881 1716 1839 18 60 -392 C ATOM 2732 O GLN A 152 24.036 -30.953 -14.487 1.00 12.93 O ANISOU 2732 O GLN A 152 1749 1483 1682 -9 46 -404 O ATOM 2733 CB GLN A 152 24.804 -29.155 -17.120 1.00 11.10 C ANISOU 2733 CB GLN A 152 1617 1332 1267 -66 93 -473 C ATOM 2734 CG GLN A 152 24.334 -30.464 -17.731 1.00 13.31 C ANISOU 2734 CG GLN A 152 2044 1516 1497 -129 132 -548 C ATOM 2735 CD GLN A 152 22.823 -30.524 -17.858 1.00 21.34 C ANISOU 2735 CD GLN A 152 3087 2569 2453 -257 -6 -536 C ATOM 2736 OE1 GLN A 152 22.162 -31.376 -17.261 1.00 28.62 O ANISOU 2736 OE1 GLN A 152 4015 3446 3415 -289 -38 -533 O ATOM 2737 NE2 GLN A 152 22.268 -29.601 -18.622 1.00 19.63 N ANISOU 2737 NE2 GLN A 152 2865 2443 2151 -333 -93 -502 N ATOM 0 H GLN A 152 25.188 -27.161 -15.742 1.00 11.81 H new ATOM 0 HA GLN A 152 23.285 -28.957 -15.741 1.00 10.98 H new ATOM 0 HB2 GLN A 152 24.538 -28.423 -17.698 1.00 11.10 H new ATOM 0 HB3 GLN A 152 25.773 -29.152 -17.086 1.00 11.10 H new ATOM 0 HG2 GLN A 152 24.736 -30.573 -18.607 1.00 13.31 H new ATOM 0 HG3 GLN A 152 24.641 -31.204 -17.184 1.00 13.31 H new ATOM 0 HE21 GLN A 152 22.761 -29.022 -19.024 1.00 19.63 H new ATOM 0 HE22 GLN A 152 21.414 -29.579 -18.718 1.00 19.63 H new ATOM 2746 N GLU A 153 25.987 -29.850 -14.253 1.00 13.40 N ANISOU 2746 N GLU A 153 1682 1624 1785 89 110 -338 N ATOM 2747 CA AGLU A 153 26.465 -30.821 -13.276 0.65 11.71 C ANISOU 2747 CA AGLU A 153 1408 1375 1666 150 137 -269 C ATOM 2748 CA BGLU A 153 26.493 -30.790 -13.254 0.35 12.76 C ANISOU 2748 CA BGLU A 153 1537 1512 1800 151 136 -267 C ATOM 2749 C GLU A 153 25.623 -30.774 -12.007 1.00 11.34 C ANISOU 2749 C GLU A 153 1323 1364 1620 107 39 -232 C ATOM 2750 O GLU A 153 25.309 -31.825 -11.434 1.00 12.30 O ANISOU 2750 O GLU A 153 1454 1428 1792 122 44 -203 O ATOM 2751 CB AGLU A 153 27.938 -30.590 -12.942 0.65 15.47 C ANISOU 2751 CB AGLU A 153 1758 1911 2210 215 179 -167 C ATOM 2752 CB BGLU A 153 27.931 -30.438 -12.874 0.35 15.44 C ANISOU 2752 CB BGLU A 153 1747 1921 2200 206 166 -165 C ATOM 2753 CG AGLU A 153 28.481 -31.650 -11.985 0.65 17.02 C ANISOU 2753 CG AGLU A 153 1866 2080 2519 288 201 -48 C ATOM 2754 CG BGLU A 153 28.973 -30.730 -13.931 0.35 22.89 C ANISOU 2754 CG BGLU A 153 2689 2825 3183 286 310 -162 C ATOM 2755 CD AGLU A 153 29.947 -31.476 -11.650 0.65 26.48 C ANISOU 2755 CD AGLU A 153 2893 3368 3802 344 225 107 C ATOM 2756 CD BGLU A 153 30.336 -30.171 -13.564 0.35 28.82 C ANISOU 2756 CD BGLU A 153 3266 3687 3996 315 316 -26 C ATOM 2757 OE1AGLU A 153 30.601 -30.598 -12.249 0.65 28.02 O ANISOU 2757 OE1AGLU A 153 3047 3632 3967 325 243 106 O ATOM 2758 OE1BGLU A 153 30.700 -29.095 -14.083 0.35 28.16 O ANISOU 2758 OE1BGLU A 153 3168 3677 3853 262 304 -40 O ATOM 2759 OE2AGLU A 153 30.441 -32.222 -10.776 0.65 32.97 O ANISOU 2759 OE2AGLU A 153 3606 4199 4722 398 216 254 O ATOM 2760 OE2BGLU A 153 31.036 -30.800 -12.742 0.35 34.37 O ANISOU 2760 OE2BGLU A 153 3838 4412 4808 378 323 116 O ATOM 0 H AGLU A 153 26.542 -29.226 -14.459 0.65 13.40 H new ATOM 0 H BGLU A 153 26.538 -29.229 -14.477 0.35 13.40 H new ATOM 0 HA AGLU A 153 26.378 -31.702 -13.672 0.65 12.76 H new ATOM 0 HA BGLU A 153 26.470 -31.679 -13.642 0.35 12.76 H new ATOM 0 HB2AGLU A 153 28.459 -30.597 -13.760 0.65 15.44 H new ATOM 0 HB2BGLU A 153 27.970 -29.494 -12.656 0.35 15.44 H new ATOM 0 HB3AGLU A 153 28.045 -29.712 -12.545 0.65 15.44 H new ATOM 0 HB3BGLU A 153 28.165 -30.925 -12.068 0.35 15.44 H new ATOM 0 HG2AGLU A 153 27.965 -31.627 -11.164 0.65 22.89 H new ATOM 0 HG2BGLU A 153 29.042 -31.689 -14.058 0.35 22.89 H new ATOM 0 HG3AGLU A 153 28.349 -32.527 -12.378 0.65 22.89 H new ATOM 0 HG3BGLU A 153 28.687 -30.352 -14.777 0.35 22.89 H new ATOM 2773 N ALA A 154 25.251 -29.572 -11.558 1.00 11.76 N ANISOU 2773 N ALA A 154 1352 1496 1619 56 -27 -232 N ATOM 2774 CA ALA A 154 24.386 -29.437 -10.394 1.00 10.12 C ANISOU 2774 CA ALA A 154 1133 1314 1397 17 -79 -210 C ATOM 2775 C ALA A 154 23.026 -30.068 -10.650 1.00 13.17 C ANISOU 2775 C ALA A 154 1560 1654 1788 -5 -91 -240 C ATOM 2776 O ALA A 154 22.473 -30.741 -9.774 1.00 12.72 O ANISOU 2776 O ALA A 154 1492 1588 1755 -19 -105 -204 O ATOM 2777 CB ALA A 154 24.233 -27.959 -10.030 1.00 9.66 C ANISOU 2777 CB ALA A 154 1082 1308 1278 -25 -96 -223 C ATOM 0 H ALA A 154 25.490 -28.827 -11.915 1.00 11.76 H new ATOM 0 HA ALA A 154 24.795 -29.905 -9.649 1.00 10.12 H new ATOM 0 HB1 ALA A 154 23.656 -27.875 -9.255 1.00 9.66 H new ATOM 0 HB2 ALA A 154 25.104 -27.584 -9.827 1.00 9.66 H new ATOM 0 HB3 ALA A 154 23.841 -27.480 -10.777 1.00 9.66 H new ATOM 2783 N MET A 155 22.469 -29.865 -11.850 1.00 14.57 N ANISOU 2783 N MET A 155 1783 1818 1936 -30 -98 -287 N ATOM 2784 CA MET A 155 21.186 -30.476 -12.185 1.00 11.18 C ANISOU 2784 CA MET A 155 1377 1370 1500 -92 -137 -289 C ATOM 2785 C MET A 155 21.276 -31.995 -12.149 1.00 11.11 C ANISOU 2785 C MET A 155 1430 1269 1521 -110 -113 -304 C ATOM 2786 O MET A 155 20.391 -32.663 -11.601 1.00 12.77 O ANISOU 2786 O MET A 155 1632 1466 1755 -159 -144 -273 O ATOM 2787 CB MET A 155 20.724 -30.008 -13.565 1.00 12.23 C ANISOU 2787 CB MET A 155 1550 1527 1571 -148 -173 -313 C ATOM 2788 CG MET A 155 20.312 -28.542 -13.615 1.00 21.49 C ANISOU 2788 CG MET A 155 2656 2770 2739 -124 -195 -265 C ATOM 2789 SD MET A 155 18.728 -28.192 -12.820 1.00 18.92 S ANISOU 2789 SD MET A 155 2223 2494 2473 -124 -223 -167 S ATOM 2790 CE MET A 155 17.618 -29.107 -13.881 1.00 26.73 C ANISOU 2790 CE MET A 155 3210 3519 3428 -259 -329 -125 C ATOM 0 H MET A 155 22.815 -29.383 -12.473 1.00 14.57 H new ATOM 0 HA MET A 155 20.536 -30.197 -11.521 1.00 11.18 H new ATOM 0 HB2 MET A 155 21.440 -30.155 -14.203 1.00 12.23 H new ATOM 0 HB3 MET A 155 19.975 -30.555 -13.848 1.00 12.23 H new ATOM 0 HG2 MET A 155 21.001 -28.008 -13.190 1.00 21.49 H new ATOM 0 HG3 MET A 155 20.267 -28.260 -14.542 1.00 21.49 H new ATOM 0 HE1 MET A 155 16.701 -28.941 -13.610 1.00 26.73 H new ATOM 0 HE2 MET A 155 17.740 -28.822 -14.800 1.00 26.73 H new ATOM 0 HE3 MET A 155 17.810 -30.055 -13.809 1.00 26.73 H new ATOM 2800 N ASP A 156 22.336 -32.561 -12.729 1.00 12.77 N ANISOU 2800 N ASP A 156 1708 1402 1742 -67 -37 -344 N ATOM 2801 CA ASP A 156 22.464 -34.014 -12.781 1.00 11.87 C ANISOU 2801 CA ASP A 156 1686 1152 1671 -68 27 -362 C ATOM 2802 C ASP A 156 22.514 -34.609 -11.383 1.00 10.99 C ANISOU 2802 C ASP A 156 1501 1029 1645 -24 19 -270 C ATOM 2803 O ASP A 156 21.858 -35.618 -11.105 1.00 12.77 O ANISOU 2803 O ASP A 156 1781 1174 1896 -75 15 -260 O ATOM 2804 CB ASP A 156 23.714 -34.419 -13.553 1.00 13.24 C ANISOU 2804 CB ASP A 156 1932 1230 1867 15 162 -401 C ATOM 2805 CG ASP A 156 23.648 -34.045 -15.024 1.00 26.59 C ANISOU 2805 CG ASP A 156 3744 2916 3444 -54 189 -502 C ATOM 2806 OD1 ASP A 156 22.544 -33.762 -15.536 1.00 21.29 O ANISOU 2806 OD1 ASP A 156 3117 2295 2676 -189 87 -534 O ATOM 2807 OD2 ASP A 156 24.711 -34.052 -15.671 1.00 22.87 O ANISOU 2807 OD2 ASP A 156 3311 2399 2979 21 316 -530 O ATOM 0 H ASP A 156 22.983 -32.126 -13.093 1.00 12.77 H new ATOM 0 HA ASP A 156 21.682 -34.360 -13.239 1.00 11.87 H new ATOM 0 HB2 ASP A 156 24.488 -33.995 -13.151 1.00 13.24 H new ATOM 0 HB3 ASP A 156 23.842 -35.377 -13.473 1.00 13.24 H new ATOM 2812 N ILE A 157 23.305 -34.005 -10.492 1.00 13.08 N ANISOU 2812 N ILE A 157 1651 1378 1940 47 9 -193 N ATOM 2813 CA ILE A 157 23.373 -34.482 -9.114 1.00 13.87 C ANISOU 2813 CA ILE A 157 1684 1497 2089 63 -18 -86 C ATOM 2814 C ILE A 157 22.025 -34.315 -8.431 1.00 12.58 C ANISOU 2814 C ILE A 157 1513 1385 1882 -23 -82 -84 C ATOM 2815 O ILE A 157 21.531 -35.229 -7.762 1.00 15.79 O ANISOU 2815 O ILE A 157 1929 1749 2322 -50 -88 -30 O ATOM 2816 CB ILE A 157 24.480 -33.746 -8.338 1.00 12.18 C ANISOU 2816 CB ILE A 157 1360 1393 1876 103 -43 2 C ATOM 2817 CG1 ILE A 157 25.842 -33.966 -8.998 1.00 15.78 C ANISOU 2817 CG1 ILE A 157 1777 1815 2405 200 34 41 C ATOM 2818 CG2 ILE A 157 24.513 -34.233 -6.891 1.00 13.69 C ANISOU 2818 CG2 ILE A 157 1494 1625 2081 85 -91 128 C ATOM 2819 CD1 ILE A 157 26.954 -33.096 -8.412 1.00 20.08 C ANISOU 2819 CD1 ILE A 157 2193 2499 2938 198 -16 142 C ATOM 0 H ILE A 157 23.803 -33.326 -10.665 1.00 13.08 H new ATOM 0 HA ILE A 157 23.594 -35.426 -9.124 1.00 13.87 H new ATOM 0 HB ILE A 157 24.285 -32.796 -8.350 1.00 12.18 H new ATOM 0 HG12 ILE A 157 26.090 -34.899 -8.907 1.00 15.78 H new ATOM 0 HG13 ILE A 157 25.766 -33.784 -9.948 1.00 15.78 H new ATOM 0 HG21 ILE A 157 25.212 -33.766 -6.408 1.00 13.69 H new ATOM 0 HG22 ILE A 157 23.657 -34.057 -6.470 1.00 13.69 H new ATOM 0 HG23 ILE A 157 24.691 -35.186 -6.874 1.00 13.69 H new ATOM 0 HD11 ILE A 157 27.787 -33.283 -8.872 1.00 20.08 H new ATOM 0 HD12 ILE A 157 26.726 -32.160 -8.524 1.00 20.08 H new ATOM 0 HD13 ILE A 157 27.055 -33.293 -7.468 1.00 20.08 H new ATOM 2831 N SER A 158 21.418 -33.132 -8.565 1.00 10.33 N ANISOU 2831 N SER A 158 1203 1188 1532 -57 -114 -123 N ATOM 2832 CA SER A 158 20.208 -32.854 -7.801 1.00 14.25 C ANISOU 2832 CA SER A 158 1666 1741 2007 -108 -136 -95 C ATOM 2833 C SER A 158 19.082 -33.796 -8.206 1.00 17.60 C ANISOU 2833 C SER A 158 2111 2116 2458 -180 -157 -90 C ATOM 2834 O SER A 158 18.308 -34.254 -7.357 1.00 14.92 O ANISOU 2834 O SER A 158 1741 1794 2136 -220 -161 -30 O ATOM 2835 CB SER A 158 19.797 -31.392 -7.976 1.00 15.19 C ANISOU 2835 CB SER A 158 1758 1932 2082 -100 -128 -123 C ATOM 2836 OG SER A 158 19.166 -31.167 -9.213 1.00 24.36 O ANISOU 2836 OG SER A 158 2921 3090 3246 -122 -153 -152 O ATOM 0 H SER A 158 21.684 -32.496 -9.079 1.00 10.33 H new ATOM 0 HA SER A 158 20.393 -33.007 -6.861 1.00 14.25 H new ATOM 0 HB2 SER A 158 19.198 -31.137 -7.257 1.00 15.19 H new ATOM 0 HB3 SER A 158 20.581 -30.826 -7.906 1.00 15.19 H new ATOM 0 HG SER A 158 19.566 -31.597 -9.814 1.00 24.36 H new ATOM 2842 N LYS A 159 18.993 -34.120 -9.496 1.00 13.09 N ANISOU 2842 N LYS A 159 1606 1490 1877 -221 -172 -150 N ATOM 2843 CA LYS A 159 17.968 -35.048 -9.956 1.00 12.60 C ANISOU 2843 CA LYS A 159 1589 1382 1815 -343 -213 -147 C ATOM 2844 C LYS A 159 18.199 -36.459 -9.433 1.00 13.91 C ANISOU 2844 C LYS A 159 1831 1421 2032 -359 -177 -127 C ATOM 2845 O LYS A 159 17.234 -37.196 -9.205 1.00 18.39 O ANISOU 2845 O LYS A 159 2407 1968 2612 -469 -212 -87 O ATOM 2846 CB LYS A 159 17.913 -35.058 -11.485 1.00 19.78 C ANISOU 2846 CB LYS A 159 2595 2261 2658 -423 -241 -224 C ATOM 2847 CG LYS A 159 17.433 -33.743 -12.093 1.00 29.22 C ANISOU 2847 CG LYS A 159 3706 3586 3810 -429 -297 -204 C ATOM 2848 CD LYS A 159 17.004 -33.919 -13.546 1.00 45.71 C ANISOU 2848 CD LYS A 159 5885 5677 5805 -575 -367 -241 C ATOM 2849 CE LYS A 159 17.081 -32.609 -14.310 1.00 60.66 C ANISOU 2849 CE LYS A 159 7725 7668 7653 -542 -398 -224 C ATOM 2850 NZ LYS A 159 16.590 -32.739 -15.715 1.00 73.43 N ANISOU 2850 NZ LYS A 159 9428 9320 9151 -715 -490 -233 N ATOM 0 H LYS A 159 19.511 -33.816 -10.112 1.00 13.09 H new ATOM 0 HA LYS A 159 17.118 -34.740 -9.603 1.00 12.60 H new ATOM 0 HB2 LYS A 159 18.796 -35.261 -11.831 1.00 19.78 H new ATOM 0 HB3 LYS A 159 17.324 -35.772 -11.774 1.00 19.78 H new ATOM 0 HG2 LYS A 159 16.689 -33.399 -11.575 1.00 29.22 H new ATOM 0 HG3 LYS A 159 18.143 -33.084 -12.042 1.00 29.22 H new ATOM 0 HD2 LYS A 159 17.571 -34.579 -13.975 1.00 45.71 H new ATOM 0 HD3 LYS A 159 16.097 -34.261 -13.578 1.00 45.71 H new ATOM 0 HE2 LYS A 159 16.556 -31.937 -13.848 1.00 60.66 H new ATOM 0 HE3 LYS A 159 17.999 -32.296 -14.319 1.00 60.66 H new ATOM 0 HZ1 LYS A 159 17.183 -32.377 -16.272 1.00 73.43 H new ATOM 0 HZ2 LYS A 159 16.483 -33.600 -15.914 1.00 73.43 H new ATOM 0 HZ3 LYS A 159 15.811 -32.317 -15.798 1.00 73.43 H new ATOM 2864 N LYS A 160 19.455 -36.865 -9.245 1.00 14.18 N ANISOU 2864 N LYS A 160 1910 1368 2112 -253 -105 -131 N ATOM 2865 CA ALYS A 160 19.742 -38.202 -8.735 0.59 13.78 C ANISOU 2865 CA ALYS A 160 1924 1173 2137 -239 -53 -82 C ATOM 2866 CA BLYS A 160 19.713 -38.208 -8.742 0.41 15.09 C ANISOU 2866 CA BLYS A 160 2092 1340 2302 -243 -55 -82 C ATOM 2867 C LYS A 160 19.622 -38.279 -7.221 1.00 16.16 C ANISOU 2867 C LYS A 160 2123 1548 2470 -216 -80 44 C ATOM 2868 O LYS A 160 19.203 -39.307 -6.689 1.00 18.40 O ANISOU 2868 O LYS A 160 2443 1750 2799 -264 -74 107 O ATOM 2869 CB ALYS A 160 21.155 -38.640 -9.120 0.59 20.41 C ANISOU 2869 CB ALYS A 160 2823 1890 3044 -108 56 -90 C ATOM 2870 CB BLYS A 160 21.087 -38.695 -9.211 0.41 20.33 C ANISOU 2870 CB BLYS A 160 2825 1869 3029 -118 57 -99 C ATOM 2871 CG ALYS A 160 21.379 -38.919 -10.582 0.59 21.72 C ANISOU 2871 CG ALYS A 160 3150 1929 3174 -132 136 -221 C ATOM 2872 CG BLYS A 160 21.486 -40.066 -8.669 0.41 30.34 C ANISOU 2872 CG BLYS A 160 4154 2963 4412 -64 138 -16 C ATOM 2873 CD ALYS A 160 22.841 -39.262 -10.819 0.59 28.50 C ANISOU 2873 CD ALYS A 160 4027 2677 4126 39 285 -199 C ATOM 2874 CD BLYS A 160 22.768 -40.581 -9.314 0.41 34.40 C ANISOU 2874 CD BLYS A 160 4738 3317 5015 83 295 -23 C ATOM 2875 CE ALYS A 160 23.132 -39.566 -12.277 0.59 35.49 C ANISOU 2875 CE ALYS A 160 5108 3417 4961 21 414 -343 C ATOM 2876 CE BLYS A 160 22.488 -41.559 -10.454 0.41 38.44 C ANISOU 2876 CE BLYS A 160 5502 3589 5514 13 415 -159 C ATOM 2877 NZ ALYS A 160 24.407 -40.327 -12.418 0.59 47.64 N ANISOU 2877 NZ ALYS A 160 6689 4778 6633 204 621 -301 N ATOM 2878 NZ BLYS A 160 21.933 -42.865 -9.985 0.41 28.01 N ANISOU 2878 NZ BLYS A 160 4300 2083 4258 -51 448 -116 N ATOM 0 H ALYS A 160 20.150 -36.384 -9.406 0.59 14.18 H new ATOM 0 H BLYS A 160 20.155 -36.389 -9.399 0.41 14.18 H new ATOM 0 HA ALYS A 160 19.083 -38.790 -9.136 0.59 15.09 H new ATOM 0 HA BLYS A 160 19.025 -38.789 -9.102 0.41 15.09 H new ATOM 0 HB2ALYS A 160 21.777 -37.950 -8.841 0.59 20.33 H new ATOM 0 HB2BLYS A 160 21.093 -38.728 -10.180 0.41 20.33 H new ATOM 0 HB3ALYS A 160 21.375 -39.440 -8.618 0.59 20.33 H new ATOM 0 HB3BLYS A 160 21.757 -38.046 -8.945 0.41 20.33 H new ATOM 0 HG2ALYS A 160 20.814 -39.653 -10.871 0.59 30.34 H new ATOM 0 HG2BLYS A 160 21.607 -40.011 -7.708 0.41 30.34 H new ATOM 0 HG3ALYS A 160 21.129 -38.145 -11.110 0.59 30.34 H new ATOM 0 HG3BLYS A 160 20.768 -40.698 -8.828 0.41 30.34 H new ATOM 0 HD2ALYS A 160 23.396 -38.522 -10.528 0.59 34.40 H new ATOM 0 HD2BLYS A 160 23.282 -39.831 -9.652 0.41 34.40 H new ATOM 0 HD3ALYS A 160 23.083 -40.029 -10.276 0.59 34.40 H new ATOM 0 HD3BLYS A 160 23.313 -41.018 -8.642 0.41 34.40 H new ATOM 0 HE2ALYS A 160 22.401 -40.079 -12.656 0.59 38.44 H new ATOM 0 HE2BLYS A 160 21.863 -41.153 -11.075 0.41 38.44 H new ATOM 0 HE3ALYS A 160 23.188 -38.738 -12.779 0.59 38.44 H new ATOM 0 HE3BLYS A 160 23.310 -41.720 -10.943 0.41 38.44 H new ATOM 0 HZ1ALYS A 160 24.559 -40.495 -13.279 0.59 28.01 H new ATOM 0 HZ1BLYS A 160 21.965 -43.457 -10.649 0.41 28.01 H new ATOM 0 HZ2ALYS A 160 25.078 -39.846 -12.087 0.59 28.01 H new ATOM 0 HZ2BLYS A 160 22.415 -43.163 -9.299 0.41 28.01 H new ATOM 0 HZ3ALYS A 160 24.345 -41.095 -11.973 0.59 28.01 H new ATOM 0 HZ3BLYS A 160 21.088 -42.754 -9.728 0.41 28.01 H new ATOM 2905 N GLU A 161 19.981 -37.206 -6.514 1.00 13.48 N ANISOU 2905 N GLU A 161 1677 1354 2091 -164 -105 80 N ATOM 2906 CA GLU A 161 20.191 -37.277 -5.073 1.00 11.57 C ANISOU 2906 CA GLU A 161 1371 1181 1845 -152 -122 199 C ATOM 2907 C GLU A 161 19.192 -36.502 -4.223 1.00 19.53 C ANISOU 2907 C GLU A 161 2327 2320 2772 -218 -141 211 C ATOM 2908 O GLU A 161 19.229 -36.642 -2.995 1.00 19.25 O ANISOU 2908 O GLU A 161 2270 2340 2702 -240 -146 303 O ATOM 2909 CB GLU A 161 21.601 -36.765 -4.738 1.00 15.55 C ANISOU 2909 CB GLU A 161 1818 1744 2345 -69 -127 252 C ATOM 2910 CG GLU A 161 22.716 -37.540 -5.400 1.00 19.40 C ANISOU 2910 CG GLU A 161 2320 2109 2942 34 -70 285 C ATOM 2911 CD GLU A 161 22.766 -38.984 -4.946 1.00 38.65 C ANISOU 2911 CD GLU A 161 4790 4411 5485 63 -33 399 C ATOM 2912 OE1 GLU A 161 22.228 -39.288 -3.858 1.00 39.04 O ANISOU 2912 OE1 GLU A 161 4817 4508 5508 0 -82 491 O ATOM 2913 OE2 GLU A 161 23.342 -39.815 -5.680 1.00 47.91 O ANISOU 2913 OE2 GLU A 161 6023 5414 6765 151 64 398 O ATOM 0 H GLU A 161 20.108 -36.426 -6.854 1.00 13.48 H new ATOM 0 HA GLU A 161 20.067 -38.213 -4.850 1.00 11.57 H new ATOM 0 HB2 GLU A 161 21.667 -35.834 -5.002 1.00 15.55 H new ATOM 0 HB3 GLU A 161 21.725 -36.797 -3.777 1.00 15.55 H new ATOM 0 HG2 GLU A 161 22.600 -37.510 -6.363 1.00 19.40 H new ATOM 0 HG3 GLU A 161 23.564 -37.113 -5.204 1.00 19.40 H new ATOM 2920 N MET A 162 18.321 -35.690 -4.810 1.00 15.18 N ANISOU 2920 N MET A 162 1839 1976 1953 -252 -75 226 N ATOM 2921 CA AMET A 162 17.450 -34.792 -4.059 0.59 17.90 C ANISOU 2921 CA AMET A 162 2147 2398 2257 -300 -76 215 C ATOM 2922 CA BMET A 162 17.440 -34.875 -3.999 0.41 16.07 C ANISOU 2922 CA BMET A 162 1916 2165 2025 -301 -77 220 C ATOM 2923 C MET A 162 16.010 -34.957 -4.510 1.00 16.42 C ANISOU 2923 C MET A 162 1980 2183 2077 -350 -75 198 C ATOM 2924 O MET A 162 15.767 -35.194 -5.698 1.00 13.88 O ANISOU 2924 O MET A 162 1692 1800 1781 -349 -73 166 O ATOM 2925 CB AMET A 162 17.824 -33.319 -4.271 0.59 20.21 C ANISOU 2925 CB AMET A 162 2404 2746 2529 -292 -65 158 C ATOM 2926 CB BMET A 162 17.941 -33.422 -3.986 0.41 20.10 C ANISOU 2926 CB BMET A 162 2386 2743 2510 -291 -67 170 C ATOM 2927 CG AMET A 162 19.120 -32.863 -3.674 0.59 20.10 C ANISOU 2927 CG AMET A 162 2356 2791 2492 -264 -66 167 C ATOM 2928 CG BMET A 162 19.341 -33.306 -3.359 0.41 15.18 C ANISOU 2928 CG BMET A 162 1732 2168 1868 -257 -71 195 C ATOM 2929 SD AMET A 162 19.459 -31.192 -4.264 0.59 14.17 S ANISOU 2929 SD AMET A 162 1583 2073 1727 -265 -49 90 S ATOM 2930 SD BMET A 162 20.378 -31.960 -3.961 0.41 24.46 S ANISOU 2930 SD BMET A 162 2881 3380 3031 -236 -59 133 S ATOM 2931 CE AMET A 162 20.666 -30.672 -3.054 0.59 19.06 C ANISOU 2931 CE AMET A 162 2154 2791 2298 -267 -51 107 C ATOM 2932 CE BMET A 162 19.494 -30.561 -3.291 0.41 12.08 C ANISOU 2932 CE BMET A 162 1287 1876 1426 -289 -45 88 C ATOM 0 H AMET A 162 18.217 -35.644 -5.662 0.59 15.18 H new ATOM 0 H BMET A 162 18.227 -35.599 -5.660 0.41 15.18 H new ATOM 0 HA AMET A 162 17.556 -35.024 -3.123 0.59 16.07 H new ATOM 0 HA BMET A 162 17.446 -35.212 -3.089 0.41 16.07 H new ATOM 0 HB2AMET A 162 17.853 -33.148 -5.225 0.59 20.10 H new ATOM 0 HB2BMET A 162 17.964 -33.079 -4.893 0.41 20.10 H new ATOM 0 HB3AMET A 162 17.112 -32.770 -3.906 0.59 20.10 H new ATOM 0 HB3BMET A 162 17.317 -32.869 -3.490 0.41 20.10 H new ATOM 0 HG2AMET A 162 19.069 -32.875 -2.705 0.59 15.18 H new ATOM 0 HG2BMET A 162 19.237 -33.205 -2.400 0.41 15.18 H new ATOM 0 HG3AMET A 162 19.839 -33.463 -3.928 0.59 15.18 H new ATOM 0 HG3BMET A 162 19.811 -34.142 -3.507 0.41 15.18 H new ATOM 0 HE1AMET A 162 20.716 -29.703 -3.042 0.59 12.08 H new ATOM 0 HE1BMET A 162 20.020 -29.755 -3.417 0.41 12.08 H new ATOM 0 HE2AMET A 162 20.404 -30.993 -2.177 0.59 12.08 H new ATOM 0 HE2BMET A 162 18.644 -30.466 -3.748 0.41 12.08 H new ATOM 0 HE3AMET A 162 21.534 -31.037 -3.285 0.59 12.08 H new ATOM 0 HE3BMET A 162 19.338 -30.700 -2.344 0.41 12.08 H new ATOM 2951 N PRO A 163 15.039 -34.790 -3.615 1.00 15.24 N ANISOU 2951 N PRO A 163 1804 2087 1898 -396 -76 215 N ATOM 2952 CA PRO A 163 13.636 -34.814 -4.036 1.00 17.52 C ANISOU 2952 CA PRO A 163 2096 2370 2189 -444 -75 199 C ATOM 2953 C PRO A 163 13.295 -33.567 -4.827 1.00 15.32 C ANISOU 2953 C PRO A 163 1794 2114 1913 -434 -65 138 C ATOM 2954 O PRO A 163 13.961 -32.531 -4.683 1.00 14.42 O ANISOU 2954 O PRO A 163 1655 2034 1790 -404 -55 109 O ATOM 2955 CB PRO A 163 12.868 -34.855 -2.708 1.00 19.68 C ANISOU 2955 CB PRO A 163 2335 2716 2425 -490 -73 234 C ATOM 2956 CG PRO A 163 13.764 -34.158 -1.759 1.00 24.89 C ANISOU 2956 CG PRO A 163 2960 3442 3054 -466 -66 236 C ATOM 2957 CD PRO A 163 15.163 -34.541 -2.167 1.00 17.74 C ANISOU 2957 CD PRO A 163 2080 2488 2172 -413 -76 249 C ATOM 0 HA PRO A 163 13.422 -35.561 -4.616 1.00 17.52 H new ATOM 0 HB2 PRO A 163 12.009 -34.409 -2.780 1.00 19.68 H new ATOM 0 HB3 PRO A 163 12.692 -35.766 -2.427 1.00 19.68 H new ATOM 0 HG2 PRO A 163 13.639 -33.197 -1.803 1.00 24.89 H new ATOM 0 HG3 PRO A 163 13.581 -34.427 -0.845 1.00 24.89 H new ATOM 0 HD2 PRO A 163 15.797 -33.832 -1.979 1.00 17.74 H new ATOM 0 HD3 PRO A 163 15.471 -35.330 -1.693 1.00 17.74 H new ATOM 2965 N PRO A 164 12.258 -33.625 -5.668 1.00 15.68 N ANISOU 2965 N PRO A 164 1846 2142 1969 -463 -69 122 N ATOM 2966 CA PRO A 164 11.946 -32.485 -6.544 1.00 17.46 C ANISOU 2966 CA PRO A 164 2049 2382 2202 -449 -65 77 C ATOM 2967 C PRO A 164 11.483 -31.238 -5.810 1.00 16.21 C ANISOU 2967 C PRO A 164 1836 2293 2029 -442 -47 58 C ATOM 2968 O PRO A 164 11.427 -30.171 -6.435 1.00 15.81 O ANISOU 2968 O PRO A 164 1769 2246 1991 -417 -41 26 O ATOM 2969 CB PRO A 164 10.838 -33.031 -7.456 1.00 19.90 C ANISOU 2969 CB PRO A 164 2371 2671 2518 -492 -78 79 C ATOM 2970 CG PRO A 164 10.292 -34.219 -6.762 1.00 25.68 C ANISOU 2970 CG PRO A 164 3120 3397 3242 -541 -84 120 C ATOM 2971 CD PRO A 164 11.394 -34.788 -5.928 1.00 18.88 C ANISOU 2971 CD PRO A 164 2282 2511 2381 -515 -81 148 C ATOM 0 HA PRO A 164 12.738 -32.184 -7.016 1.00 17.46 H new ATOM 0 HB2 PRO A 164 10.148 -32.365 -7.601 1.00 19.90 H new ATOM 0 HB3 PRO A 164 11.191 -33.269 -8.328 1.00 19.90 H new ATOM 0 HG2 PRO A 164 9.535 -33.974 -6.208 1.00 25.68 H new ATOM 0 HG3 PRO A 164 9.974 -34.874 -7.403 1.00 25.68 H new ATOM 0 HD2 PRO A 164 11.057 -35.174 -5.105 1.00 18.88 H new ATOM 0 HD3 PRO A 164 11.871 -35.491 -6.397 1.00 18.88 H new ATOM 2979 N THR A 165 11.155 -31.332 -4.522 1.00 15.18 N ANISOU 2979 N THR A 165 1679 2216 1874 -463 -37 77 N ATOM 2980 CA THR A 165 10.772 -30.172 -3.724 1.00 11.78 C ANISOU 2980 CA THR A 165 1199 1849 1427 -457 -11 49 C ATOM 2981 C THR A 165 11.927 -29.570 -2.945 1.00 12.07 C ANISOU 2981 C THR A 165 1233 1910 1444 -436 3 31 C ATOM 2982 O THR A 165 11.730 -28.567 -2.251 1.00 13.80 O ANISOU 2982 O THR A 165 1419 2177 1647 -435 31 -3 O ATOM 2983 CB THR A 165 9.681 -30.544 -2.723 1.00 12.86 C ANISOU 2983 CB THR A 165 1301 2048 1537 -502 -1 72 C ATOM 2984 OG1 THR A 165 10.099 -31.704 -1.995 1.00 14.01 O ANISOU 2984 OG1 THR A 165 1471 2194 1660 -532 -15 122 O ATOM 2985 CG2 THR A 165 8.364 -30.802 -3.427 1.00 15.55 C ANISOU 2985 CG2 THR A 165 1625 2391 1893 -527 -9 81 C ATOM 0 H THR A 165 11.149 -32.074 -4.087 1.00 15.18 H new ATOM 0 HA THR A 165 10.455 -29.514 -4.362 1.00 11.78 H new ATOM 0 HB THR A 165 9.543 -29.805 -2.110 1.00 12.86 H new ATOM 0 HG1 THR A 165 9.765 -32.390 -2.345 1.00 14.01 H new ATOM 0 HG21 THR A 165 7.687 -31.036 -2.773 1.00 15.55 H new ATOM 0 HG22 THR A 165 8.090 -30.003 -3.903 1.00 15.55 H new ATOM 0 HG23 THR A 165 8.471 -31.532 -4.056 1.00 15.55 H new ATOM 2993 N ASN A 166 13.103 -30.166 -3.000 1.00 11.73 N ANISOU 2993 N ASN A 166 1219 1839 1397 -422 -13 53 N ATOM 2994 CA ASN A 166 14.235 -29.646 -2.245 1.00 14.37 C ANISOU 2994 CA ASN A 166 1543 2211 1705 -411 -4 42 C ATOM 2995 C ASN A 166 14.496 -28.191 -2.638 1.00 11.70 C ANISOU 2995 C ASN A 166 1195 1874 1377 -390 17 -19 C ATOM 2996 O ASN A 166 14.684 -27.909 -3.829 1.00 12.90 O ANISOU 2996 O ASN A 166 1368 1974 1561 -364 11 -35 O ATOM 2997 CB ASN A 166 15.476 -30.493 -2.507 1.00 13.84 C ANISOU 2997 CB ASN A 166 1504 2111 1645 -386 -26 77 C ATOM 2998 CG ASN A 166 16.695 -29.974 -1.774 1.00 20.59 C ANISOU 2998 CG ASN A 166 2338 3020 2467 -379 -22 72 C ATOM 2999 OD1 ASN A 166 17.331 -29.016 -2.208 1.00 18.87 O ANISOU 2999 OD1 ASN A 166 2117 2802 2252 -362 -11 28 O ATOM 3000 ND2 ASN A 166 17.029 -30.605 -0.660 1.00 23.95 N ANISOU 3000 ND2 ASN A 166 2747 3495 2856 -396 -32 122 N ATOM 0 H ASN A 166 13.271 -30.870 -3.465 1.00 11.73 H new ATOM 0 HA ASN A 166 14.028 -29.685 -1.298 1.00 14.37 H new ATOM 0 HB2 ASN A 166 15.303 -31.408 -2.235 1.00 13.84 H new ATOM 0 HB3 ASN A 166 15.658 -30.510 -3.460 1.00 13.84 H new ATOM 0 HD21 ASN A 166 17.715 -30.348 -0.209 1.00 23.95 H new ATOM 0 HD22 ASN A 166 16.560 -31.272 -0.387 1.00 23.95 H new ATOM 3007 N PRO A 167 14.515 -27.248 -1.693 1.00 12.11 N ANISOU 3007 N PRO A 167 1220 1982 1399 -404 45 -55 N ATOM 3008 CA PRO A 167 14.684 -25.833 -2.078 1.00 13.77 C ANISOU 3008 CA PRO A 167 1430 2176 1626 -387 70 -114 C ATOM 3009 C PRO A 167 15.961 -25.528 -2.843 1.00 15.30 C ANISOU 3009 C PRO A 167 1647 2336 1829 -367 58 -123 C ATOM 3010 O PRO A 167 15.960 -24.605 -3.668 1.00 11.98 O ANISOU 3010 O PRO A 167 1239 1875 1438 -349 68 -155 O ATOM 3011 CB PRO A 167 14.654 -25.107 -0.727 1.00 13.89 C ANISOU 3011 CB PRO A 167 1419 2261 1599 -417 104 -152 C ATOM 3012 CG PRO A 167 13.810 -25.972 0.126 1.00 19.22 C ANISOU 3012 CG PRO A 167 2072 2986 2246 -446 102 -117 C ATOM 3013 CD PRO A 167 14.173 -27.377 -0.265 1.00 16.44 C ANISOU 3013 CD PRO A 167 1740 2608 1900 -443 59 -47 C ATOM 0 HA PRO A 167 13.994 -25.555 -2.701 1.00 13.77 H new ATOM 0 HB2 PRO A 167 15.545 -25.006 -0.358 1.00 13.89 H new ATOM 0 HB3 PRO A 167 14.279 -24.216 -0.811 1.00 13.89 H new ATOM 0 HG2 PRO A 167 13.983 -25.813 1.067 1.00 19.22 H new ATOM 0 HG3 PRO A 167 12.867 -25.799 -0.022 1.00 19.22 H new ATOM 0 HD2 PRO A 167 14.921 -27.712 0.254 1.00 16.44 H new ATOM 0 HD3 PRO A 167 13.434 -27.990 -0.127 1.00 16.44 H new ATOM 3021 N ILE A 168 17.059 -26.241 -2.582 1.00 15.35 N ANISOU 3021 N ILE A 168 1657 2364 1811 -369 38 -92 N ATOM 3022 CA ILE A 168 18.272 -26.027 -3.368 1.00 12.71 C ANISOU 3022 CA ILE A 168 1337 2006 1485 -349 29 -100 C ATOM 3023 C ILE A 168 18.036 -26.457 -4.807 1.00 10.59 C ANISOU 3023 C ILE A 168 1096 1667 1260 -320 14 -89 C ATOM 3024 O ILE A 168 18.360 -25.730 -5.755 1.00 13.64 O ANISOU 3024 O ILE A 168 1496 2022 1664 -308 18 -115 O ATOM 3025 CB ILE A 168 19.468 -26.786 -2.765 1.00 13.86 C ANISOU 3025 CB ILE A 168 1469 2198 1598 -348 11 -61 C ATOM 3026 CG1 ILE A 168 19.688 -26.427 -1.298 1.00 21.08 C ANISOU 3026 CG1 ILE A 168 2352 3200 2456 -389 21 -65 C ATOM 3027 CG2 ILE A 168 20.732 -26.480 -3.568 1.00 16.96 C ANISOU 3027 CG2 ILE A 168 1866 2580 1996 -328 6 -73 C ATOM 3028 CD1 ILE A 168 20.564 -27.448 -0.584 1.00 32.31 C ANISOU 3028 CD1 ILE A 168 3754 4676 3847 -387 -5 -1 C ATOM 0 H ILE A 168 17.121 -26.840 -1.968 1.00 15.35 H new ATOM 0 HA ILE A 168 18.486 -25.081 -3.351 1.00 12.71 H new ATOM 0 HB ILE A 168 19.270 -27.734 -2.810 1.00 13.86 H new ATOM 0 HG12 ILE A 168 20.100 -25.551 -1.239 1.00 21.08 H new ATOM 0 HG13 ILE A 168 18.830 -26.368 -0.849 1.00 21.08 H new ATOM 0 HG21 ILE A 168 21.483 -26.960 -3.185 1.00 16.96 H new ATOM 0 HG22 ILE A 168 20.606 -26.759 -4.489 1.00 16.96 H new ATOM 0 HG23 ILE A 168 20.910 -25.527 -3.541 1.00 16.96 H new ATOM 0 HD11 ILE A 168 20.679 -27.184 0.342 1.00 32.31 H new ATOM 0 HD12 ILE A 168 20.141 -28.320 -0.621 1.00 32.31 H new ATOM 0 HD13 ILE A 168 21.431 -27.491 -1.018 1.00 32.31 H new ATOM 3040 N ARG A 169 17.483 -27.657 -4.988 1.00 13.97 N ANISOU 3040 N ARG A 169 1536 2071 1702 -316 -3 -51 N ATOM 3041 CA ARG A 169 17.154 -28.135 -6.326 1.00 11.65 C ANISOU 3041 CA ARG A 169 1270 1715 1440 -301 -16 -47 C ATOM 3042 C ARG A 169 16.229 -27.161 -7.048 1.00 11.18 C ANISOU 3042 C ARG A 169 1209 1639 1400 -305 -8 -75 C ATOM 3043 O ARG A 169 16.420 -26.879 -8.236 1.00 10.80 O ANISOU 3043 O ARG A 169 1178 1558 1369 -294 -14 -86 O ATOM 3044 CB ARG A 169 16.511 -29.520 -6.240 1.00 11.91 C ANISOU 3044 CB ARG A 169 1319 1724 1481 -312 -30 -7 C ATOM 3045 CG ARG A 169 16.093 -30.079 -7.591 1.00 11.83 C ANISOU 3045 CG ARG A 169 1343 1656 1498 -311 -41 -10 C ATOM 3046 CD ARG A 169 15.740 -31.560 -7.528 1.00 15.84 C ANISOU 3046 CD ARG A 169 1878 2126 2014 -326 -53 25 C ATOM 3047 NE ARG A 169 15.060 -31.961 -8.759 1.00 16.80 N ANISOU 3047 NE ARG A 169 2029 2204 2152 -345 -60 11 N ATOM 3048 CZ ARG A 169 14.625 -33.188 -9.020 1.00 17.77 C ANISOU 3048 CZ ARG A 169 2188 2281 2285 -370 -67 29 C ATOM 3049 NH1 ARG A 169 14.797 -34.164 -8.141 1.00 19.53 N ANISOU 3049 NH1 ARG A 169 2424 2486 2510 -372 -69 68 N ATOM 3050 NH2 ARG A 169 14.008 -33.432 -10.164 1.00 16.85 N ANISOU 3050 NH2 ARG A 169 2094 2136 2171 -398 -74 9 N ATOM 0 H ARG A 169 17.292 -28.204 -4.353 1.00 13.97 H new ATOM 0 HA ARG A 169 17.975 -28.197 -6.839 1.00 11.65 H new ATOM 0 HB2 ARG A 169 17.136 -30.134 -5.823 1.00 11.91 H new ATOM 0 HB3 ARG A 169 15.733 -29.472 -5.663 1.00 11.91 H new ATOM 0 HG2 ARG A 169 15.328 -29.581 -7.921 1.00 11.83 H new ATOM 0 HG3 ARG A 169 16.813 -29.948 -8.228 1.00 11.83 H new ATOM 0 HD2 ARG A 169 16.545 -32.088 -7.407 1.00 15.84 H new ATOM 0 HD3 ARG A 169 15.170 -31.733 -6.763 1.00 15.84 H new ATOM 0 HE ARG A 169 14.932 -31.357 -9.358 1.00 16.80 H new ATOM 0 HH11 ARG A 169 15.193 -34.005 -7.394 1.00 19.53 H new ATOM 0 HH12 ARG A 169 14.513 -34.956 -8.317 1.00 19.53 H new ATOM 0 HH21 ARG A 169 13.891 -32.798 -10.733 1.00 16.85 H new ATOM 0 HH22 ARG A 169 13.724 -34.225 -10.339 1.00 16.85 H new ATOM 3064 N LEU A 170 15.224 -26.638 -6.346 1.00 10.45 N ANISOU 3064 N LEU A 170 1091 1573 1306 -318 6 -82 N ATOM 3065 CA LEU A 170 14.275 -25.716 -6.968 1.00 10.44 C ANISOU 3065 CA LEU A 170 1079 1556 1330 -310 14 -99 C ATOM 3066 C LEU A 170 14.936 -24.402 -7.363 1.00 10.34 C ANISOU 3066 C LEU A 170 1073 1527 1328 -294 29 -132 C ATOM 3067 O LEU A 170 14.675 -23.872 -8.450 1.00 10.28 O ANISOU 3067 O LEU A 170 1074 1486 1345 -281 22 -131 O ATOM 3068 CB LEU A 170 13.111 -25.442 -6.018 1.00 10.73 C ANISOU 3068 CB LEU A 170 1080 1631 1365 -320 33 -103 C ATOM 3069 CG LEU A 170 12.132 -26.582 -5.746 1.00 10.92 C ANISOU 3069 CG LEU A 170 1092 1676 1381 -346 20 -68 C ATOM 3070 CD1 LEU A 170 11.128 -26.151 -4.690 1.00 11.28 C ANISOU 3070 CD1 LEU A 170 1094 1774 1417 -356 47 -79 C ATOM 3071 CD2 LEU A 170 11.421 -26.980 -7.015 1.00 13.37 C ANISOU 3071 CD2 LEU A 170 1410 1957 1714 -348 -4 -48 C ATOM 0 H LEU A 170 15.075 -26.803 -5.515 1.00 10.45 H new ATOM 0 HA LEU A 170 13.946 -26.138 -7.777 1.00 10.44 H new ATOM 0 HB2 LEU A 170 13.481 -25.157 -5.168 1.00 10.73 H new ATOM 0 HB3 LEU A 170 12.606 -24.694 -6.373 1.00 10.73 H new ATOM 0 HG LEU A 170 12.625 -27.351 -5.420 1.00 10.92 H new ATOM 0 HD11 LEU A 170 10.507 -26.876 -4.519 1.00 11.28 H new ATOM 0 HD12 LEU A 170 11.596 -25.926 -3.871 1.00 11.28 H new ATOM 0 HD13 LEU A 170 10.639 -25.375 -5.006 1.00 11.28 H new ATOM 0 HD21 LEU A 170 10.803 -27.704 -6.827 1.00 13.37 H new ATOM 0 HD22 LEU A 170 10.930 -26.219 -7.363 1.00 13.37 H new ATOM 0 HD23 LEU A 170 12.071 -27.273 -7.672 1.00 13.37 H new ATOM 3083 N GLY A 171 15.749 -23.833 -6.475 1.00 10.41 N ANISOU 3083 N GLY A 171 1079 1561 1316 -302 49 -159 N ATOM 3084 CA GLY A 171 16.431 -22.587 -6.793 1.00 12.72 C ANISOU 3084 CA GLY A 171 1384 1833 1616 -299 65 -192 C ATOM 3085 C GLY A 171 17.442 -22.746 -7.907 1.00 10.17 C ANISOU 3085 C GLY A 171 1084 1488 1294 -294 46 -182 C ATOM 3086 O GLY A 171 17.638 -21.829 -8.711 1.00 10.17 O ANISOU 3086 O GLY A 171 1098 1455 1310 -290 51 -193 O ATOM 0 H GLY A 171 15.916 -24.150 -5.693 1.00 10.41 H new ATOM 0 HA2 GLY A 171 15.775 -21.919 -7.049 1.00 12.72 H new ATOM 0 HA3 GLY A 171 16.879 -22.255 -5.999 1.00 12.72 H new ATOM 3090 N LEU A 172 18.093 -23.906 -7.968 1.00 10.07 N ANISOU 3090 N LEU A 172 1074 1489 1262 -293 27 -160 N ATOM 3091 CA LEU A 172 18.984 -24.220 -9.075 1.00 10.68 C ANISOU 3091 CA LEU A 172 1169 1548 1339 -284 14 -154 C ATOM 3092 C LEU A 172 18.224 -24.226 -10.393 1.00 9.85 C ANISOU 3092 C LEU A 172 1082 1404 1258 -278 1 -144 C ATOM 3093 O LEU A 172 18.649 -23.605 -11.374 1.00 10.61 O ANISOU 3093 O LEU A 172 1191 1484 1357 -280 -1 -151 O ATOM 3094 CB LEU A 172 19.640 -25.579 -8.824 1.00 10.14 C ANISOU 3094 CB LEU A 172 1101 1495 1257 -273 1 -130 C ATOM 3095 CG LEU A 172 20.300 -26.263 -10.021 1.00 10.82 C ANISOU 3095 CG LEU A 172 1206 1556 1350 -256 -8 -126 C ATOM 3096 CD1 LEU A 172 21.453 -25.431 -10.570 1.00 10.78 C ANISOU 3096 CD1 LEU A 172 1198 1568 1331 -258 1 -148 C ATOM 3097 CD2 LEU A 172 20.769 -27.651 -9.637 1.00 14.63 C ANISOU 3097 CD2 LEU A 172 1689 2038 1831 -235 -15 -100 C ATOM 0 H LEU A 172 18.030 -24.525 -7.374 1.00 10.07 H new ATOM 0 HA LEU A 172 19.672 -23.539 -9.134 1.00 10.68 H new ATOM 0 HB2 LEU A 172 20.312 -25.466 -8.133 1.00 10.14 H new ATOM 0 HB3 LEU A 172 18.965 -26.178 -8.469 1.00 10.14 H new ATOM 0 HG LEU A 172 19.639 -26.343 -10.726 1.00 10.82 H new ATOM 0 HD11 LEU A 172 21.851 -25.889 -11.327 1.00 10.78 H new ATOM 0 HD12 LEU A 172 21.121 -24.565 -10.855 1.00 10.78 H new ATOM 0 HD13 LEU A 172 22.122 -25.308 -9.878 1.00 10.78 H new ATOM 0 HD21 LEU A 172 21.186 -28.075 -10.403 1.00 14.63 H new ATOM 0 HD22 LEU A 172 21.412 -27.587 -8.914 1.00 14.63 H new ATOM 0 HD23 LEU A 172 20.010 -28.181 -9.348 1.00 14.63 H new ATOM 3109 N ALA A 173 17.094 -24.934 -10.433 1.00 12.26 N ANISOU 3109 N ALA A 173 1384 1700 1574 -279 -11 -124 N ATOM 3110 CA ALA A 173 16.312 -25.020 -11.665 1.00 13.13 C ANISOU 3110 CA ALA A 173 1504 1788 1698 -284 -28 -111 C ATOM 3111 C ALA A 173 15.776 -23.654 -12.062 1.00 9.98 C ANISOU 3111 C ALA A 173 1094 1379 1319 -278 -23 -111 C ATOM 3112 O ALA A 173 15.789 -23.287 -13.245 1.00 10.01 O ANISOU 3112 O ALA A 173 1110 1369 1326 -281 -35 -101 O ATOM 3113 CB ALA A 173 15.167 -26.018 -11.483 1.00 10.30 C ANISOU 3113 CB ALA A 173 1139 1433 1343 -297 -40 -90 C ATOM 0 H ALA A 173 16.767 -25.367 -9.766 1.00 12.26 H new ATOM 0 HA ALA A 173 16.889 -25.331 -12.380 1.00 13.13 H new ATOM 0 HB1 ALA A 173 14.651 -26.072 -12.303 1.00 10.30 H new ATOM 0 HB2 ALA A 173 15.530 -26.892 -11.272 1.00 10.30 H new ATOM 0 HB3 ALA A 173 14.593 -25.724 -10.759 1.00 10.30 H new ATOM 3119 N LEU A 174 15.285 -22.893 -11.085 1.00 10.57 N ANISOU 3119 N LEU A 174 1149 1460 1408 -268 -2 -122 N ATOM 3120 CA LEU A 174 14.871 -21.515 -11.332 1.00 10.84 C ANISOU 3120 CA LEU A 174 1176 1470 1471 -252 11 -124 C ATOM 3121 C LEU A 174 15.973 -20.723 -12.026 1.00 11.38 C ANISOU 3121 C LEU A 174 1272 1515 1536 -259 14 -133 C ATOM 3122 O LEU A 174 15.748 -20.092 -13.067 1.00 12.82 O ANISOU 3122 O LEU A 174 1462 1673 1735 -254 3 -111 O ATOM 3123 CB LEU A 174 14.492 -20.859 -10.002 1.00 11.99 C ANISOU 3123 CB LEU A 174 1303 1623 1628 -243 45 -152 C ATOM 3124 CG LEU A 174 14.035 -19.404 -10.059 1.00 11.10 C ANISOU 3124 CG LEU A 174 1188 1472 1557 -218 70 -162 C ATOM 3125 CD1 LEU A 174 12.714 -19.299 -10.801 1.00 16.39 C ANISOU 3125 CD1 LEU A 174 1830 2134 2261 -190 55 -120 C ATOM 3126 CD2 LEU A 174 13.916 -18.835 -8.643 1.00 12.29 C ANISOU 3126 CD2 LEU A 174 1328 1632 1709 -217 114 -209 C ATOM 0 H LEU A 174 15.184 -23.157 -10.273 1.00 10.57 H new ATOM 0 HA LEU A 174 14.102 -21.519 -11.923 1.00 10.84 H new ATOM 0 HB2 LEU A 174 13.783 -21.383 -9.597 1.00 11.99 H new ATOM 0 HB3 LEU A 174 15.258 -20.912 -9.409 1.00 11.99 H new ATOM 0 HG LEU A 174 14.695 -18.882 -10.542 1.00 11.10 H new ATOM 0 HD11 LEU A 174 12.433 -18.371 -10.832 1.00 16.39 H new ATOM 0 HD12 LEU A 174 12.823 -19.633 -11.705 1.00 16.39 H new ATOM 0 HD13 LEU A 174 12.042 -19.825 -10.341 1.00 16.39 H new ATOM 0 HD21 LEU A 174 13.625 -17.911 -8.689 1.00 12.29 H new ATOM 0 HD22 LEU A 174 13.268 -19.353 -8.139 1.00 12.29 H new ATOM 0 HD23 LEU A 174 14.779 -18.881 -8.202 1.00 12.29 H new ATOM 3138 N ASN A 175 17.185 -20.763 -11.471 1.00 11.95 N ANISOU 3138 N ASN A 175 1356 1602 1584 -273 26 -161 N ATOM 3139 CA ASN A 175 18.267 -19.945 -12.010 1.00 10.20 C ANISOU 3139 CA ASN A 175 1155 1367 1354 -289 33 -172 C ATOM 3140 C ASN A 175 18.770 -20.478 -13.347 1.00 10.07 C ANISOU 3140 C ASN A 175 1152 1354 1320 -297 9 -153 C ATOM 3141 O ASN A 175 19.137 -19.693 -14.228 1.00 12.00 O ANISOU 3141 O ASN A 175 1412 1582 1566 -309 7 -144 O ATOM 3142 CB ASN A 175 19.406 -19.857 -11.001 1.00 10.20 C ANISOU 3142 CB ASN A 175 1153 1398 1324 -309 51 -206 C ATOM 3143 CG ASN A 175 19.074 -18.941 -9.840 1.00 11.78 C ANISOU 3143 CG ASN A 175 1350 1592 1535 -316 82 -239 C ATOM 3144 OD1 ASN A 175 17.919 -18.556 -9.650 1.00 11.64 O ANISOU 3144 OD1 ASN A 175 1325 1546 1550 -295 93 -237 O ATOM 3145 ND2 ASN A 175 20.084 -18.588 -9.059 1.00 10.61 N ANISOU 3145 ND2 ASN A 175 1202 1474 1355 -348 99 -271 N ATOM 0 H ASN A 175 17.397 -21.249 -10.794 1.00 11.95 H new ATOM 0 HA ASN A 175 17.916 -19.055 -12.171 1.00 10.20 H new ATOM 0 HB2 ASN A 175 19.606 -20.744 -10.664 1.00 10.20 H new ATOM 0 HB3 ASN A 175 20.206 -19.536 -11.446 1.00 10.20 H new ATOM 0 HD21 ASN A 175 19.947 -18.069 -8.387 1.00 10.61 H new ATOM 0 HD22 ASN A 175 20.877 -18.878 -9.224 1.00 10.61 H new ATOM 3152 N PHE A 176 18.803 -21.800 -13.522 1.00 9.90 N ANISOU 3152 N PHE A 176 1127 1354 1282 -293 -6 -146 N ATOM 3153 CA PHE A 176 19.191 -22.354 -14.817 1.00 9.89 C ANISOU 3153 CA PHE A 176 1140 1355 1262 -303 -21 -138 C ATOM 3154 C PHE A 176 18.185 -21.939 -15.885 1.00 11.46 C ANISOU 3154 C PHE A 176 1343 1538 1473 -310 -40 -109 C ATOM 3155 O PHE A 176 18.557 -21.631 -17.024 1.00 10.16 O ANISOU 3155 O PHE A 176 1192 1378 1292 -328 -49 -99 O ATOM 3156 CB PHE A 176 19.299 -23.875 -14.703 1.00 9.81 C ANISOU 3156 CB PHE A 176 1132 1355 1241 -296 -27 -142 C ATOM 3157 CG PHE A 176 20.080 -24.553 -15.815 1.00 9.89 C ANISOU 3157 CG PHE A 176 1159 1371 1228 -302 -28 -153 C ATOM 3158 CD1 PHE A 176 20.907 -23.849 -16.670 1.00 9.97 C ANISOU 3158 CD1 PHE A 176 1174 1394 1219 -317 -23 -161 C ATOM 3159 CD2 PHE A 176 19.979 -25.924 -15.979 1.00 13.56 C ANISOU 3159 CD2 PHE A 176 1636 1825 1690 -296 -31 -159 C ATOM 3160 CE1 PHE A 176 21.620 -24.499 -17.668 1.00 10.12 C ANISOU 3160 CE1 PHE A 176 1204 1427 1213 -323 -18 -178 C ATOM 3161 CE2 PHE A 176 20.680 -26.581 -16.982 1.00 10.27 C ANISOU 3161 CE2 PHE A 176 1237 1410 1255 -299 -24 -180 C ATOM 3162 CZ PHE A 176 21.507 -25.866 -17.826 1.00 10.22 C ANISOU 3162 CZ PHE A 176 1230 1428 1225 -311 -16 -191 C ATOM 0 H PHE A 176 18.609 -22.381 -12.918 1.00 9.90 H new ATOM 0 HA PHE A 176 20.057 -22.006 -15.081 1.00 9.89 H new ATOM 0 HB2 PHE A 176 19.717 -24.093 -13.855 1.00 9.81 H new ATOM 0 HB3 PHE A 176 18.404 -24.248 -14.682 1.00 9.81 H new ATOM 0 HD1 PHE A 176 20.987 -22.927 -16.575 1.00 9.97 H new ATOM 0 HD2 PHE A 176 19.432 -26.414 -15.408 1.00 13.56 H new ATOM 0 HE1 PHE A 176 22.176 -24.012 -18.232 1.00 10.12 H new ATOM 0 HE2 PHE A 176 20.593 -27.501 -17.085 1.00 10.27 H new ATOM 0 HZ PHE A 176 21.984 -26.302 -18.495 1.00 10.22 H new ATOM 3172 N SER A 177 16.902 -21.900 -15.522 1.00 10.13 N ANISOU 3172 N SER A 177 1157 1362 1329 -298 -47 -90 N ATOM 3173 CA ASER A 177 15.884 -21.450 -16.468 0.53 10.39 C ANISOU 3173 CA ASER A 177 1182 1392 1374 -300 -69 -51 C ATOM 3174 CA BSER A 177 15.870 -21.443 -16.449 0.47 10.39 C ANISOU 3174 CA BSER A 177 1182 1392 1375 -300 -69 -51 C ATOM 3175 C SER A 177 16.083 -19.983 -16.827 1.00 12.77 C ANISOU 3175 C SER A 177 1490 1667 1696 -294 -63 -33 C ATOM 3176 O SER A 177 15.916 -19.599 -17.992 1.00 12.13 O ANISOU 3176 O SER A 177 1413 1588 1607 -307 -83 2 O ATOM 3177 CB ASER A 177 14.483 -21.683 -15.898 0.53 11.26 C ANISOU 3177 CB ASER A 177 1261 1510 1508 -285 -75 -33 C ATOM 3178 CB BSER A 177 14.493 -21.647 -15.817 0.47 11.70 C ANISOU 3178 CB BSER A 177 1317 1565 1565 -284 -73 -34 C ATOM 3179 OG ASER A 177 14.118 -20.680 -14.964 0.53 11.66 O ANISOU 3179 OG ASER A 177 1294 1540 1595 -255 -51 -37 O ATOM 3180 OG BSER A 177 13.474 -21.015 -16.564 0.47 10.88 O ANISOU 3180 OG BSER A 177 1191 1464 1480 -276 -93 11 O ATOM 0 H ASER A 177 16.605 -22.126 -14.747 0.53 10.13 H new ATOM 0 H BSER A 177 16.611 -22.133 -14.747 0.47 10.13 H new ATOM 0 HA ASER A 177 15.975 -21.971 -17.281 0.53 10.39 H new ATOM 0 HA BSER A 177 15.925 -21.965 -17.265 0.47 10.39 H new ATOM 0 HB2ASER A 177 13.838 -21.700 -16.622 0.53 11.70 H new ATOM 0 HB2BSER A 177 14.305 -22.596 -15.751 0.47 11.70 H new ATOM 0 HB3ASER A 177 14.450 -22.552 -15.468 0.53 11.70 H new ATOM 0 HB3BSER A 177 14.497 -21.295 -14.913 0.47 11.70 H new ATOM 0 HG ASER A 177 13.338 -20.825 -14.688 0.53 10.88 H new ATOM 0 HG BSER A 177 13.131 -21.569 -17.095 0.47 10.88 H new ATOM 3191 N VAL A 178 16.455 -19.151 -15.850 1.00 12.11 N ANISOU 3191 N VAL A 178 1409 1557 1634 -280 -34 -57 N ATOM 3192 CA VAL A 178 16.766 -17.749 -16.132 1.00 10.97 C ANISOU 3192 CA VAL A 178 1283 1372 1513 -280 -22 -46 C ATOM 3193 C VAL A 178 17.976 -17.653 -17.053 1.00 10.93 C ANISOU 3193 C VAL A 178 1303 1379 1472 -316 -28 -46 C ATOM 3194 O VAL A 178 17.998 -16.854 -17.997 1.00 11.26 O ANISOU 3194 O VAL A 178 1358 1402 1518 -328 -39 -9 O ATOM 3195 CB VAL A 178 16.996 -16.976 -14.820 1.00 12.35 C ANISOU 3195 CB VAL A 178 1463 1517 1712 -269 17 -86 C ATOM 3196 CG1 VAL A 178 17.549 -15.576 -15.101 1.00 12.73 C ANISOU 3196 CG1 VAL A 178 1542 1513 1781 -282 34 -84 C ATOM 3197 CG2 VAL A 178 15.699 -16.888 -14.020 1.00 13.12 C ANISOU 3197 CG2 VAL A 178 1532 1604 1849 -230 29 -85 C ATOM 0 H VAL A 178 16.533 -19.378 -15.024 1.00 12.11 H new ATOM 0 HA VAL A 178 16.011 -17.343 -16.586 1.00 10.97 H new ATOM 0 HB VAL A 178 17.652 -17.459 -14.294 1.00 12.35 H new ATOM 0 HG11 VAL A 178 17.686 -15.108 -14.263 1.00 12.73 H new ATOM 0 HG12 VAL A 178 18.394 -15.650 -15.571 1.00 12.73 H new ATOM 0 HG13 VAL A 178 16.918 -15.082 -15.647 1.00 12.73 H new ATOM 0 HG21 VAL A 178 15.858 -16.399 -13.197 1.00 13.12 H new ATOM 0 HG22 VAL A 178 15.026 -16.427 -14.544 1.00 13.12 H new ATOM 0 HG23 VAL A 178 15.387 -17.782 -13.809 1.00 13.12 H new ATOM 3207 N PHE A 179 19.001 -18.467 -16.793 1.00 14.72 N ANISOU 3207 N PHE A 179 1786 1894 1914 -334 -21 -82 N ATOM 3208 CA PHE A 179 20.149 -18.541 -17.693 1.00 10.63 C ANISOU 3208 CA PHE A 179 1281 1402 1355 -366 -24 -86 C ATOM 3209 C PHE A 179 19.714 -18.816 -19.128 1.00 10.79 C ANISOU 3209 C PHE A 179 1305 1438 1356 -382 -52 -50 C ATOM 3210 O PHE A 179 20.156 -18.141 -20.066 1.00 12.36 O ANISOU 3210 O PHE A 179 1519 1641 1538 -410 -57 -27 O ATOM 3211 CB PHE A 179 21.105 -19.631 -17.213 1.00 10.35 C ANISOU 3211 CB PHE A 179 1236 1407 1289 -366 -14 -125 C ATOM 3212 CG PHE A 179 22.134 -20.026 -18.232 1.00 10.42 C ANISOU 3212 CG PHE A 179 1249 1452 1256 -390 -14 -133 C ATOM 3213 CD1 PHE A 179 23.318 -19.322 -18.350 1.00 10.57 C ANISOU 3213 CD1 PHE A 179 1271 1492 1254 -418 1 -144 C ATOM 3214 CD2 PHE A 179 21.920 -21.109 -19.064 1.00 10.41 C ANISOU 3214 CD2 PHE A 179 1250 1470 1235 -389 -26 -134 C ATOM 3215 CE1 PHE A 179 24.272 -19.689 -19.287 1.00 10.70 C ANISOU 3215 CE1 PHE A 179 1285 1553 1230 -439 5 -154 C ATOM 3216 CE2 PHE A 179 22.877 -21.482 -20.013 1.00 13.36 C ANISOU 3216 CE2 PHE A 179 1627 1880 1568 -409 -18 -151 C ATOM 3217 CZ PHE A 179 24.053 -20.766 -20.113 1.00 12.08 C ANISOU 3217 CZ PHE A 179 1460 1745 1385 -431 -2 -159 C ATOM 0 H PHE A 179 19.049 -18.981 -16.105 1.00 14.72 H new ATOM 0 HA PHE A 179 20.602 -17.683 -17.682 1.00 10.63 H new ATOM 0 HB2 PHE A 179 21.557 -19.323 -16.412 1.00 10.35 H new ATOM 0 HB3 PHE A 179 20.590 -20.415 -16.965 1.00 10.35 H new ATOM 0 HD1 PHE A 179 23.477 -18.593 -17.794 1.00 10.57 H new ATOM 0 HD2 PHE A 179 21.130 -21.595 -18.992 1.00 10.41 H new ATOM 0 HE1 PHE A 179 25.063 -19.205 -19.357 1.00 10.70 H new ATOM 0 HE2 PHE A 179 22.722 -22.208 -20.573 1.00 13.36 H new ATOM 0 HZ PHE A 179 24.696 -21.012 -20.738 1.00 12.08 H new ATOM 3227 N HIS A 180 18.861 -19.827 -19.318 1.00 10.70 N ANISOU 3227 N HIS A 180 1282 1442 1341 -372 -69 -44 N ATOM 3228 CA HIS A 180 18.391 -20.165 -20.655 1.00 11.53 C ANISOU 3228 CA HIS A 180 1389 1574 1417 -397 -96 -15 C ATOM 3229 C HIS A 180 17.693 -18.979 -21.300 1.00 12.97 C ANISOU 3229 C HIS A 180 1568 1741 1618 -400 -116 47 C ATOM 3230 O HIS A 180 17.892 -18.696 -22.489 1.00 11.86 O ANISOU 3230 O HIS A 180 1437 1626 1445 -434 -133 77 O ATOM 3231 CB HIS A 180 17.435 -21.359 -20.594 1.00 11.19 C ANISOU 3231 CB HIS A 180 1335 1546 1371 -394 -111 -19 C ATOM 3232 CG HIS A 180 18.107 -22.669 -20.324 1.00 10.64 C ANISOU 3232 CG HIS A 180 1277 1485 1280 -395 -95 -69 C ATOM 3233 ND1 HIS A 180 19.216 -23.098 -21.022 1.00 13.89 N ANISOU 3233 ND1 HIS A 180 1706 1919 1655 -414 -82 -100 N ATOM 3234 CD2 HIS A 180 17.823 -23.648 -19.433 1.00 10.61 C ANISOU 3234 CD2 HIS A 180 1271 1471 1291 -378 -89 -90 C ATOM 3235 CE1 HIS A 180 19.585 -24.285 -20.571 1.00 11.03 C ANISOU 3235 CE1 HIS A 180 1350 1550 1290 -399 -67 -137 C ATOM 3236 NE2 HIS A 180 18.755 -24.642 -19.608 1.00 13.01 N ANISOU 3236 NE2 HIS A 180 1592 1780 1572 -380 -72 -129 N ATOM 0 H HIS A 180 18.548 -20.323 -18.689 1.00 10.70 H new ATOM 0 HA HIS A 180 19.162 -20.400 -21.195 1.00 11.53 H new ATOM 0 HB2 HIS A 180 16.775 -21.197 -19.902 1.00 11.19 H new ATOM 0 HB3 HIS A 180 16.956 -21.420 -21.435 1.00 11.19 H new ATOM 0 HD1 HIS A 180 19.607 -22.662 -21.652 1.00 13.89 H new ATOM 0 HD2 HIS A 180 17.126 -23.648 -18.817 1.00 10.61 H new ATOM 0 HE1 HIS A 180 20.307 -24.784 -20.880 1.00 11.03 H new ATOM 3244 N TYR A 181 16.863 -18.276 -20.533 1.00 11.45 N ANISOU 3244 N TYR A 181 1362 1510 1480 -363 -113 68 N ATOM 3245 CA TYR A 181 16.047 -17.220 -21.113 1.00 11.98 C ANISOU 3245 CA TYR A 181 1420 1556 1577 -350 -132 136 C ATOM 3246 C TYR A 181 16.878 -15.980 -21.416 1.00 15.60 C ANISOU 3246 C TYR A 181 1907 1975 2044 -364 -119 154 C ATOM 3247 O TYR A 181 16.779 -15.409 -22.508 1.00 14.34 O ANISOU 3247 O TYR A 181 1753 1822 1872 -385 -143 213 O ATOM 3248 CB TYR A 181 14.896 -16.859 -20.173 1.00 18.34 C ANISOU 3248 CB TYR A 181 2197 2329 2442 -297 -124 148 C ATOM 3249 CG TYR A 181 13.819 -16.056 -20.861 1.00 14.88 C ANISOU 3249 CG TYR A 181 1734 1882 2037 -273 -150 229 C ATOM 3250 CD1 TYR A 181 13.944 -14.682 -21.022 1.00 17.45 C ANISOU 3250 CD1 TYR A 181 2077 2146 2406 -252 -140 269 C ATOM 3251 CD2 TYR A 181 12.680 -16.674 -21.364 1.00 20.20 C ANISOU 3251 CD2 TYR A 181 2366 2611 2699 -272 -185 270 C ATOM 3252 CE1 TYR A 181 12.964 -13.947 -21.660 1.00 21.71 C ANISOU 3252 CE1 TYR A 181 2590 2675 2982 -221 -166 355 C ATOM 3253 CE2 TYR A 181 11.695 -15.946 -22.004 1.00 26.44 C ANISOU 3253 CE2 TYR A 181 3122 3405 3517 -247 -213 355 C ATOM 3254 CZ TYR A 181 11.842 -14.583 -22.148 1.00 19.35 C ANISOU 3254 CZ TYR A 181 2240 2443 2668 -215 -203 400 C ATOM 3255 OH TYR A 181 10.857 -13.856 -22.784 1.00 24.89 O ANISOU 3255 OH TYR A 181 2905 3146 3405 -180 -233 496 O ATOM 0 H TYR A 181 16.760 -18.394 -19.687 1.00 11.45 H new ATOM 0 HA TYR A 181 15.684 -17.553 -21.949 1.00 11.98 H new ATOM 0 HB2 TYR A 181 14.509 -17.672 -19.813 1.00 18.34 H new ATOM 0 HB3 TYR A 181 15.242 -16.353 -19.421 1.00 18.34 H new ATOM 0 HD1 TYR A 181 14.700 -14.250 -20.695 1.00 17.45 H new ATOM 0 HD2 TYR A 181 12.579 -17.594 -21.268 1.00 20.20 H new ATOM 0 HE1 TYR A 181 13.060 -13.027 -21.760 1.00 21.71 H new ATOM 0 HE2 TYR A 181 10.938 -16.373 -22.335 1.00 26.44 H new ATOM 0 HH TYR A 181 11.201 -13.189 -23.162 1.00 24.89 H new ATOM 3265 N GLU A 182 17.705 -15.555 -20.463 1.00 15.59 N ANISOU 3265 N GLU A 182 1926 1938 2059 -361 -84 105 N ATOM 3266 CA GLU A 182 18.376 -14.262 -20.523 1.00 22.88 C ANISOU 3266 CA GLU A 182 2882 2811 3002 -378 -66 118 C ATOM 3267 C GLU A 182 19.786 -14.325 -21.092 1.00 16.59 C ANISOU 3267 C GLU A 182 2106 2050 2148 -436 -61 97 C ATOM 3268 O GLU A 182 20.259 -13.326 -21.637 1.00 16.80 O ANISOU 3268 O GLU A 182 2159 2050 2176 -467 -59 129 O ATOM 3269 CB GLU A 182 18.433 -13.637 -19.120 1.00 17.89 C ANISOU 3269 CB GLU A 182 2260 2121 2417 -352 -26 71 C ATOM 3270 CG GLU A 182 17.056 -13.414 -18.494 1.00 25.35 C ANISOU 3270 CG GLU A 182 3181 3028 3422 -291 -21 87 C ATOM 3271 CD GLU A 182 17.079 -12.487 -17.285 1.00 39.28 C ANISOU 3271 CD GLU A 182 4965 4724 5237 -271 25 43 C ATOM 3272 OE1 GLU A 182 18.131 -12.371 -16.613 1.00 39.30 O ANISOU 3272 OE1 GLU A 182 4989 4726 5215 -308 52 -15 O ATOM 3273 OE2 GLU A 182 16.029 -11.871 -17.007 1.00 38.69 O ANISOU 3273 OE2 GLU A 182 4879 4599 5224 -219 37 66 O ATOM 0 H GLU A 182 17.893 -16.013 -19.760 1.00 15.59 H new ATOM 0 HA GLU A 182 17.850 -13.717 -21.129 1.00 22.88 H new ATOM 0 HB2 GLU A 182 18.955 -14.212 -18.539 1.00 17.89 H new ATOM 0 HB3 GLU A 182 18.898 -12.787 -19.171 1.00 17.89 H new ATOM 0 HG2 GLU A 182 16.460 -13.044 -19.164 1.00 25.35 H new ATOM 0 HG3 GLU A 182 16.687 -14.271 -18.228 1.00 25.35 H new ATOM 3280 N ILE A 183 20.468 -15.459 -20.990 1.00 11.93 N ANISOU 3280 N ILE A 183 1503 1519 1511 -450 -57 48 N ATOM 3281 CA ILE A 183 21.868 -15.577 -21.383 1.00 12.10 C ANISOU 3281 CA ILE A 183 1533 1584 1481 -496 -44 20 C ATOM 3282 C ILE A 183 22.019 -16.391 -22.660 1.00 15.38 C ANISOU 3282 C ILE A 183 1940 2062 1839 -523 -64 31 C ATOM 3283 O ILE A 183 22.731 -15.993 -23.584 1.00 12.26 O ANISOU 3283 O ILE A 183 1557 1698 1405 -569 -65 48 O ATOM 3284 CB ILE A 183 22.714 -16.191 -20.243 1.00 15.16 C ANISOU 3284 CB ILE A 183 1907 1994 1859 -488 -18 -45 C ATOM 3285 CG1 ILE A 183 22.503 -15.437 -18.930 1.00 16.25 C ANISOU 3285 CG1 ILE A 183 2053 2080 2043 -471 4 -65 C ATOM 3286 CG2 ILE A 183 24.185 -16.203 -20.623 1.00 13.17 C ANISOU 3286 CG2 ILE A 183 1653 1795 1556 -532 -3 -69 C ATOM 3287 CD1 ILE A 183 22.860 -13.972 -18.974 1.00 19.74 C ANISOU 3287 CD1 ILE A 183 2527 2471 2504 -505 18 -50 C ATOM 0 H ILE A 183 20.129 -16.189 -20.688 1.00 11.93 H new ATOM 0 HA ILE A 183 22.198 -14.682 -21.559 1.00 12.10 H new ATOM 0 HB ILE A 183 22.420 -17.106 -20.110 1.00 15.16 H new ATOM 0 HG12 ILE A 183 21.573 -15.522 -18.669 1.00 16.25 H new ATOM 0 HG13 ILE A 183 23.032 -15.865 -18.238 1.00 16.25 H new ATOM 0 HG21 ILE A 183 24.703 -16.590 -19.900 1.00 13.17 H new ATOM 0 HG22 ILE A 183 24.307 -16.732 -21.427 1.00 13.17 H new ATOM 0 HG23 ILE A 183 24.485 -15.295 -20.785 1.00 13.17 H new ATOM 0 HD11 ILE A 183 22.697 -13.573 -18.105 1.00 19.74 H new ATOM 0 HD12 ILE A 183 23.797 -13.874 -19.204 1.00 19.74 H new ATOM 0 HD13 ILE A 183 22.316 -13.526 -19.642 1.00 19.74 H new ATOM 3299 N ALA A 184 21.349 -17.536 -22.730 1.00 15.57 N ANISOU 3299 N ALA A 184 1950 2110 1857 -500 -76 19 N ATOM 3300 CA ALA A 184 21.569 -18.496 -23.802 1.00 12.54 C ANISOU 3300 CA ALA A 184 1563 1785 1415 -529 -85 6 C ATOM 3301 C ALA A 184 20.596 -18.337 -24.961 1.00 14.76 C ANISOU 3301 C ALA A 184 1845 2087 1678 -553 -120 64 C ATOM 3302 O ALA A 184 20.640 -19.138 -25.899 1.00 15.63 O ANISOU 3302 O ALA A 184 1954 2250 1734 -586 -128 51 O ATOM 3303 CB ALA A 184 21.487 -19.922 -23.247 1.00 15.43 C ANISOU 3303 CB ALA A 184 1919 2162 1781 -500 -75 -46 C ATOM 0 H ALA A 184 20.755 -17.777 -22.157 1.00 15.57 H new ATOM 0 HA ALA A 184 22.455 -18.321 -24.156 1.00 12.54 H new ATOM 0 HB1 ALA A 184 21.634 -20.558 -23.965 1.00 15.43 H new ATOM 0 HB2 ALA A 184 22.165 -20.043 -22.564 1.00 15.43 H new ATOM 0 HB3 ALA A 184 20.610 -20.069 -22.860 1.00 15.43 H new ATOM 3309 N ASN A 185 19.724 -17.332 -24.929 1.00 13.68 N ANISOU 3309 N ASN A 185 1706 1911 1582 -539 -141 129 N ATOM 3310 CA ASN A 185 18.787 -17.097 -26.020 1.00 15.14 C ANISOU 3310 CA ASN A 185 1881 2124 1749 -560 -181 200 C ATOM 3311 C ASN A 185 17.988 -18.364 -26.318 1.00 17.15 C ANISOU 3311 C ASN A 185 2117 2424 1974 -566 -199 181 C ATOM 3312 O ASN A 185 17.788 -18.743 -27.473 1.00 15.38 O ANISOU 3312 O ASN A 185 1891 2263 1690 -615 -222 200 O ATOM 3313 CB ASN A 185 19.530 -16.606 -27.267 1.00 31.22 C ANISOU 3313 CB ASN A 185 3932 4204 3725 -622 -189 232 C ATOM 3314 CG ASN A 185 18.593 -16.098 -28.352 1.00 47.62 C ANISOU 3314 CG ASN A 185 5997 6311 5785 -646 -234 325 C ATOM 3315 OD1 ASN A 185 17.557 -15.499 -28.064 1.00 45.68 O ANISOU 3315 OD1 ASN A 185 5736 6025 5595 -604 -256 387 O ATOM 3316 ND2 ASN A 185 18.957 -16.340 -29.609 1.00 37.99 N ANISOU 3316 ND2 ASN A 185 4782 5169 4484 -713 -248 338 N ATOM 0 H ASN A 185 19.660 -16.772 -24.279 1.00 13.68 H new ATOM 0 HA ASN A 185 18.163 -16.405 -25.751 1.00 15.14 H new ATOM 0 HB2 ASN A 185 20.141 -15.896 -27.015 1.00 31.22 H new ATOM 0 HB3 ASN A 185 20.068 -17.330 -27.624 1.00 31.22 H new ATOM 0 HD21 ASN A 185 18.461 -16.074 -30.259 1.00 37.99 H new ATOM 0 HD22 ASN A 185 19.689 -16.762 -29.771 1.00 37.99 H new ATOM 3323 N SER A 186 17.538 -19.037 -25.258 1.00 12.45 N ANISOU 3323 N SER A 186 1512 1802 1416 -525 -188 143 N ATOM 3324 CA SER A 186 16.791 -20.291 -25.367 1.00 12.59 C ANISOU 3324 CA SER A 186 1519 1853 1414 -535 -201 119 C ATOM 3325 C SER A 186 15.524 -20.187 -24.530 1.00 12.56 C ANISOU 3325 C SER A 186 1485 1823 1464 -492 -214 149 C ATOM 3326 O SER A 186 15.357 -20.910 -23.538 1.00 11.96 O ANISOU 3326 O SER A 186 1406 1726 1412 -467 -197 106 O ATOM 3327 CB SER A 186 17.641 -21.479 -24.917 1.00 16.04 C ANISOU 3327 CB SER A 186 1974 2286 1833 -534 -167 35 C ATOM 3328 OG SER A 186 18.865 -21.539 -25.627 1.00 15.08 O ANISOU 3328 OG SER A 186 1872 2193 1666 -565 -148 4 O ATOM 0 H SER A 186 17.659 -18.776 -24.448 1.00 12.45 H new ATOM 0 HA SER A 186 16.554 -20.440 -26.296 1.00 12.59 H new ATOM 0 HB2 SER A 186 17.820 -21.409 -23.966 1.00 16.04 H new ATOM 0 HB3 SER A 186 17.146 -22.302 -25.052 1.00 16.04 H new ATOM 0 HG SER A 186 19.294 -20.827 -25.507 1.00 15.08 H new ATOM 3334 N PRO A 187 14.602 -19.295 -24.905 1.00 13.77 N ANISOU 3334 N PRO A 187 1613 1981 1639 -481 -244 226 N ATOM 3335 CA PRO A 187 13.385 -19.132 -24.093 1.00 14.49 C ANISOU 3335 CA PRO A 187 1666 2053 1786 -433 -251 254 C ATOM 3336 C PRO A 187 12.543 -20.391 -24.012 1.00 14.57 C ANISOU 3336 C PRO A 187 1655 2107 1772 -454 -266 233 C ATOM 3337 O PRO A 187 11.941 -20.653 -22.961 1.00 12.98 O ANISOU 3337 O PRO A 187 1434 1887 1611 -419 -253 218 O ATOM 3338 CB PRO A 187 12.644 -17.983 -24.796 1.00 14.34 C ANISOU 3338 CB PRO A 187 1620 2041 1788 -419 -283 351 C ATOM 3339 CG PRO A 187 13.169 -17.987 -26.190 1.00 15.49 C ANISOU 3339 CG PRO A 187 1784 2239 1864 -483 -307 377 C ATOM 3340 CD PRO A 187 14.603 -18.413 -26.086 1.00 16.25 C ANISOU 3340 CD PRO A 187 1925 2321 1927 -510 -272 298 C ATOM 0 HA PRO A 187 13.590 -18.944 -23.164 1.00 14.49 H new ATOM 0 HB2 PRO A 187 11.684 -18.122 -24.781 1.00 14.34 H new ATOM 0 HB3 PRO A 187 12.814 -17.134 -24.358 1.00 14.34 H new ATOM 0 HG2 PRO A 187 12.664 -18.598 -26.750 1.00 15.49 H new ATOM 0 HG3 PRO A 187 13.096 -17.107 -26.592 1.00 15.49 H new ATOM 0 HD2 PRO A 187 14.897 -18.881 -26.883 1.00 16.25 H new ATOM 0 HD3 PRO A 187 15.195 -17.654 -25.967 1.00 16.25 H new ATOM 3348 N GLU A 188 12.496 -21.200 -25.071 1.00 13.05 N ANISOU 3348 N GLU A 188 1470 1974 1513 -518 -288 228 N ATOM 3349 CA GLU A 188 11.707 -22.427 -24.999 1.00 13.09 C ANISOU 3349 CA GLU A 188 1463 2015 1494 -551 -299 203 C ATOM 3350 C GLU A 188 12.288 -23.396 -23.975 1.00 12.51 C ANISOU 3350 C GLU A 188 1421 1896 1437 -537 -261 124 C ATOM 3351 O GLU A 188 11.538 -24.047 -23.236 1.00 12.44 O ANISOU 3351 O GLU A 188 1396 1884 1446 -531 -261 114 O ATOM 3352 CB GLU A 188 11.610 -23.066 -26.381 1.00 16.26 C ANISOU 3352 CB GLU A 188 1874 2489 1815 -633 -326 203 C ATOM 3353 CG GLU A 188 10.708 -22.263 -27.304 1.00 19.92 C ANISOU 3353 CG GLU A 188 2291 3018 2259 -652 -375 298 C ATOM 3354 CD GLU A 188 10.569 -22.855 -28.688 1.00 26.38 C ANISOU 3354 CD GLU A 188 3116 3924 2985 -746 -405 300 C ATOM 3355 OE1 GLU A 188 11.519 -23.511 -29.165 1.00 24.65 O ANISOU 3355 OE1 GLU A 188 2945 3704 2716 -790 -380 229 O ATOM 3356 OE2 GLU A 188 9.506 -22.648 -29.305 1.00 21.09 O ANISOU 3356 OE2 GLU A 188 2397 3329 2289 -776 -452 373 O ATOM 0 H GLU A 188 12.900 -21.063 -25.818 1.00 13.05 H new ATOM 0 HA GLU A 188 10.811 -22.203 -24.703 1.00 13.09 H new ATOM 0 HB2 GLU A 188 12.496 -23.133 -26.771 1.00 16.26 H new ATOM 0 HB3 GLU A 188 11.267 -23.970 -26.298 1.00 16.26 H new ATOM 0 HG2 GLU A 188 9.828 -22.193 -26.902 1.00 19.92 H new ATOM 0 HG3 GLU A 188 11.058 -21.362 -27.381 1.00 19.92 H new ATOM 3363 N GLU A 189 13.618 -23.506 -23.910 1.00 14.12 N ANISOU 3363 N GLU A 189 1665 2068 1632 -531 -230 74 N ATOM 3364 CA GLU A 189 14.246 -24.323 -22.870 1.00 11.72 C ANISOU 3364 CA GLU A 189 1384 1720 1349 -506 -195 13 C ATOM 3365 C GLU A 189 13.957 -23.760 -21.483 1.00 12.93 C ANISOU 3365 C GLU A 189 1514 1837 1562 -449 -182 25 C ATOM 3366 O GLU A 189 13.676 -24.514 -20.540 1.00 12.85 O ANISOU 3366 O GLU A 189 1503 1812 1570 -438 -171 2 O ATOM 3367 CB GLU A 189 15.755 -24.405 -23.111 1.00 12.69 C ANISOU 3367 CB GLU A 189 1540 1829 1452 -505 -166 -33 C ATOM 3368 CG GLU A 189 16.528 -25.359 -22.191 1.00 12.68 C ANISOU 3368 CG GLU A 189 1559 1791 1467 -478 -133 -89 C ATOM 3369 CD GLU A 189 16.227 -26.831 -22.448 1.00 17.63 C ANISOU 3369 CD GLU A 189 2211 2415 2074 -508 -130 -126 C ATOM 3370 OE1 GLU A 189 16.555 -27.668 -21.578 1.00 16.39 O ANISOU 3370 OE1 GLU A 189 2068 2220 1941 -482 -109 -155 O ATOM 3371 OE2 GLU A 189 15.671 -27.153 -23.516 1.00 14.17 O ANISOU 3371 OE2 GLU A 189 1780 2010 1595 -562 -148 -125 O ATOM 0 H GLU A 189 14.166 -23.122 -24.450 1.00 14.12 H new ATOM 0 HA GLU A 189 13.870 -25.216 -22.913 1.00 11.72 H new ATOM 0 HB2 GLU A 189 15.904 -24.677 -24.030 1.00 12.69 H new ATOM 0 HB3 GLU A 189 16.130 -23.515 -23.014 1.00 12.69 H new ATOM 0 HG2 GLU A 189 17.479 -25.206 -22.305 1.00 12.68 H new ATOM 0 HG3 GLU A 189 16.316 -25.149 -21.268 1.00 12.68 H new ATOM 3378 N ALA A 190 14.020 -22.435 -21.344 1.00 11.45 N ANISOU 3378 N ALA A 190 1312 1634 1404 -418 -181 59 N ATOM 3379 CA ALA A 190 13.701 -21.796 -20.071 1.00 11.29 C ANISOU 3379 CA ALA A 190 1273 1580 1439 -368 -163 63 C ATOM 3380 C ALA A 190 12.293 -22.158 -19.620 1.00 11.47 C ANISOU 3380 C ALA A 190 1256 1623 1480 -360 -177 86 C ATOM 3381 O ALA A 190 12.064 -22.500 -18.453 1.00 11.40 O ANISOU 3381 O ALA A 190 1237 1602 1493 -339 -157 63 O ATOM 3382 CB ALA A 190 13.843 -20.282 -20.210 1.00 11.52 C ANISOU 3382 CB ALA A 190 1298 1581 1499 -342 -159 99 C ATOM 0 H ALA A 190 14.244 -21.892 -21.972 1.00 11.45 H new ATOM 0 HA ALA A 190 14.321 -22.115 -19.397 1.00 11.29 H new ATOM 0 HB1 ALA A 190 13.631 -19.858 -19.364 1.00 11.52 H new ATOM 0 HB2 ALA A 190 14.754 -20.064 -20.461 1.00 11.52 H new ATOM 0 HB3 ALA A 190 13.234 -19.961 -20.894 1.00 11.52 H new ATOM 3388 N ILE A 191 11.333 -22.084 -20.543 1.00 11.93 N ANISOU 3388 N ILE A 191 1286 1723 1524 -381 -211 136 N ATOM 3389 CA ILE A 191 9.932 -22.325 -20.203 1.00 12.23 C ANISOU 3389 CA ILE A 191 1274 1796 1578 -375 -227 167 C ATOM 3390 C ILE A 191 9.706 -23.795 -19.859 1.00 12.07 C ANISOU 3390 C ILE A 191 1265 1794 1529 -417 -227 129 C ATOM 3391 O ILE A 191 9.037 -24.125 -18.870 1.00 13.13 O ANISOU 3391 O ILE A 191 1373 1932 1684 -404 -217 124 O ATOM 3392 CB ILE A 191 9.033 -21.859 -21.366 1.00 12.87 C ANISOU 3392 CB ILE A 191 1315 1931 1644 -392 -270 240 C ATOM 3393 CG1 ILE A 191 9.069 -20.326 -21.469 1.00 13.16 C ANISOU 3393 CG1 ILE A 191 1338 1935 1729 -335 -267 290 C ATOM 3394 CG2 ILE A 191 7.604 -22.374 -21.192 1.00 20.48 C ANISOU 3394 CG2 ILE A 191 2220 2954 2606 -404 -292 270 C ATOM 3395 CD1 ILE A 191 8.485 -19.767 -22.750 1.00 14.92 C ANISOU 3395 CD1 ILE A 191 1529 2207 1934 -350 -312 373 C ATOM 0 H ILE A 191 11.473 -21.896 -21.370 1.00 11.93 H new ATOM 0 HA ILE A 191 9.696 -21.811 -19.414 1.00 12.23 H new ATOM 0 HB ILE A 191 9.373 -22.230 -22.195 1.00 12.87 H new ATOM 0 HG12 ILE A 191 8.585 -19.951 -20.716 1.00 13.16 H new ATOM 0 HG13 ILE A 191 9.989 -20.030 -21.391 1.00 13.16 H new ATOM 0 HG21 ILE A 191 7.058 -22.069 -21.933 1.00 20.48 H new ATOM 0 HG22 ILE A 191 7.610 -23.344 -21.172 1.00 20.48 H new ATOM 0 HG23 ILE A 191 7.237 -22.036 -20.360 1.00 20.48 H new ATOM 0 HD11 ILE A 191 8.545 -18.799 -22.738 1.00 14.92 H new ATOM 0 HD12 ILE A 191 8.981 -20.112 -23.509 1.00 14.92 H new ATOM 0 HD13 ILE A 191 7.555 -20.032 -22.825 1.00 14.92 H new ATOM 3407 N SER A 192 10.252 -24.697 -20.674 1.00 13.90 N ANISOU 3407 N SER A 192 1536 2033 1711 -471 -235 100 N ATOM 3408 CA ASER A 192 10.098 -26.125 -20.417 0.28 14.52 C ANISOU 3408 CA ASER A 192 1638 2112 1768 -513 -231 61 C ATOM 3409 CA BSER A 192 10.098 -26.125 -20.417 0.72 13.53 C ANISOU 3409 CA BSER A 192 1513 1986 1643 -513 -231 61 C ATOM 3410 C SER A 192 10.694 -26.512 -19.070 1.00 12.17 C ANISOU 3410 C SER A 192 1360 1764 1501 -477 -196 25 C ATOM 3411 O SER A 192 10.084 -27.269 -18.305 1.00 13.79 O ANISOU 3411 O SER A 192 1556 1970 1712 -490 -193 21 O ATOM 3412 CB ASER A 192 10.755 -26.929 -21.539 0.28 17.94 C ANISOU 3412 CB ASER A 192 2119 2547 2149 -569 -234 25 C ATOM 3413 CB BSER A 192 10.753 -26.928 -21.540 0.72 19.56 C ANISOU 3413 CB BSER A 192 2325 2754 2355 -569 -234 25 C ATOM 3414 OG ASER A 192 10.124 -26.676 -22.779 0.28 16.37 O ANISOU 3414 OG ASER A 192 1901 2411 1909 -617 -270 61 O ATOM 3415 OG BSER A 192 10.639 -28.323 -21.298 0.72 23.09 O ANISOU 3415 OG BSER A 192 2804 3182 2788 -608 -225 -15 O ATOM 0 H ASER A 192 10.711 -24.504 -21.375 0.28 13.90 H new ATOM 0 H BSER A 192 10.711 -24.504 -21.375 0.72 13.90 H new ATOM 0 HA ASER A 192 9.150 -26.328 -20.391 0.28 13.53 H new ATOM 0 HA BSER A 192 9.150 -26.329 -20.390 0.72 13.53 H new ATOM 0 HB2ASER A 192 11.696 -26.700 -21.598 0.28 19.56 H new ATOM 0 HB2BSER A 192 10.335 -26.708 -22.387 0.72 19.56 H new ATOM 0 HB3ASER A 192 10.706 -27.876 -21.334 0.28 19.56 H new ATOM 0 HB3BSER A 192 11.689 -26.684 -21.614 0.72 19.56 H new ATOM 0 HG ASER A 192 10.335 -25.909 -23.049 0.28 23.09 H new ATOM 0 HG BSER A 192 11.406 -28.660 -21.235 0.72 23.09 H new ATOM 3426 N LEU A 193 11.883 -26.001 -18.756 1.00 11.74 N ANISOU 3426 N LEU A 193 1328 1673 1461 -439 -172 2 N ATOM 3427 CA LEU A 193 12.500 -26.350 -17.484 1.00 10.88 C ANISOU 3427 CA LEU A 193 1231 1530 1372 -409 -144 -26 C ATOM 3428 C LEU A 193 11.677 -25.825 -16.313 1.00 13.50 C ANISOU 3428 C LEU A 193 1522 1872 1737 -380 -136 -7 C ATOM 3429 O LEU A 193 11.490 -26.527 -15.312 1.00 12.12 O ANISOU 3429 O LEU A 193 1345 1694 1567 -382 -125 -16 O ATOM 3430 CB LEU A 193 13.932 -25.818 -17.432 1.00 12.06 C ANISOU 3430 CB LEU A 193 1403 1655 1524 -381 -122 -51 C ATOM 3431 CG LEU A 193 14.660 -26.022 -16.102 1.00 13.19 C ANISOU 3431 CG LEU A 193 1551 1779 1683 -351 -97 -73 C ATOM 3432 CD1 LEU A 193 14.691 -27.485 -15.712 1.00 12.37 C ANISOU 3432 CD1 LEU A 193 1467 1660 1572 -364 -94 -86 C ATOM 3433 CD2 LEU A 193 16.073 -25.456 -16.177 1.00 13.35 C ANISOU 3433 CD2 LEU A 193 1585 1790 1697 -333 -79 -94 C ATOM 0 H LEU A 193 12.337 -25.465 -19.252 1.00 11.74 H new ATOM 0 HA LEU A 193 12.528 -27.317 -17.410 1.00 10.88 H new ATOM 0 HB2 LEU A 193 14.446 -26.247 -18.134 1.00 12.06 H new ATOM 0 HB3 LEU A 193 13.916 -24.869 -17.632 1.00 12.06 H new ATOM 0 HG LEU A 193 14.170 -25.543 -15.415 1.00 13.19 H new ATOM 0 HD11 LEU A 193 15.157 -27.585 -14.867 1.00 12.37 H new ATOM 0 HD12 LEU A 193 13.783 -27.815 -15.621 1.00 12.37 H new ATOM 0 HD13 LEU A 193 15.152 -27.993 -16.398 1.00 12.37 H new ATOM 0 HD21 LEU A 193 16.522 -25.592 -15.328 1.00 13.35 H new ATOM 0 HD22 LEU A 193 16.566 -25.908 -16.879 1.00 13.35 H new ATOM 0 HD23 LEU A 193 16.032 -24.507 -16.372 1.00 13.35 H new ATOM 3445 N ALA A 194 11.165 -24.596 -16.420 1.00 14.16 N ANISOU 3445 N ALA A 194 1570 1966 1843 -353 -139 21 N ATOM 3446 CA ALA A 194 10.382 -24.034 -15.321 1.00 13.40 C ANISOU 3446 CA ALA A 194 1433 1879 1781 -320 -123 31 C ATOM 3447 C ALA A 194 9.086 -24.806 -15.112 1.00 13.51 C ANISOU 3447 C ALA A 194 1411 1936 1788 -346 -138 52 C ATOM 3448 O ALA A 194 8.689 -25.065 -13.971 1.00 12.95 O ANISOU 3448 O ALA A 194 1320 1875 1725 -340 -119 43 O ATOM 3449 CB ALA A 194 10.077 -22.561 -15.577 1.00 13.81 C ANISOU 3449 CB ALA A 194 1459 1921 1867 -278 -119 57 C ATOM 0 H ALA A 194 11.257 -24.083 -17.104 1.00 14.16 H new ATOM 0 HA ALA A 194 10.914 -24.110 -14.513 1.00 13.40 H new ATOM 0 HB1 ALA A 194 9.558 -22.205 -14.839 1.00 13.81 H new ATOM 0 HB2 ALA A 194 10.908 -22.067 -15.655 1.00 13.81 H new ATOM 0 HB3 ALA A 194 9.571 -22.473 -16.400 1.00 13.81 H new ATOM 3455 N ALYS A 195 8.422 -25.209 -16.195 0.62 13.70 N ANISOU 3455 N ALYS A 195 1424 1993 1788 -385 -171 80 N ATOM 3456 N BLYS A 195 8.402 -25.152 -16.206 0.38 13.11 N ANISOU 3456 N BLYS A 195 1347 1918 1715 -383 -171 81 N ATOM 3457 CA ALYS A 195 7.152 -25.913 -16.049 0.62 12.99 C ANISOU 3457 CA ALYS A 195 1294 1955 1687 -421 -187 102 C ATOM 3458 CA BLYS A 195 7.165 -25.920 -16.113 0.38 14.29 C ANISOU 3458 CA BLYS A 195 1460 2120 1851 -423 -189 102 C ATOM 3459 C ALYS A 195 7.357 -27.318 -15.489 0.62 11.98 C ANISOU 3459 C ALYS A 195 1204 1812 1537 -467 -180 73 C ATOM 3460 C BLYS A 195 7.408 -27.274 -15.461 0.38 12.30 C ANISOU 3460 C BLYS A 195 1245 1850 1579 -464 -179 72 C ATOM 3461 O ALYS A 195 6.628 -27.749 -14.588 0.62 12.14 O ANISOU 3461 O ALYS A 195 1197 1856 1560 -479 -173 79 O ATOM 3462 O BLYS A 195 6.757 -27.629 -14.471 0.38 12.40 O ANISOU 3462 O BLYS A 195 1230 1883 1597 -470 -168 76 O ATOM 3463 CB ALYS A 195 6.424 -25.970 -17.392 0.62 12.77 C ANISOU 3463 CB ALYS A 195 1243 1977 1632 -463 -228 141 C ATOM 3464 CB BLYS A 195 6.562 -26.111 -17.507 0.38 15.20 C ANISOU 3464 CB BLYS A 195 1561 2280 1933 -471 -229 135 C ATOM 3465 CG ALYS A 195 4.944 -26.255 -17.246 0.62 20.75 C ANISOU 3465 CG ALYS A 195 2187 3060 2637 -489 -247 178 C ATOM 3466 CG BLYS A 195 5.807 -24.916 -18.057 0.38 16.62 C ANISOU 3466 CG BLYS A 195 1680 2500 2134 -435 -248 192 C ATOM 3467 CD ALYS A 195 4.299 -26.628 -18.566 0.62 28.49 C ANISOU 3467 CD ALYS A 195 3151 4102 3573 -555 -291 210 C ATOM 3468 CD BLYS A 195 5.364 -25.186 -19.486 0.38 17.15 C ANISOU 3468 CD BLYS A 195 1737 2623 2155 -494 -294 227 C ATOM 3469 CE ALYS A 195 2.810 -26.881 -18.385 0.62 26.67 C ANISOU 3469 CE ALYS A 195 2842 3957 3334 -585 -312 252 C ATOM 3470 CE BLYS A 195 4.342 -24.177 -19.972 0.38 24.13 C ANISOU 3470 CE BLYS A 195 2544 3567 3058 -461 -321 303 C ATOM 3471 NZ ALYS A 195 2.530 -27.793 -17.241 0.62 20.84 N ANISOU 3471 NZ ALYS A 195 2110 3213 2596 -612 -289 223 N ATOM 3472 NZ BLYS A 195 3.994 -24.405 -21.402 0.38 24.00 N ANISOU 3472 NZ BLYS A 195 2516 3618 2986 -527 -369 343 N ATOM 0 H ALYS A 195 8.683 -25.088 -17.005 0.62 13.11 H new ATOM 0 H BLYS A 195 8.639 -24.951 -17.008 0.38 13.11 H new ATOM 0 HA ALYS A 195 6.605 -25.421 -15.416 0.62 14.29 H new ATOM 0 HA BLYS A 195 6.542 -25.425 -15.559 0.38 14.29 H new ATOM 0 HB2ALYS A 195 6.542 -25.126 -17.855 0.62 15.20 H new ATOM 0 HB2BLYS A 195 7.276 -26.335 -18.124 0.38 15.20 H new ATOM 0 HB3ALYS A 195 6.828 -26.657 -17.945 0.62 15.20 H new ATOM 0 HB3BLYS A 195 5.960 -26.871 -17.481 0.38 15.20 H new ATOM 0 HG2ALYS A 195 4.817 -26.977 -16.610 0.62 16.62 H new ATOM 0 HG2BLYS A 195 5.034 -24.730 -17.501 0.38 16.62 H new ATOM 0 HG3ALYS A 195 4.500 -25.474 -16.881 0.62 16.62 H new ATOM 0 HG3BLYS A 195 6.372 -24.128 -18.030 0.38 16.62 H new ATOM 0 HD2ALYS A 195 4.435 -25.916 -19.210 0.62 17.15 H new ATOM 0 HD2BLYS A 195 6.137 -25.167 -20.071 0.38 17.15 H new ATOM 0 HD3ALYS A 195 4.725 -27.421 -18.927 0.62 17.15 H new ATOM 0 HD3BLYS A 195 4.987 -26.078 -19.542 0.38 17.15 H new ATOM 0 HE2ALYS A 195 2.355 -26.036 -18.242 0.62 24.13 H new ATOM 0 HE2BLYS A 195 3.541 -24.237 -19.428 0.38 24.13 H new ATOM 0 HE3ALYS A 195 2.447 -27.265 -19.199 0.62 24.13 H new ATOM 0 HE3BLYS A 195 4.693 -23.279 -19.861 0.38 24.13 H new ATOM 0 HZ1ALYS A 195 1.857 -28.336 -17.452 0.62 24.00 H new ATOM 0 HZ1BLYS A 195 3.394 -23.801 -21.662 0.38 24.00 H new ATOM 0 HZ2ALYS A 195 3.255 -28.277 -17.062 0.62 24.00 H new ATOM 0 HZ2BLYS A 195 4.726 -24.329 -21.902 0.38 24.00 H new ATOM 0 HZ3ALYS A 195 2.310 -27.312 -16.525 0.62 24.00 H new ATOM 0 HZ3BLYS A 195 3.653 -25.222 -21.498 0.38 24.00 H new ATOM 3499 N THR A 196 8.343 -28.050 -16.010 1.00 13.29 N ANISOU 3499 N THR A 196 1432 1936 1682 -491 -181 42 N ATOM 3500 CA ATHR A 196 8.604 -29.399 -15.517 0.62 14.11 C ANISOU 3500 CA ATHR A 196 1578 2009 1773 -526 -172 20 C ATOM 3501 CA BTHR A 196 8.571 -29.398 -15.504 0.38 15.05 C ANISOU 3501 CA BTHR A 196 1696 2130 1893 -527 -172 20 C ATOM 3502 C THR A 196 9.039 -29.372 -14.057 1.00 13.62 C ANISOU 3502 C THR A 196 1515 1927 1733 -488 -144 13 C ATOM 3503 O THR A 196 8.619 -30.214 -13.254 1.00 11.67 O ANISOU 3503 O THR A 196 1269 1682 1482 -515 -140 20 O ATOM 3504 CB ATHR A 196 9.665 -30.068 -16.394 0.62 18.93 C ANISOU 3504 CB ATHR A 196 2254 2573 2365 -544 -169 -15 C ATOM 3505 CB BTHR A 196 9.584 -30.132 -16.381 0.38 17.58 C ANISOU 3505 CB BTHR A 196 2082 2403 2193 -548 -170 -14 C ATOM 3506 OG1ATHR A 196 9.099 -30.390 -17.672 0.62 18.19 O ANISOU 3506 OG1ATHR A 196 2165 2508 2238 -603 -194 -14 O ATOM 3507 OG1BTHR A 196 10.789 -29.361 -16.474 0.38 21.58 O ANISOU 3507 OG1BTHR A 196 2602 2886 2711 -496 -155 -31 O ATOM 3508 CG2ATHR A 196 10.200 -31.331 -15.748 0.62 14.94 C ANISOU 3508 CG2ATHR A 196 1797 2014 1864 -555 -152 -37 C ATOM 3509 CG2BTHR A 196 9.010 -30.362 -17.769 0.38 17.86 C ANISOU 3509 CG2BTHR A 196 2121 2472 2194 -607 -197 -12 C ATOM 0 H ATHR A 196 8.865 -27.787 -16.641 0.62 13.29 H new ATOM 0 H BTHR A 196 8.848 -27.817 -16.666 0.38 13.29 H new ATOM 0 HA ATHR A 196 7.785 -29.916 -15.566 0.62 15.05 H new ATOM 0 HA BTHR A 196 7.727 -29.876 -15.535 0.38 15.05 H new ATOM 0 HB ATHR A 196 10.402 -29.446 -16.502 0.62 17.58 H new ATOM 0 HB BTHR A 196 9.783 -30.992 -15.980 0.38 17.58 H new ATOM 0 HG1ATHR A 196 9.074 -29.700 -18.150 0.62 21.58 H new ATOM 0 HG1BTHR A 196 10.683 -28.741 -17.031 0.38 21.58 H new ATOM 0 HG21ATHR A 196 10.869 -31.732 -16.325 0.62 17.86 H new ATOM 0 HG21BTHR A 196 9.662 -30.828 -18.316 0.38 17.86 H new ATOM 0 HG22ATHR A 196 10.601 -31.112 -14.892 0.62 17.86 H new ATOM 0 HG22BTHR A 196 8.204 -30.897 -17.701 0.38 17.86 H new ATOM 0 HG23ATHR A 196 9.473 -31.958 -15.612 0.62 17.86 H new ATOM 0 HG23BTHR A 196 8.798 -29.508 -18.177 0.38 17.86 H new ATOM 3524 N THR A 197 9.888 -28.407 -13.696 1.00 11.16 N ANISOU 3524 N THR A 197 1200 1600 1439 -434 -126 0 N ATOM 3525 CA THR A 197 10.313 -28.276 -12.304 1.00 13.45 C ANISOU 3525 CA THR A 197 1484 1886 1740 -405 -101 -8 C ATOM 3526 C THR A 197 9.118 -28.020 -11.399 1.00 14.14 C ANISOU 3526 C THR A 197 1518 2021 1834 -408 -93 10 C ATOM 3527 O THR A 197 8.956 -28.667 -10.357 1.00 13.77 O ANISOU 3527 O THR A 197 1469 1986 1779 -425 -83 15 O ATOM 3528 CB THR A 197 11.321 -27.137 -12.161 1.00 10.84 C ANISOU 3528 CB THR A 197 1156 1541 1422 -359 -83 -28 C ATOM 3529 OG1 THR A 197 12.464 -27.398 -12.980 1.00 11.81 O ANISOU 3529 OG1 THR A 197 1322 1632 1535 -358 -87 -44 O ATOM 3530 CG2 THR A 197 11.761 -26.995 -10.705 1.00 11.44 C ANISOU 3530 CG2 THR A 197 1224 1626 1499 -341 -58 -40 C ATOM 0 H THR A 197 10.224 -27.827 -14.234 1.00 11.16 H new ATOM 0 HA THR A 197 10.734 -29.108 -12.038 1.00 13.45 H new ATOM 0 HB THR A 197 10.898 -26.311 -12.445 1.00 10.84 H new ATOM 0 HG1 THR A 197 12.301 -27.168 -13.771 1.00 11.81 H new ATOM 0 HG21 THR A 197 12.400 -26.269 -10.629 1.00 11.44 H new ATOM 0 HG22 THR A 197 10.988 -26.804 -10.150 1.00 11.44 H new ATOM 0 HG23 THR A 197 12.174 -27.821 -10.410 1.00 11.44 H new ATOM 3538 N PHE A 198 8.276 -27.064 -11.781 1.00 12.49 N ANISOU 3538 N PHE A 198 1263 1841 1640 -390 -97 24 N ATOM 3539 CA PHE A 198 7.093 -26.743 -10.992 1.00 14.09 C ANISOU 3539 CA PHE A 198 1406 2096 1854 -385 -84 39 C ATOM 3540 C PHE A 198 6.187 -27.959 -10.836 1.00 14.16 C ANISOU 3540 C PHE A 198 1402 2140 1837 -446 -100 60 C ATOM 3541 O PHE A 198 5.738 -28.275 -9.728 1.00 12.27 O ANISOU 3541 O PHE A 198 1138 1932 1590 -459 -83 62 O ATOM 3542 CB PHE A 198 6.340 -25.592 -11.654 1.00 12.06 C ANISOU 3542 CB PHE A 198 1100 1860 1624 -348 -89 59 C ATOM 3543 CG PHE A 198 5.128 -25.139 -10.892 1.00 12.80 C ANISOU 3543 CG PHE A 198 1120 2007 1734 -328 -69 72 C ATOM 3544 CD1 PHE A 198 3.916 -25.798 -11.028 1.00 15.08 C ANISOU 3544 CD1 PHE A 198 1362 2361 2008 -368 -89 104 C ATOM 3545 CD2 PHE A 198 5.198 -24.052 -10.048 1.00 13.98 C ANISOU 3545 CD2 PHE A 198 1249 2147 1914 -272 -28 47 C ATOM 3546 CE1 PHE A 198 2.804 -25.372 -10.335 1.00 20.18 C ANISOU 3546 CE1 PHE A 198 1932 3067 2669 -346 -67 115 C ATOM 3547 CE2 PHE A 198 4.088 -23.629 -9.351 1.00 17.23 C ANISOU 3547 CE2 PHE A 198 1592 2610 2344 -247 -2 51 C ATOM 3548 CZ PHE A 198 2.892 -24.290 -9.495 1.00 17.48 C ANISOU 3548 CZ PHE A 198 1569 2713 2361 -281 -21 87 C ATOM 0 H PHE A 198 8.372 -26.591 -12.493 1.00 12.49 H new ATOM 0 HA PHE A 198 7.374 -26.474 -10.103 1.00 14.09 H new ATOM 0 HB2 PHE A 198 6.944 -24.840 -11.760 1.00 12.06 H new ATOM 0 HB3 PHE A 198 6.068 -25.865 -12.544 1.00 12.06 H new ATOM 0 HD1 PHE A 198 3.853 -26.535 -11.592 1.00 15.08 H new ATOM 0 HD2 PHE A 198 6.004 -23.599 -9.948 1.00 13.98 H new ATOM 0 HE1 PHE A 198 1.994 -25.817 -10.436 1.00 20.18 H new ATOM 0 HE2 PHE A 198 4.148 -22.895 -8.782 1.00 17.23 H new ATOM 0 HZ PHE A 198 2.143 -24.005 -9.024 1.00 17.48 H new ATOM 3558 N ASP A 199 5.894 -28.642 -11.944 1.00 12.41 N ANISOU 3558 N ASP A 199 1198 1920 1599 -492 -132 75 N ATOM 3559 CA ASP A 199 4.947 -29.753 -11.919 1.00 12.68 C ANISOU 3559 CA ASP A 199 1222 1989 1608 -563 -149 94 C ATOM 3560 C ASP A 199 5.468 -30.919 -11.083 1.00 14.05 C ANISOU 3560 C ASP A 199 1447 2123 1769 -596 -138 86 C ATOM 3561 O ASP A 199 4.709 -31.540 -10.332 1.00 16.11 O ANISOU 3561 O ASP A 199 1687 2418 2016 -638 -135 104 O ATOM 3562 CB ASP A 199 4.650 -30.210 -13.349 1.00 16.72 C ANISOU 3562 CB ASP A 199 1750 2506 2098 -615 -183 103 C ATOM 3563 CG ASP A 199 3.825 -29.198 -14.133 1.00 29.51 C ANISOU 3563 CG ASP A 199 3303 4188 3723 -595 -203 133 C ATOM 3564 OD1 ASP A 199 3.221 -28.298 -13.511 1.00 31.26 O ANISOU 3564 OD1 ASP A 199 3459 4449 3971 -545 -188 151 O ATOM 3565 OD2 ASP A 199 3.775 -29.310 -15.377 1.00 33.30 O ANISOU 3565 OD2 ASP A 199 3794 4677 4180 -628 -232 141 O ATOM 0 H ASP A 199 6.233 -28.477 -12.717 1.00 12.41 H new ATOM 0 HA ASP A 199 4.128 -29.442 -11.503 1.00 12.68 H new ATOM 0 HB2 ASP A 199 5.487 -30.368 -13.814 1.00 16.72 H new ATOM 0 HB3 ASP A 199 4.176 -31.056 -13.322 1.00 16.72 H new ATOM 3570 N GLU A 200 6.755 -31.237 -11.195 1.00 12.26 N ANISOU 3570 N GLU A 200 1284 1827 1547 -576 -132 63 N ATOM 3571 CA GLU A 200 7.294 -32.337 -10.404 1.00 12.31 C ANISOU 3571 CA GLU A 200 1337 1792 1548 -597 -123 66 C ATOM 3572 C GLU A 200 7.331 -31.986 -8.922 1.00 12.79 C ANISOU 3572 C GLU A 200 1366 1886 1609 -572 -100 76 C ATOM 3573 O GLU A 200 7.108 -32.857 -8.076 1.00 14.46 O ANISOU 3573 O GLU A 200 1586 2101 1808 -609 -98 99 O ATOM 3574 CB GLU A 200 8.678 -32.722 -10.921 1.00 19.68 C ANISOU 3574 CB GLU A 200 2337 2651 2491 -571 -120 43 C ATOM 3575 CG GLU A 200 8.621 -33.524 -12.218 1.00 36.76 C ANISOU 3575 CG GLU A 200 4547 4776 4645 -616 -135 27 C ATOM 3576 CD GLU A 200 9.941 -33.551 -12.968 1.00 61.17 C ANISOU 3576 CD GLU A 200 7687 7810 7744 -579 -127 -5 C ATOM 3577 OE1 GLU A 200 9.933 -33.938 -14.156 1.00 69.72 O ANISOU 3577 OE1 GLU A 200 8803 8874 8815 -612 -135 -29 O ATOM 3578 OE2 GLU A 200 10.981 -33.184 -12.382 1.00 67.70 O ANISOU 3578 OE2 GLU A 200 8515 8621 8585 -522 -111 -9 O ATOM 0 H GLU A 200 7.319 -30.840 -11.709 1.00 12.26 H new ATOM 0 HA GLU A 200 6.707 -33.103 -10.500 1.00 12.31 H new ATOM 0 HB2 GLU A 200 9.200 -31.918 -11.065 1.00 19.68 H new ATOM 0 HB3 GLU A 200 9.139 -33.242 -10.244 1.00 19.68 H new ATOM 0 HG2 GLU A 200 8.352 -34.434 -12.016 1.00 36.76 H new ATOM 0 HG3 GLU A 200 7.937 -33.147 -12.794 1.00 36.76 H new ATOM 3585 N ALA A 201 7.576 -30.720 -8.580 1.00 12.31 N ANISOU 3585 N ALA A 201 1269 1850 1560 -517 -83 59 N ATOM 3586 CA ALA A 201 7.511 -30.334 -7.176 1.00 12.46 C ANISOU 3586 CA ALA A 201 1253 1911 1569 -504 -57 59 C ATOM 3587 C ALA A 201 6.073 -30.396 -6.664 1.00 12.51 C ANISOU 3587 C ALA A 201 1201 1988 1564 -539 -51 78 C ATOM 3588 O ALA A 201 5.822 -30.895 -5.561 1.00 13.87 O ANISOU 3588 O ALA A 201 1362 2195 1714 -569 -39 93 O ATOM 3589 CB ALA A 201 8.103 -28.939 -6.986 1.00 16.56 C ANISOU 3589 CB ALA A 201 1755 2433 2104 -444 -34 26 C ATOM 0 H ALA A 201 7.775 -30.089 -9.129 1.00 12.31 H new ATOM 0 HA ALA A 201 8.037 -30.962 -6.656 1.00 12.46 H new ATOM 0 HB1 ALA A 201 8.055 -28.692 -6.049 1.00 16.56 H new ATOM 0 HB2 ALA A 201 9.030 -28.939 -7.273 1.00 16.56 H new ATOM 0 HB3 ALA A 201 7.601 -28.299 -7.515 1.00 16.56 H new ATOM 3595 N MET A 202 5.118 -29.888 -7.450 1.00 13.35 N ANISOU 3595 N MET A 202 1265 2126 1683 -536 -60 82 N ATOM 3596 CA AMET A 202 3.711 -29.977 -7.074 0.47 13.25 C ANISOU 3596 CA AMET A 202 1185 2190 1658 -570 -56 103 C ATOM 3597 CA BMET A 202 3.710 -29.979 -7.075 0.53 13.25 C ANISOU 3597 CA BMET A 202 1185 2190 1658 -570 -56 103 C ATOM 3598 C MET A 202 3.344 -31.391 -6.638 1.00 13.58 C ANISOU 3598 C MET A 202 1249 2243 1669 -650 -68 132 C ATOM 3599 O MET A 202 2.678 -31.588 -5.615 1.00 13.97 O ANISOU 3599 O MET A 202 1258 2353 1697 -680 -51 146 O ATOM 3600 CB AMET A 202 2.832 -29.538 -8.250 0.47 15.14 C ANISOU 3600 CB AMET A 202 1382 2459 1912 -566 -78 117 C ATOM 3601 CB BMET A 202 2.826 -29.554 -8.250 0.53 14.58 C ANISOU 3601 CB BMET A 202 1310 2388 1840 -567 -78 118 C ATOM 3602 CG AMET A 202 1.334 -29.488 -7.949 0.47 19.41 C ANISOU 3602 CG AMET A 202 1835 3095 2443 -591 -74 143 C ATOM 3603 CG BMET A 202 2.704 -28.061 -8.437 0.53 17.51 C ANISOU 3603 CG BMET A 202 1635 2771 2248 -487 -60 105 C ATOM 3604 SD AMET A 202 0.867 -28.361 -6.620 0.47 24.20 S ANISOU 3604 SD AMET A 202 2367 3763 3067 -529 -18 121 S ATOM 3605 SD BMET A 202 1.686 -27.295 -7.161 0.53 21.85 S ANISOU 3605 SD BMET A 202 2094 3401 2806 -455 -13 97 S ATOM 3606 CE AMET A 202 1.584 -26.830 -7.219 0.47 27.16 C ANISOU 3606 CE AMET A 202 2750 4076 3493 -428 -5 93 C ATOM 3607 CE BMET A 202 0.072 -27.915 -7.634 0.53 30.00 C ANISOU 3607 CE BMET A 202 3050 4528 3821 -512 -39 145 C ATOM 0 H AMET A 202 5.266 -29.492 -8.199 0.47 13.35 H new ATOM 0 H BMET A 202 5.266 -29.490 -8.198 0.53 13.35 H new ATOM 0 HA AMET A 202 3.558 -29.386 -6.320 0.47 13.25 H new ATOM 0 HA BMET A 202 3.561 -29.382 -6.325 0.53 13.25 H new ATOM 0 HB2AMET A 202 3.120 -28.659 -8.542 0.47 14.58 H new ATOM 0 HB2BMET A 202 3.182 -29.942 -9.064 0.53 14.58 H new ATOM 0 HB3AMET A 202 2.980 -30.145 -8.992 0.47 14.58 H new ATOM 0 HB3BMET A 202 1.939 -29.926 -8.123 0.53 14.58 H new ATOM 0 HG2AMET A 202 0.863 -29.229 -8.756 0.47 17.51 H new ATOM 0 HG2BMET A 202 3.588 -27.662 -8.426 0.53 17.51 H new ATOM 0 HG3AMET A 202 1.033 -30.381 -7.719 0.47 17.51 H new ATOM 0 HG3BMET A 202 2.320 -27.876 -9.309 0.53 17.51 H new ATOM 0 HE1AMET A 202 1.821 -26.267 -6.466 0.47 30.00 H new ATOM 0 HE1BMET A 202 -0.616 -27.336 -7.272 0.53 30.00 H new ATOM 0 HE2AMET A 202 2.380 -27.026 -7.738 0.47 30.00 H new ATOM 0 HE2BMET A 202 0.003 -27.933 -8.601 0.53 30.00 H new ATOM 0 HE3AMET A 202 0.940 -26.368 -7.778 0.47 30.00 H new ATOM 0 HE3BMET A 202 -0.045 -28.813 -7.285 0.53 30.00 H new ATOM 3626 N ALA A 203 3.772 -32.391 -7.409 1.00 13.53 N ANISOU 3626 N ALA A 203 1309 2173 1659 -690 -95 140 N ATOM 3627 CA ALA A 203 3.387 -33.775 -7.155 1.00 13.98 C ANISOU 3627 CA ALA A 203 1398 2221 1693 -773 -108 169 C ATOM 3628 C ALA A 203 4.075 -34.376 -5.939 1.00 14.23 C ANISOU 3628 C ALA A 203 1464 2227 1715 -777 -93 185 C ATOM 3629 O ALA A 203 3.677 -35.462 -5.507 1.00 14.47 O ANISOU 3629 O ALA A 203 1517 2254 1727 -847 -99 219 O ATOM 3630 CB ALA A 203 3.685 -34.635 -8.389 1.00 18.88 C ANISOU 3630 CB ALA A 203 2087 2770 2317 -812 -133 163 C ATOM 0 H ALA A 203 4.289 -32.286 -8.088 1.00 13.53 H new ATOM 0 HA ALA A 203 2.435 -33.767 -6.968 1.00 13.98 H new ATOM 0 HB1 ALA A 203 3.427 -35.553 -8.214 1.00 18.88 H new ATOM 0 HB2 ALA A 203 3.183 -34.298 -9.148 1.00 18.88 H new ATOM 0 HB3 ALA A 203 4.634 -34.599 -8.588 1.00 18.88 H new ATOM 3636 N ASP A 204 5.083 -33.707 -5.388 1.00 13.56 N ANISOU 3636 N ASP A 204 1385 2128 1639 -712 -76 167 N ATOM 3637 CA ASP A 204 5.831 -34.195 -4.231 1.00 13.62 C ANISOU 3637 CA ASP A 204 1418 2124 1631 -712 -66 190 C ATOM 3638 C ASP A 204 5.506 -33.425 -2.954 1.00 18.59 C ANISOU 3638 C ASP A 204 1985 2842 2235 -703 -37 185 C ATOM 3639 O ASP A 204 5.998 -33.789 -1.878 1.00 15.20 O ANISOU 3639 O ASP A 204 1567 2429 1781 -714 -30 208 O ATOM 3640 CB ASP A 204 7.334 -34.110 -4.542 1.00 13.16 C ANISOU 3640 CB ASP A 204 1412 1993 1594 -654 -69 174 C ATOM 3641 CG ASP A 204 8.208 -34.803 -3.515 1.00 21.43 C ANISOU 3641 CG ASP A 204 2490 3023 2629 -653 -68 210 C ATOM 3642 OD1 ASP A 204 8.029 -36.015 -3.293 1.00 27.17 O ANISOU 3642 OD1 ASP A 204 3254 3716 3353 -700 -80 255 O ATOM 3643 OD2 ASP A 204 9.120 -34.136 -2.967 1.00 25.58 O ANISOU 3643 OD2 ASP A 204 3004 3567 3149 -607 -57 197 O ATOM 0 H ASP A 204 5.356 -32.945 -5.679 1.00 13.56 H new ATOM 0 HA ASP A 204 5.570 -35.115 -4.069 1.00 13.62 H new ATOM 0 HB2 ASP A 204 7.499 -34.503 -5.413 1.00 13.16 H new ATOM 0 HB3 ASP A 204 7.592 -33.177 -4.598 1.00 13.16 H new ATOM 3648 N LEU A 205 4.681 -32.376 -3.037 1.00 13.76 N ANISOU 3648 N LEU A 205 1308 2293 1627 -682 -19 155 N ATOM 3649 CA LEU A 205 4.379 -31.568 -1.858 1.00 13.96 C ANISOU 3649 CA LEU A 205 1276 2399 1630 -668 19 135 C ATOM 3650 C LEU A 205 3.708 -32.381 -0.758 1.00 15.19 C ANISOU 3650 C LEU A 205 1409 2622 1740 -739 26 174 C ATOM 3651 O LEU A 205 3.894 -32.089 0.429 1.00 14.76 O ANISOU 3651 O LEU A 205 1332 2625 1652 -743 52 166 O ATOM 3652 CB LEU A 205 3.478 -30.393 -2.238 1.00 14.06 C ANISOU 3652 CB LEU A 205 1220 2457 1666 -628 41 101 C ATOM 3653 CG LEU A 205 4.123 -29.268 -3.044 1.00 13.59 C ANISOU 3653 CG LEU A 205 1172 2343 1647 -553 45 62 C ATOM 3654 CD1 LEU A 205 3.066 -28.236 -3.424 1.00 13.89 C ANISOU 3654 CD1 LEU A 205 1140 2423 1714 -513 64 45 C ATOM 3655 CD2 LEU A 205 5.259 -28.624 -2.270 1.00 13.32 C ANISOU 3655 CD2 LEU A 205 1162 2294 1605 -519 70 26 C ATOM 0 H LEU A 205 4.291 -32.120 -3.760 1.00 13.76 H new ATOM 0 HA LEU A 205 5.225 -31.241 -1.515 1.00 13.96 H new ATOM 0 HB2 LEU A 205 2.728 -30.739 -2.747 1.00 14.06 H new ATOM 0 HB3 LEU A 205 3.116 -30.012 -1.422 1.00 14.06 H new ATOM 0 HG LEU A 205 4.501 -29.642 -3.855 1.00 13.59 H new ATOM 0 HD11 LEU A 205 3.479 -27.523 -3.936 1.00 13.89 H new ATOM 0 HD12 LEU A 205 2.377 -28.660 -3.959 1.00 13.89 H new ATOM 0 HD13 LEU A 205 2.669 -27.868 -2.619 1.00 13.89 H new ATOM 0 HD21 LEU A 205 5.652 -27.914 -2.802 1.00 13.32 H new ATOM 0 HD22 LEU A 205 4.917 -28.255 -1.441 1.00 13.32 H new ATOM 0 HD23 LEU A 205 5.935 -29.291 -2.072 1.00 13.32 H new ATOM 3667 N HIS A 206 2.916 -33.388 -1.127 1.00 14.94 N ANISOU 3667 N HIS A 206 1383 2591 1702 -805 3 214 N ATOM 3668 CA HIS A 206 2.165 -34.150 -0.138 1.00 15.61 C ANISOU 3668 CA HIS A 206 1443 2745 1742 -883 9 256 C ATOM 3669 C HIS A 206 3.069 -34.880 0.847 1.00 16.14 C ANISOU 3669 C HIS A 206 1560 2792 1781 -906 5 295 C ATOM 3670 O HIS A 206 2.583 -35.329 1.890 1.00 16.85 O ANISOU 3670 O HIS A 206 1625 2952 1825 -967 15 331 O ATOM 3671 CB HIS A 206 1.248 -35.156 -0.841 1.00 16.03 C ANISOU 3671 CB HIS A 206 1506 2789 1795 -959 -18 292 C ATOM 3672 CG HIS A 206 1.984 -36.292 -1.480 1.00 18.45 C ANISOU 3672 CG HIS A 206 1909 2979 2121 -984 -51 321 C ATOM 3673 ND1 HIS A 206 2.197 -37.493 -0.839 1.00 19.69 N ANISOU 3673 ND1 HIS A 206 2118 3103 2259 -1046 -62 376 N ATOM 3674 CD2 HIS A 206 2.579 -36.400 -2.691 1.00 15.91 C ANISOU 3674 CD2 HIS A 206 1642 2565 1837 -953 -72 300 C ATOM 3675 CE1 HIS A 206 2.880 -38.297 -1.634 1.00 21.12 C ANISOU 3675 CE1 HIS A 206 2384 3167 2473 -1046 -85 386 C ATOM 3676 NE2 HIS A 206 3.125 -37.658 -2.763 1.00 24.91 N ANISOU 3676 NE2 HIS A 206 2867 3615 2985 -992 -90 336 N ATOM 0 H HIS A 206 2.802 -33.643 -1.941 1.00 14.94 H new ATOM 0 HA HIS A 206 1.636 -33.515 0.371 1.00 15.61 H new ATOM 0 HB2 HIS A 206 0.616 -35.511 -0.197 1.00 16.03 H new ATOM 0 HB3 HIS A 206 0.732 -34.693 -1.519 1.00 16.03 H new ATOM 0 HD2 HIS A 206 2.612 -35.745 -3.351 1.00 15.91 H new ATOM 0 HE1 HIS A 206 3.144 -39.166 -1.433 1.00 21.12 H new ATOM 0 HE2 HIS A 206 3.557 -37.978 -3.435 1.00 24.91 H new ATOM 3684 N THR A 207 4.361 -35.007 0.546 1.00 15.26 N ANISOU 3684 N THR A 207 1511 2594 1694 -860 -12 295 N ATOM 3685 CA THR A 207 5.297 -35.688 1.428 1.00 18.17 C ANISOU 3685 CA THR A 207 1920 2944 2040 -871 -21 343 C ATOM 3686 C THR A 207 5.864 -34.784 2.517 1.00 19.24 C ANISOU 3686 C THR A 207 2018 3155 2138 -843 5 319 C ATOM 3687 O THR A 207 6.512 -35.292 3.438 1.00 15.68 O ANISOU 3687 O THR A 207 1583 2722 1653 -863 -3 367 O ATOM 3688 CB THR A 207 6.468 -36.260 0.621 1.00 15.11 C ANISOU 3688 CB THR A 207 1609 2436 1695 -830 -48 356 C ATOM 3689 OG1 THR A 207 7.263 -35.183 0.116 1.00 14.45 O ANISOU 3689 OG1 THR A 207 1519 2336 1635 -753 -39 298 O ATOM 3690 CG2 THR A 207 5.975 -37.119 -0.542 1.00 20.95 C ANISOU 3690 CG2 THR A 207 2395 3094 2470 -862 -68 365 C ATOM 0 H THR A 207 4.716 -34.700 -0.175 1.00 15.26 H new ATOM 0 HA THR A 207 4.791 -36.395 1.858 1.00 18.17 H new ATOM 0 HB THR A 207 6.998 -36.822 1.208 1.00 15.11 H new ATOM 0 HG1 THR A 207 6.841 -34.784 -0.491 1.00 14.45 H new ATOM 0 HG21 THR A 207 6.736 -37.466 -1.033 1.00 20.95 H new ATOM 0 HG22 THR A 207 5.448 -37.857 -0.199 1.00 20.95 H new ATOM 0 HG23 THR A 207 5.428 -36.579 -1.134 1.00 20.95 H new ATOM 3698 N LEU A 208 5.620 -33.476 2.443 1.00 15.10 N ANISOU 3698 N LEU A 208 1444 2676 1618 -801 36 249 N ATOM 3699 CA LEU A 208 6.314 -32.485 3.251 1.00 15.25 C ANISOU 3699 CA LEU A 208 1440 2745 1609 -769 64 206 C ATOM 3700 C LEU A 208 5.532 -32.095 4.501 1.00 21.73 C ANISOU 3700 C LEU A 208 2198 3687 2370 -813 104 190 C ATOM 3701 O LEU A 208 4.300 -32.139 4.534 1.00 18.13 O ANISOU 3701 O LEU A 208 1697 3282 1909 -844 121 188 O ATOM 3702 CB LEU A 208 6.574 -31.222 2.437 1.00 14.46 C ANISOU 3702 CB LEU A 208 1333 2608 1553 -697 81 133 C ATOM 3703 CG LEU A 208 7.317 -31.417 1.117 1.00 17.00 C ANISOU 3703 CG LEU A 208 1709 2822 1928 -653 49 136 C ATOM 3704 CD1 LEU A 208 7.526 -30.069 0.455 1.00 14.15 C ANISOU 3704 CD1 LEU A 208 1335 2438 1602 -591 69 70 C ATOM 3705 CD2 LEU A 208 8.637 -32.147 1.327 1.00 17.61 C ANISOU 3705 CD2 LEU A 208 1836 2857 1997 -649 22 177 C ATOM 0 H LEU A 208 5.035 -33.138 1.911 1.00 15.10 H new ATOM 0 HA LEU A 208 7.149 -32.895 3.526 1.00 15.25 H new ATOM 0 HB2 LEU A 208 5.722 -30.799 2.248 1.00 14.46 H new ATOM 0 HB3 LEU A 208 7.082 -30.604 2.985 1.00 14.46 H new ATOM 0 HG LEU A 208 6.780 -31.974 0.531 1.00 17.00 H new ATOM 0 HD11 LEU A 208 7.998 -30.190 -0.384 1.00 14.15 H new ATOM 0 HD12 LEU A 208 6.665 -29.655 0.285 1.00 14.15 H new ATOM 0 HD13 LEU A 208 8.049 -29.498 1.040 1.00 14.15 H new ATOM 0 HD21 LEU A 208 9.086 -32.256 0.474 1.00 17.61 H new ATOM 0 HD22 LEU A 208 9.201 -31.631 1.925 1.00 17.61 H new ATOM 0 HD23 LEU A 208 8.466 -33.019 1.716 1.00 17.61 H new ATOM 3717 N SER A 209 6.280 -31.686 5.524 1.00 17.37 N ANISOU 3717 N SER A 209 1640 3191 1770 -818 121 175 N ATOM 3718 CA SER A 209 5.741 -30.974 6.672 1.00 21.13 C ANISOU 3718 CA SER A 209 2057 3783 2188 -849 171 130 C ATOM 3719 C SER A 209 5.262 -29.584 6.257 1.00 20.95 C ANISOU 3719 C SER A 209 1998 3758 2202 -791 218 34 C ATOM 3720 O SER A 209 5.587 -29.078 5.181 1.00 17.64 O ANISOU 3720 O SER A 209 1604 3252 1848 -728 208 7 O ATOM 3721 CB SER A 209 6.808 -30.828 7.756 1.00 16.59 C ANISOU 3721 CB SER A 209 1490 3265 1549 -872 174 132 C ATOM 3722 OG SER A 209 7.835 -29.946 7.317 1.00 22.08 O ANISOU 3722 OG SER A 209 2209 3908 2273 -813 177 78 O ATOM 0 H SER A 209 7.129 -31.818 5.568 1.00 17.37 H new ATOM 0 HA SER A 209 4.993 -31.485 7.020 1.00 21.13 H new ATOM 0 HB2 SER A 209 6.407 -30.488 8.571 1.00 16.59 H new ATOM 0 HB3 SER A 209 7.186 -31.696 7.967 1.00 16.59 H new ATOM 0 HG SER A 209 8.263 -30.304 6.689 1.00 22.08 H new ATOM 3728 N GLU A 210 4.505 -28.945 7.150 1.00 20.27 N ANISOU 3728 N GLU A 210 2400 3408 1895 13 632 288 N ATOM 3729 CA GLU A 210 4.043 -27.587 6.881 1.00 20.91 C ANISOU 3729 CA GLU A 210 2586 3466 1891 187 686 207 C ATOM 3730 C GLU A 210 5.220 -26.645 6.636 1.00 20.30 C ANISOU 3730 C GLU A 210 2728 3201 1783 140 514 96 C ATOM 3731 O GLU A 210 5.182 -25.820 5.715 1.00 20.67 O ANISOU 3731 O GLU A 210 2775 3194 1887 193 488 35 O ATOM 3732 CB GLU A 210 3.182 -27.091 8.043 1.00 33.24 C ANISOU 3732 CB GLU A 210 4303 5096 3229 395 875 232 C ATOM 3733 CG GLU A 210 2.582 -25.707 7.831 1.00 58.30 C ANISOU 3733 CG GLU A 210 7624 8229 6297 641 991 173 C ATOM 3734 CD GLU A 210 1.719 -25.254 8.997 1.00 73.82 C ANISOU 3734 CD GLU A 210 9783 10249 8017 905 1238 217 C ATOM 3735 OE1 GLU A 210 1.564 -26.028 9.966 1.00 71.61 O ANISOU 3735 OE1 GLU A 210 9498 10058 7651 878 1308 296 O ATOM 3736 OE2 GLU A 210 1.197 -24.120 8.943 1.00 77.02 O ANISOU 3736 OE2 GLU A 210 10363 10597 8304 1164 1383 184 O ATOM 0 H GLU A 210 4.253 -29.274 7.903 1.00 20.27 H new ATOM 0 HA GLU A 210 3.504 -27.598 6.075 1.00 20.91 H new ATOM 0 HB2 GLU A 210 2.463 -27.725 8.193 1.00 33.24 H new ATOM 0 HB3 GLU A 210 3.721 -27.078 8.849 1.00 33.24 H new ATOM 0 HG2 GLU A 210 3.298 -25.066 7.696 1.00 58.30 H new ATOM 0 HG3 GLU A 210 2.048 -25.711 7.021 1.00 58.30 H new ATOM 3743 N ASP A 211 6.281 -26.759 7.442 1.00 23.62 N ANISOU 3743 N ASP A 211 3322 3535 2116 19 378 99 N ATOM 3744 CA ASP A 211 7.426 -25.865 7.284 1.00 23.77 C ANISOU 3744 CA ASP A 211 3532 3399 2099 -79 180 44 C ATOM 3745 C ASP A 211 8.143 -26.097 5.958 1.00 18.66 C ANISOU 3745 C ASP A 211 2665 2733 1691 -180 77 75 C ATOM 3746 O ASP A 211 8.501 -25.139 5.265 1.00 23.93 O ANISOU 3746 O ASP A 211 3402 3308 2382 -185 -4 20 O ATOM 3747 CB ASP A 211 8.400 -26.044 8.446 1.00 32.14 C ANISOU 3747 CB ASP A 211 4780 4417 3016 -231 25 99 C ATOM 3748 CG ASP A 211 7.940 -25.338 9.715 1.00 44.68 C ANISOU 3748 CG ASP A 211 6748 5945 4285 -143 83 27 C ATOM 3749 OD1 ASP A 211 6.826 -24.771 9.735 1.00 35.91 O ANISOU 3749 OD1 ASP A 211 5735 4833 3075 83 290 -49 O ATOM 3750 OD2 ASP A 211 8.706 -25.351 10.697 1.00 49.55 O ANISOU 3750 OD2 ASP A 211 7577 6517 4733 -292 -74 65 O ATOM 0 H ASP A 211 6.355 -27.337 8.074 1.00 23.62 H new ATOM 0 HA ASP A 211 7.091 -24.955 7.284 1.00 23.77 H new ATOM 0 HB2 ASP A 211 8.509 -26.990 8.629 1.00 32.14 H new ATOM 0 HB3 ASP A 211 9.271 -25.703 8.188 1.00 32.14 H new ATOM 3755 N SER A 212 8.381 -27.362 5.598 1.00 22.03 N ANISOU 3755 N SER A 212 2861 3228 2282 -251 94 169 N ATOM 3756 CA SER A 212 9.021 -27.667 4.321 1.00 16.19 C ANISOU 3756 CA SER A 212 1954 2457 1741 -305 47 204 C ATOM 3757 C SER A 212 8.129 -27.255 3.155 1.00 16.65 C ANISOU 3757 C SER A 212 1930 2529 1865 -220 129 120 C ATOM 3758 O SER A 212 8.616 -26.757 2.131 1.00 15.76 O ANISOU 3758 O SER A 212 1788 2360 1839 -231 70 101 O ATOM 3759 CB SER A 212 9.344 -29.160 4.245 1.00 24.67 C ANISOU 3759 CB SER A 212 2879 3559 2934 -359 94 317 C ATOM 3760 OG SER A 212 10.305 -29.533 5.210 1.00 26.93 O ANISOU 3760 OG SER A 212 3203 3848 3182 -430 5 439 O ATOM 0 H SER A 212 8.181 -28.049 6.075 1.00 22.03 H new ATOM 0 HA SER A 212 9.847 -27.161 4.260 1.00 16.19 H new ATOM 0 HB2 SER A 212 8.533 -29.675 4.379 1.00 24.67 H new ATOM 0 HB3 SER A 212 9.674 -29.376 3.359 1.00 24.67 H new ATOM 0 HG SER A 212 10.170 -30.327 5.447 1.00 26.93 H new ATOM 3766 N ATYR A 213 6.817 -27.461 3.299 0.45 16.24 N ANISOU 3766 N ATYR A 213 1820 2577 1773 -139 262 101 N ATOM 3767 N BTYR A 213 6.818 -27.464 3.296 0.55 15.90 N ANISOU 3767 N BTYR A 213 1777 2534 1731 -140 262 102 N ATOM 3768 CA ATYR A 213 5.859 -27.021 2.289 0.45 17.14 C ANISOU 3768 CA ATYR A 213 1830 2748 1934 -63 324 67 C ATOM 3769 CA BTYR A 213 5.865 -27.020 2.284 0.55 17.07 C ANISOU 3769 CA BTYR A 213 1821 2738 1926 -64 323 67 C ATOM 3770 C ATYR A 213 5.991 -25.525 2.027 0.45 17.19 C ANISOU 3770 C ATYR A 213 1980 2673 1880 41 286 -10 C ATOM 3771 C BTYR A 213 6.001 -25.523 2.026 0.55 17.13 C ANISOU 3771 C BTYR A 213 1972 2664 1872 41 285 -10 C ATOM 3772 O ATYR A 213 5.989 -25.085 0.871 0.45 17.71 O ANISOU 3772 O ATYR A 213 1981 2718 2031 51 255 -33 O ATOM 3773 O BTYR A 213 6.014 -25.082 0.870 0.55 17.12 O ANISOU 3773 O BTYR A 213 1908 2641 1956 49 252 -33 O ATOM 3774 CB ATYR A 213 4.448 -27.383 2.761 0.45 17.48 C ANISOU 3774 CB ATYR A 213 1762 2954 1925 8 467 128 C ATOM 3775 CB BTYR A 213 4.452 -27.390 2.744 0.55 16.95 C ANISOU 3775 CB BTYR A 213 1693 2887 1861 7 466 128 C ATOM 3776 CG ATYR A 213 3.320 -27.178 1.771 0.45 17.22 C ANISOU 3776 CG ATYR A 213 1544 3047 1952 53 519 169 C ATOM 3777 CG BTYR A 213 3.302 -26.787 1.968 0.55 17.48 C ANISOU 3777 CG BTYR A 213 1624 3069 1948 114 537 154 C ATOM 3778 CD1ATYR A 213 2.960 -28.181 0.880 0.45 16.88 C ANISOU 3778 CD1ATYR A 213 1333 3064 2016 -111 482 226 C ATOM 3779 CD1BTYR A 213 2.642 -27.519 0.990 0.55 17.34 C ANISOU 3779 CD1BTYR A 213 1394 3159 2037 -4 520 226 C ATOM 3780 CD2ATYR A 213 2.583 -26.000 1.761 0.45 23.52 C ANISOU 3780 CD2ATYR A 213 2357 3900 2681 257 605 172 C ATOM 3781 CD2BTYR A 213 2.849 -25.501 2.240 0.55 18.62 C ANISOU 3781 CD2BTYR A 213 1876 3212 1987 331 619 129 C ATOM 3782 CE1ATYR A 213 1.916 -28.008 -0.012 0.45 22.08 C ANISOU 3782 CE1ATYR A 213 1813 3864 2712 -118 487 297 C ATOM 3783 CE1BTYR A 213 1.577 -26.980 0.287 0.55 21.79 C ANISOU 3783 CE1BTYR A 213 1794 3868 2618 74 557 298 C ATOM 3784 CE2ATYR A 213 1.535 -25.818 0.869 0.45 23.69 C ANISOU 3784 CE2ATYR A 213 2164 4075 2763 301 642 262 C ATOM 3785 CE2BTYR A 213 1.785 -24.952 1.543 0.55 19.51 C ANISOU 3785 CE2BTYR A 213 1832 3454 2128 462 699 201 C ATOM 3786 CZ ATYR A 213 1.207 -26.828 -0.014 0.45 20.88 C ANISOU 3786 CZ ATYR A 213 1611 3808 2514 91 564 331 C ATOM 3787 CZ BTYR A 213 1.153 -25.696 0.568 0.55 22.21 C ANISOU 3787 CZ BTYR A 213 1902 3946 2593 325 656 300 C ATOM 3788 OH ATYR A 213 0.168 -26.664 -0.903 0.45 19.60 O ANISOU 3788 OH ATYR A 213 1228 3821 2397 86 557 451 O ATOM 3789 OH BTYR A 213 0.094 -25.156 -0.127 0.55 23.42 O ANISOU 3789 OH BTYR A 213 1862 4264 2774 434 707 417 O ATOM 0 H ATYR A 213 6.464 -27.855 3.977 0.45 15.90 H new ATOM 0 H BTYR A 213 6.463 -27.861 3.971 0.55 15.90 H new ATOM 0 HA ATYR A 213 6.040 -27.471 1.449 0.45 17.07 H new ATOM 0 HA BTYR A 213 6.049 -27.465 1.442 0.55 17.07 H new ATOM 0 HB2ATYR A 213 4.449 -28.315 3.028 0.45 16.95 H new ATOM 0 HB2BTYR A 213 4.366 -28.356 2.710 0.55 16.95 H new ATOM 0 HB3ATYR A 213 4.252 -26.861 3.554 0.45 16.95 H new ATOM 0 HB3BTYR A 213 4.359 -27.129 3.674 0.55 16.95 H new ATOM 0 HD1ATYR A 213 3.429 -28.984 0.883 0.45 17.34 H new ATOM 0 HD1BTYR A 213 2.920 -28.387 0.804 0.55 17.34 H new ATOM 0 HD2ATYR A 213 2.795 -25.322 2.362 0.45 18.62 H new ATOM 0 HD2BTYR A 213 3.268 -25.000 2.902 0.55 18.62 H new ATOM 0 HE1ATYR A 213 1.694 -28.687 -0.608 0.45 21.79 H new ATOM 0 HE1BTYR A 213 1.150 -27.480 -0.371 0.55 21.79 H new ATOM 0 HE2ATYR A 213 1.057 -25.021 0.866 0.45 19.51 H new ATOM 0 HE2BTYR A 213 1.499 -24.087 1.731 0.55 19.51 H new ATOM 0 HH ATYR A 213 -0.175 -25.905 -0.796 0.45 23.42 H new ATOM 0 HH BTYR A 213 -0.053 -24.376 0.147 0.55 23.42 H new ATOM 3808 N LYS A 214 6.133 -24.727 3.089 1.00 17.25 N ANISOU 3808 N LYS A 214 2225 2608 1720 112 285 -51 N ATOM 3809 CA LYS A 214 6.291 -23.286 2.916 1.00 17.97 C ANISOU 3809 CA LYS A 214 2536 2566 1725 198 245 -129 C ATOM 3810 C LYS A 214 7.590 -22.949 2.191 1.00 18.22 C ANISOU 3810 C LYS A 214 2589 2481 1852 38 56 -131 C ATOM 3811 O LYS A 214 7.610 -22.066 1.325 1.00 17.49 O ANISOU 3811 O LYS A 214 2528 2321 1798 81 29 -166 O ATOM 3812 CB LYS A 214 6.230 -22.588 4.276 1.00 33.66 C ANISOU 3812 CB LYS A 214 4871 4454 3465 279 277 -181 C ATOM 3813 CG LYS A 214 4.832 -22.587 4.886 1.00 57.42 C ANISOU 3813 CG LYS A 214 7881 7577 6359 522 524 -157 C ATOM 3814 CD LYS A 214 4.803 -21.985 6.285 1.00 86.27 C ANISOU 3814 CD LYS A 214 11944 11110 9723 624 588 -213 C ATOM 3815 CE LYS A 214 3.402 -22.073 6.883 1.00 93.47 C ANISOU 3815 CE LYS A 214 12816 12169 10528 910 885 -142 C ATOM 3816 NZ LYS A 214 3.318 -21.539 8.269 1.00 90.77 N ANISOU 3816 NZ LYS A 214 12924 11701 9864 1048 994 -198 N ATOM 0 H ALYS A 214 6.140 -24.998 3.905 0.45 17.25 H new ATOM 0 H BLYS A 214 6.134 -24.998 3.905 0.55 17.25 H new ATOM 0 HA LYS A 214 5.561 -22.965 2.364 1.00 17.97 H new ATOM 0 HB2 LYS A 214 6.843 -23.027 4.886 1.00 33.66 H new ATOM 0 HB3 LYS A 214 6.535 -21.672 4.177 1.00 33.66 H new ATOM 0 HG2 LYS A 214 4.232 -22.087 4.310 1.00 57.42 H new ATOM 0 HG3 LYS A 214 4.498 -23.497 4.922 1.00 57.42 H new ATOM 0 HD2 LYS A 214 5.433 -22.452 6.856 1.00 86.27 H new ATOM 0 HD3 LYS A 214 5.086 -21.058 6.249 1.00 86.27 H new ATOM 0 HE2 LYS A 214 2.784 -21.584 6.317 1.00 93.47 H new ATOM 0 HE3 LYS A 214 3.115 -22.999 6.882 1.00 93.47 H new ATOM 0 HZ1 LYS A 214 2.483 -21.615 8.567 1.00 90.77 H new ATOM 0 HZ2 LYS A 214 3.864 -22.000 8.799 1.00 90.77 H new ATOM 0 HZ3 LYS A 214 3.557 -20.682 8.272 1.00 90.77 H new ATOM 3831 N ASP A 215 8.685 -23.640 2.523 1.00 16.90 N ANISOU 3831 N ASP A 215 2382 2307 1731 -133 -65 -60 N ATOM 3832 CA ASP A 215 9.955 -23.373 1.849 1.00 16.84 C ANISOU 3832 CA ASP A 215 2336 2233 1828 -273 -226 4 C ATOM 3833 C ASP A 215 9.867 -23.680 0.359 1.00 16.24 C ANISOU 3833 C ASP A 215 2040 2199 1930 -237 -168 19 C ATOM 3834 O ASP A 215 10.377 -22.919 -0.470 1.00 17.47 O ANISOU 3834 O ASP A 215 2206 2292 2140 -261 -240 29 O ATOM 3835 CB ASP A 215 11.084 -24.201 2.465 1.00 17.56 C ANISOU 3835 CB ASP A 215 2356 2360 1956 -426 -334 144 C ATOM 3836 CG ASP A 215 11.390 -23.827 3.903 1.00 28.41 C ANISOU 3836 CG ASP A 215 3977 3688 3129 -522 -453 151 C ATOM 3837 OD1 ASP A 215 11.170 -22.665 4.300 1.00 27.87 O ANISOU 3837 OD1 ASP A 215 4205 3497 2887 -519 -508 52 O ATOM 3838 OD2 ASP A 215 11.878 -24.715 4.633 1.00 27.09 O ANISOU 3838 OD2 ASP A 215 3739 3593 2962 -601 -492 264 O ATOM 0 H ASP A 215 8.713 -24.255 3.124 1.00 16.90 H new ATOM 0 HA ASP A 215 10.147 -22.429 1.965 1.00 16.84 H new ATOM 0 HB2 ASP A 215 10.845 -25.140 2.426 1.00 17.56 H new ATOM 0 HB3 ASP A 215 11.886 -24.090 1.931 1.00 17.56 H new ATOM 3843 N SER A 216 9.244 -24.806 0.004 1.00 19.29 N ANISOU 3843 N SER A 216 2258 2679 2391 -200 -48 29 N ATOM 3844 CA SER A 216 9.206 -25.233 -1.389 1.00 18.28 C ANISOU 3844 CA SER A 216 1988 2568 2388 -195 -4 40 C ATOM 3845 C SER A 216 8.270 -24.355 -2.213 1.00 14.95 C ANISOU 3845 C SER A 216 1565 2164 1951 -105 27 -33 C ATOM 3846 O SER A 216 8.613 -23.941 -3.328 1.00 13.86 O ANISOU 3846 O SER A 216 1399 1992 1876 -107 -4 -30 O ATOM 3847 CB SER A 216 8.775 -26.701 -1.475 1.00 14.39 C ANISOU 3847 CB SER A 216 1396 2132 1940 -225 91 69 C ATOM 3848 OG SER A 216 9.706 -27.565 -0.831 1.00 14.38 O ANISOU 3848 OG SER A 216 1389 2104 1968 -277 82 164 O ATOM 0 H SER A 216 8.841 -25.331 0.553 1.00 19.29 H new ATOM 0 HA SER A 216 10.098 -25.141 -1.758 1.00 18.28 H new ATOM 0 HB2 SER A 216 7.901 -26.806 -1.067 1.00 14.39 H new ATOM 0 HB3 SER A 216 8.686 -26.958 -2.406 1.00 14.39 H new ATOM 0 HG SER A 216 10.297 -27.800 -1.380 1.00 14.38 H new ATOM 3854 N THR A 217 7.072 -24.072 -1.690 1.00 13.58 N ANISOU 3854 N THR A 217 1406 2062 1692 -6 104 -70 N ATOM 3855 CA THR A 217 6.107 -23.280 -2.447 1.00 14.95 C ANISOU 3855 CA THR A 217 1537 2285 1858 111 149 -88 C ATOM 3856 C THR A 217 6.612 -21.864 -2.689 1.00 14.30 C ANISOU 3856 C THR A 217 1622 2067 1743 173 86 -128 C ATOM 3857 O THR A 217 6.263 -21.242 -3.703 1.00 14.77 O ANISOU 3857 O THR A 217 1637 2135 1840 236 88 -124 O ATOM 3858 CB THR A 217 4.752 -23.244 -1.734 1.00 16.72 C ANISOU 3858 CB THR A 217 1713 2640 2001 246 276 -57 C ATOM 3859 OG1 THR A 217 4.899 -22.737 -0.401 1.00 17.99 O ANISOU 3859 OG1 THR A 217 2086 2724 2027 332 315 -93 O ATOM 3860 CG2 THR A 217 4.130 -24.637 -1.699 1.00 18.72 C ANISOU 3860 CG2 THR A 217 1775 3040 2299 140 316 13 C ATOM 0 H THR A 217 6.805 -24.325 -0.913 1.00 13.58 H new ATOM 0 HA THR A 217 5.994 -23.710 -3.309 1.00 14.95 H new ATOM 0 HB THR A 217 4.164 -22.652 -2.229 1.00 16.72 H new ATOM 0 HG1 THR A 217 5.236 -23.330 0.089 1.00 17.99 H new ATOM 0 HG21 THR A 217 3.274 -24.598 -1.245 1.00 18.72 H new ATOM 0 HG22 THR A 217 4.001 -24.957 -2.606 1.00 18.72 H new ATOM 0 HG23 THR A 217 4.720 -25.243 -1.224 1.00 18.72 H new ATOM 3868 N ALEU A 218 7.436 -21.338 -1.783 0.49 18.45 N ANISOU 3868 N ALEU A 218 2358 2462 2190 130 11 -153 N ATOM 3869 N BLEU A 218 7.431 -21.335 -1.782 0.51 18.42 N ANISOU 3869 N BLEU A 218 2355 2459 2186 131 12 -153 N ATOM 3870 CA ALEU A 218 8.008 -20.010 -1.987 0.49 21.80 C ANISOU 3870 CA ALEU A 218 2989 2723 2571 129 -82 -180 C ATOM 3871 CA BLEU A 218 7.998 -20.009 -1.997 0.51 21.80 C ANISOU 3871 CA BLEU A 218 2988 2724 2573 131 -81 -180 C ATOM 3872 C ALEU A 218 8.785 -19.950 -3.297 0.49 17.65 C ANISOU 3872 C ALEU A 218 2333 2187 2186 36 -164 -128 C ATOM 3873 C BLEU A 218 8.768 -19.961 -3.311 0.51 17.51 C ANISOU 3873 C BLEU A 218 2312 2172 2170 37 -162 -128 C ATOM 3874 O ALEU A 218 8.626 -19.011 -4.087 0.49 16.81 O ANISOU 3874 O ALEU A 218 2275 2021 2090 99 -173 -137 O ATOM 3875 O BLEU A 218 8.586 -19.042 -4.120 0.51 15.92 O ANISOU 3875 O BLEU A 218 2153 1916 1981 103 -168 -137 O ATOM 3876 CB ALEU A 218 8.908 -19.645 -0.804 0.49 19.67 C ANISOU 3876 CB ALEU A 218 2975 2318 2181 5 -206 -189 C ATOM 3877 CB BLEU A 218 8.901 -19.630 -0.824 0.51 19.62 C ANISOU 3877 CB BLEU A 218 2968 2311 2174 6 -206 -189 C ATOM 3878 CG ALEU A 218 9.583 -18.269 -0.835 0.49 32.38 C ANISOU 3878 CG ALEU A 218 4871 3720 3711 -70 -348 -207 C ATOM 3879 CG BLEU A 218 9.425 -18.190 -0.824 0.51 32.00 C ANISOU 3879 CG BLEU A 218 4842 3667 3650 -40 -328 -219 C ATOM 3880 CD1ALEU A 218 8.559 -17.145 -0.783 0.49 29.99 C ANISOU 3880 CD1ALEU A 218 4823 3297 3276 157 -225 -299 C ATOM 3881 CD1BLEU A 218 9.647 -17.716 0.603 0.51 31.44 C ANISOU 3881 CD1BLEU A 218 5145 3447 3354 -103 -400 -271 C ATOM 3882 CD2ALEU A 218 10.576 -18.134 0.313 0.49 27.51 C ANISOU 3882 CD2ALEU A 218 4485 3000 2969 -285 -531 -179 C ATOM 3883 CD2BLEU A 218 10.710 -18.058 -1.635 0.51 29.63 C ANISOU 3883 CD2BLEU A 218 4430 3344 3485 -246 -501 -112 C ATOM 0 H ALEU A 218 7.673 -21.728 -1.054 0.49 18.42 H new ATOM 0 H BLEU A 218 7.667 -21.720 -1.050 0.51 18.42 H new ATOM 0 HA ALEU A 218 7.286 -19.364 -2.041 0.49 21.80 H new ATOM 0 HA BLEU A 218 7.275 -19.365 -2.051 0.51 21.80 H new ATOM 0 HB2ALEU A 218 8.377 -19.701 0.006 0.49 19.62 H new ATOM 0 HB2BLEU A 218 8.411 -19.778 0.000 0.51 19.62 H new ATOM 0 HB3ALEU A 218 9.602 -20.319 -0.735 0.49 19.62 H new ATOM 0 HB3BLEU A 218 9.661 -20.233 -0.815 0.51 19.62 H new ATOM 0 HG ALEU A 218 10.063 -18.196 -1.675 0.49 32.00 H new ATOM 0 HG BLEU A 218 8.755 -17.629 -1.246 0.51 32.00 H new ATOM 0 HD11ALEU A 218 9.016 -16.290 -0.804 0.49 31.44 H new ATOM 0 HD11BLEU A 218 9.978 -16.804 0.594 0.51 31.44 H new ATOM 0 HD12ALEU A 218 7.965 -17.213 -1.547 0.49 31.44 H new ATOM 0 HD12BLEU A 218 8.809 -17.750 1.090 0.51 31.44 H new ATOM 0 HD13ALEU A 218 8.043 -17.215 0.035 0.49 31.44 H new ATOM 0 HD13BLEU A 218 10.296 -18.291 1.038 0.51 31.44 H new ATOM 0 HD21ALEU A 218 10.994 -17.259 0.279 0.49 29.63 H new ATOM 0 HD21BLEU A 218 11.013 -17.137 -1.614 0.51 29.63 H new ATOM 0 HD22ALEU A 218 10.110 -18.237 1.158 0.49 29.63 H new ATOM 0 HD22BLEU A 218 11.393 -18.632 -1.254 0.51 29.63 H new ATOM 0 HD23ALEU A 218 11.257 -18.820 0.234 0.49 29.63 H new ATOM 0 HD23BLEU A 218 10.542 -18.322 -2.553 0.51 29.63 H new ATOM 3906 N ILE A 219 9.625 -20.954 -3.550 1.00 19.09 N ANISOU 3906 N ILE A 219 2359 2425 2470 -89 -200 -54 N ATOM 3907 CA AILE A 219 10.399 -20.976 -4.788 0.44 16.14 C ANISOU 3907 CA AILE A 219 1870 2049 2213 -142 -233 20 C ATOM 3908 CA BILE A 219 10.395 -20.961 -4.789 0.56 16.20 C ANISOU 3908 CA BILE A 219 1879 2055 2220 -141 -233 19 C ATOM 3909 C ILE A 219 9.523 -21.370 -5.968 1.00 12.96 C ANISOU 3909 C ILE A 219 1345 1729 1850 -59 -133 -13 C ATOM 3910 O ILE A 219 9.736 -20.898 -7.089 1.00 15.80 O ANISOU 3910 O ILE A 219 1680 2071 2252 -47 -147 11 O ATOM 3911 CB AILE A 219 11.605 -21.923 -4.656 0.44 13.06 C ANISOU 3911 CB AILE A 219 1368 1688 1906 -248 -260 147 C ATOM 3912 CB BILE A 219 11.624 -21.875 -4.655 0.56 12.70 C ANISOU 3912 CB BILE A 219 1326 1639 1860 -250 -264 147 C ATOM 3913 CG1AILE A 219 12.448 -21.558 -3.428 0.44 18.95 C ANISOU 3913 CG1AILE A 219 2215 2387 2600 -376 -403 217 C ATOM 3914 CG1BILE A 219 12.547 -21.354 -3.547 0.56 17.46 C ANISOU 3914 CG1BILE A 219 2035 2185 2415 -385 -420 225 C ATOM 3915 CG2AILE A 219 12.454 -21.874 -5.919 0.44 18.62 C ANISOU 3915 CG2AILE A 219 1966 2394 2717 -260 -253 254 C ATOM 3916 CG2BILE A 219 12.376 -21.939 -5.975 0.56 18.31 C ANISOU 3916 CG2BILE A 219 1922 2358 2677 -251 -241 247 C ATOM 3917 CD1AILE A 219 12.918 -20.120 -3.407 0.44 14.92 C ANISOU 3917 CD1AILE A 219 1872 1758 2038 -468 -557 233 C ATOM 3918 CD1BILE A 219 13.491 -22.395 -2.997 0.56 20.72 C ANISOU 3918 CD1BILE A 219 2316 2669 2888 -465 -440 379 C ATOM 0 H AILE A 219 9.759 -21.622 -3.025 0.44 19.09 H new ATOM 0 H BILE A 219 9.772 -21.616 -3.021 0.56 19.09 H new ATOM 0 HA AILE A 219 10.735 -20.081 -4.953 0.44 16.20 H new ATOM 0 HA BILE A 219 10.711 -20.060 -4.959 0.56 16.20 H new ATOM 0 HB AILE A 219 11.274 -22.827 -4.539 0.44 12.70 H new ATOM 0 HB BILE A 219 11.326 -22.768 -4.422 0.56 12.70 H new ATOM 0 HG12AILE A 219 11.928 -21.730 -2.628 0.44 17.46 H new ATOM 0 HG12BILE A 219 13.065 -20.611 -3.893 0.56 17.46 H new ATOM 0 HG13AILE A 219 13.222 -22.142 -3.394 0.44 17.46 H new ATOM 0 HG13BILE A 219 12.004 -21.008 -2.822 0.56 17.46 H new ATOM 0 HG21AILE A 219 13.210 -22.474 -5.824 0.44 18.31 H new ATOM 0 HG21BILE A 219 13.149 -22.518 -5.880 0.56 18.31 H new ATOM 0 HG22AILE A 219 11.918 -22.147 -6.680 0.44 18.31 H new ATOM 0 HG22BILE A 219 11.791 -22.292 -6.664 0.56 18.31 H new ATOM 0 HG23AILE A 219 12.775 -20.969 -6.058 0.44 18.31 H new ATOM 0 HG23BILE A 219 12.668 -21.048 -6.225 0.56 18.31 H new ATOM 0 HD11AILE A 219 13.442 -19.962 -2.606 0.44 20.72 H new ATOM 0 HD11BILE A 219 14.042 -21.999 -2.304 0.56 20.72 H new ATOM 0 HD12AILE A 219 13.464 -19.946 -4.190 0.44 20.72 H new ATOM 0 HD12BILE A 219 12.980 -23.130 -2.623 0.56 20.72 H new ATOM 0 HD13AILE A 219 12.150 -19.528 -3.412 0.44 20.72 H new ATOM 0 HD13BILE A 219 14.058 -22.727 -3.710 0.56 20.72 H new ATOM 3941 N MET A 220 8.541 -22.247 -5.749 1.00 12.83 N ANISOU 3941 N MET A 220 1256 1810 1809 -28 -51 -50 N ATOM 3942 CA MET A 220 7.638 -22.616 -6.834 1.00 14.46 C ANISOU 3942 CA MET A 220 1362 2107 2027 -9 -4 -58 C ATOM 3943 C MET A 220 6.895 -21.395 -7.357 1.00 17.56 C ANISOU 3943 C MET A 220 1763 2519 2390 102 -14 -65 C ATOM 3944 O MET A 220 6.637 -21.288 -8.561 1.00 15.95 O ANISOU 3944 O MET A 220 1502 2356 2203 98 -27 -45 O ATOM 3945 CB MET A 220 6.654 -23.688 -6.362 1.00 12.17 C ANISOU 3945 CB MET A 220 989 1928 1707 -42 53 -59 C ATOM 3946 CG MET A 220 7.314 -25.028 -6.090 1.00 16.13 C ANISOU 3946 CG MET A 220 1502 2389 2237 -145 77 -43 C ATOM 3947 SD MET A 220 6.202 -26.203 -5.295 1.00 17.41 S ANISOU 3947 SD MET A 220 1596 2659 2359 -213 129 -27 S ATOM 3948 CE MET A 220 4.973 -26.451 -6.563 1.00 18.35 C ANISOU 3948 CE MET A 220 1627 2893 2454 -298 98 -5 C ATOM 0 H MET A 220 8.385 -22.631 -4.996 1.00 12.83 H new ATOM 0 HA MET A 220 8.165 -22.980 -7.562 1.00 14.46 H new ATOM 0 HB2 MET A 220 6.214 -23.381 -5.554 1.00 12.17 H new ATOM 0 HB3 MET A 220 5.964 -23.804 -7.034 1.00 12.17 H new ATOM 0 HG2 MET A 220 7.631 -25.404 -6.926 1.00 16.13 H new ATOM 0 HG3 MET A 220 8.092 -24.893 -5.527 1.00 16.13 H new ATOM 0 HE1 MET A 220 4.477 -27.264 -6.379 1.00 18.35 H new ATOM 0 HE2 MET A 220 4.363 -25.697 -6.575 1.00 18.35 H new ATOM 0 HE3 MET A 220 5.409 -26.527 -7.426 1.00 18.35 H new ATOM 3958 N GLN A 221 6.567 -20.450 -6.472 1.00 13.34 N ANISOU 3958 N GLN A 221 1334 1940 1794 215 2 -87 N ATOM 3959 CA GLN A 221 5.879 -19.244 -6.905 1.00 14.30 C ANISOU 3959 CA GLN A 221 1497 2051 1884 369 26 -74 C ATOM 3960 C GLN A 221 6.762 -18.394 -7.809 1.00 14.73 C ANISOU 3960 C GLN A 221 1636 1980 1979 333 -57 -65 C ATOM 3961 O GLN A 221 6.251 -17.729 -8.714 1.00 14.50 O ANISOU 3961 O GLN A 221 1575 1978 1958 421 -49 -29 O ATOM 3962 CB GLN A 221 5.423 -18.422 -5.699 1.00 16.38 C ANISOU 3962 CB GLN A 221 1944 2238 2040 532 99 -102 C ATOM 3963 CG GLN A 221 4.613 -17.184 -6.078 1.00 23.53 C ANISOU 3963 CG GLN A 221 2920 3116 2904 757 172 -65 C ATOM 3964 CD GLN A 221 3.307 -17.532 -6.775 1.00 34.03 C ANISOU 3964 CD GLN A 221 3962 4694 4275 858 248 52 C ATOM 3965 OE1 GLN A 221 2.469 -18.246 -6.224 1.00 40.52 O ANISOU 3965 OE1 GLN A 221 4627 5687 5080 893 330 112 O ATOM 3966 NE2 GLN A 221 3.134 -17.037 -7.996 1.00 32.89 N ANISOU 3966 NE2 GLN A 221 3734 4585 4178 882 204 112 N ATOM 0 H GLN A 221 6.733 -20.491 -5.629 1.00 13.34 H new ATOM 0 HA GLN A 221 5.100 -19.519 -7.414 1.00 14.30 H new ATOM 0 HB2 GLN A 221 4.888 -18.984 -5.117 1.00 16.38 H new ATOM 0 HB3 GLN A 221 6.202 -18.147 -5.191 1.00 16.38 H new ATOM 0 HG2 GLN A 221 4.422 -16.669 -5.278 1.00 23.53 H new ATOM 0 HG3 GLN A 221 5.145 -16.618 -6.659 1.00 23.53 H new ATOM 0 HE21 GLN A 221 3.742 -16.542 -8.349 1.00 32.89 H new ATOM 0 HE22 GLN A 221 2.414 -17.212 -8.433 1.00 32.89 H new ATOM 3975 N LEU A 222 8.078 -18.397 -7.580 1.00 13.60 N ANISOU 3975 N LEU A 222 1580 1722 1867 199 -141 -62 N ATOM 3976 CA LEU A 222 8.979 -17.668 -8.466 1.00 13.60 C ANISOU 3976 CA LEU A 222 1619 1630 1917 139 -218 -9 C ATOM 3977 C LEU A 222 9.020 -18.310 -9.847 1.00 12.79 C ANISOU 3977 C LEU A 222 1352 1631 1878 117 -187 35 C ATOM 3978 O LEU A 222 9.066 -17.607 -10.862 1.00 13.04 O ANISOU 3978 O LEU A 222 1389 1643 1923 147 -205 74 O ATOM 3979 CB LEU A 222 10.380 -17.608 -7.859 1.00 14.06 C ANISOU 3979 CB LEU A 222 1750 1592 2002 -24 -325 48 C ATOM 3980 CG LEU A 222 10.488 -16.881 -6.515 1.00 15.07 C ANISOU 3980 CG LEU A 222 2126 1578 2021 -60 -402 3 C ATOM 3981 CD1 LEU A 222 11.908 -16.956 -5.986 1.00 18.12 C ANISOU 3981 CD1 LEU A 222 2532 1917 2435 -282 -554 110 C ATOM 3982 CD2 LEU A 222 10.044 -15.445 -6.642 1.00 21.01 C ANISOU 3982 CD2 LEU A 222 3120 2169 2694 35 -415 -39 C ATOM 0 H LEU A 222 8.461 -18.808 -6.929 1.00 13.60 H new ATOM 0 HA LEU A 222 8.644 -16.763 -8.567 1.00 13.60 H new ATOM 0 HB2 LEU A 222 10.705 -18.515 -7.745 1.00 14.06 H new ATOM 0 HB3 LEU A 222 10.971 -17.172 -8.493 1.00 14.06 H new ATOM 0 HG LEU A 222 9.899 -17.322 -5.883 1.00 15.07 H new ATOM 0 HD11 LEU A 222 11.962 -16.492 -5.136 1.00 18.12 H new ATOM 0 HD12 LEU A 222 12.159 -17.885 -5.864 1.00 18.12 H new ATOM 0 HD13 LEU A 222 12.512 -16.539 -6.620 1.00 18.12 H new ATOM 0 HD21 LEU A 222 10.121 -15.005 -5.781 1.00 21.01 H new ATOM 0 HD22 LEU A 222 10.605 -14.989 -7.289 1.00 21.01 H new ATOM 0 HD23 LEU A 222 9.121 -15.417 -6.938 1.00 21.01 H new ATOM 3994 N LEU A 223 9.006 -19.647 -9.905 1.00 12.93 N ANISOU 3994 N LEU A 223 1265 1737 1910 63 -136 29 N ATOM 3995 CA LEU A 223 8.885 -20.330 -11.188 1.00 13.58 C ANISOU 3995 CA LEU A 223 1281 1885 1994 40 -96 46 C ATOM 3996 C LEU A 223 7.599 -19.921 -11.889 1.00 17.72 C ANISOU 3996 C LEU A 223 1762 2505 2466 100 -107 35 C ATOM 3997 O LEU A 223 7.598 -19.617 -13.088 1.00 14.15 O ANISOU 3997 O LEU A 223 1310 2069 1998 102 -124 69 O ATOM 3998 CB LEU A 223 8.922 -21.845 -10.985 1.00 15.33 C ANISOU 3998 CB LEU A 223 1479 2139 2207 -28 -35 27 C ATOM 3999 CG LEU A 223 10.239 -22.475 -10.524 1.00 13.78 C ANISOU 3999 CG LEU A 223 1291 1875 2068 -59 3 91 C ATOM 4000 CD1 LEU A 223 10.000 -23.883 -10.000 1.00 17.71 C ANISOU 4000 CD1 LEU A 223 1796 2386 2547 -98 69 63 C ATOM 4001 CD2 LEU A 223 11.250 -22.519 -11.663 1.00 11.65 C ANISOU 4001 CD2 LEU A 223 1031 1567 1828 -37 61 183 C ATOM 0 H LEU A 223 9.065 -20.166 -9.222 1.00 12.93 H new ATOM 0 HA LEU A 223 9.634 -20.073 -11.748 1.00 13.58 H new ATOM 0 HB2 LEU A 223 8.239 -22.075 -10.336 1.00 15.33 H new ATOM 0 HB3 LEU A 223 8.669 -22.264 -11.823 1.00 15.33 H new ATOM 0 HG LEU A 223 10.598 -21.925 -9.810 1.00 13.78 H new ATOM 0 HD11 LEU A 223 10.842 -24.269 -9.712 1.00 17.71 H new ATOM 0 HD12 LEU A 223 9.387 -23.849 -9.249 1.00 17.71 H new ATOM 0 HD13 LEU A 223 9.618 -24.430 -10.704 1.00 17.71 H new ATOM 0 HD21 LEU A 223 12.075 -22.921 -11.348 1.00 11.65 H new ATOM 0 HD22 LEU A 223 10.892 -23.047 -12.394 1.00 11.65 H new ATOM 0 HD23 LEU A 223 11.428 -21.617 -11.973 1.00 11.65 H new ATOM 4013 N ARG A 224 6.492 -19.893 -11.145 1.00 13.93 N ANISOU 4013 N ARG A 224 1228 2110 1955 157 -93 20 N ATOM 4014 CA ARG A 224 5.213 -19.491 -11.718 1.00 13.88 C ANISOU 4014 CA ARG A 224 1119 2243 1913 229 -102 76 C ATOM 4015 C ARG A 224 5.255 -18.042 -12.187 1.00 14.49 C ANISOU 4015 C ARG A 224 1256 2252 1996 365 -115 116 C ATOM 4016 O ARG A 224 4.756 -17.725 -13.271 1.00 16.73 O ANISOU 4016 O ARG A 224 1474 2621 2263 385 -148 184 O ATOM 4017 CB ARG A 224 4.108 -19.722 -10.682 1.00 14.72 C ANISOU 4017 CB ARG A 224 1125 2471 1997 299 -48 104 C ATOM 4018 CG ARG A 224 2.763 -19.034 -10.923 1.00 34.45 C ANISOU 4018 CG ARG A 224 3477 5136 4474 451 -22 228 C ATOM 4019 CD ARG A 224 1.842 -19.740 -11.924 1.00 66.39 C ANISOU 4019 CD ARG A 224 7326 9401 8497 312 -105 339 C ATOM 4020 NE ARG A 224 2.177 -21.142 -12.178 1.00 83.23 N ANISOU 4020 NE ARG A 224 9492 11526 10606 57 -169 276 N ATOM 4021 CZ ARG A 224 2.258 -21.699 -13.387 1.00 96.88 C ANISOU 4021 CZ ARG A 224 11265 13268 12278 -124 -267 275 C ATOM 4022 NH1 ARG A 224 2.568 -22.984 -13.500 1.00104.25 N ANISOU 4022 NH1 ARG A 224 12306 14141 13164 -326 -292 208 N ATOM 4023 NH2 ARG A 224 2.021 -20.989 -14.486 1.00 96.53 N ANISOU 4023 NH2 ARG A 224 11196 13279 12202 -97 -332 344 N ATOM 0 H ARG A 224 6.463 -20.102 -10.311 1.00 13.93 H new ATOM 0 HA ARG A 224 5.024 -20.031 -12.501 1.00 13.88 H new ATOM 0 HB2 ARG A 224 3.950 -20.677 -10.620 1.00 14.72 H new ATOM 0 HB3 ARG A 224 4.442 -19.434 -9.818 1.00 14.72 H new ATOM 0 HG2 ARG A 224 2.298 -18.958 -10.075 1.00 34.45 H new ATOM 0 HG3 ARG A 224 2.929 -18.132 -11.238 1.00 34.45 H new ATOM 0 HD2 ARG A 224 0.930 -19.692 -11.596 1.00 66.39 H new ATOM 0 HD3 ARG A 224 1.867 -19.257 -12.765 1.00 66.39 H new ATOM 0 HE ARG A 224 2.333 -21.644 -11.497 1.00 83.23 H new ATOM 0 HH11 ARG A 224 2.716 -23.454 -12.795 1.00104.25 H new ATOM 0 HH12 ARG A 224 2.621 -23.347 -14.278 1.00104.25 H new ATOM 0 HH21 ARG A 224 1.812 -20.157 -14.424 1.00 96.53 H new ATOM 0 HH22 ARG A 224 2.077 -21.362 -15.259 1.00 96.53 H new ATOM 4037 N ASP A 225 5.857 -17.148 -11.395 1.00 16.28 N ANISOU 4037 N ASP A 225 1640 2313 2233 440 -103 82 N ATOM 4038 CA ASP A 225 5.950 -15.750 -11.802 1.00 15.48 C ANISOU 4038 CA ASP A 225 1658 2095 2128 554 -117 119 C ATOM 4039 C ASP A 225 6.694 -15.615 -13.123 1.00 15.01 C ANISOU 4039 C ASP A 225 1582 2016 2104 460 -179 164 C ATOM 4040 O ASP A 225 6.299 -14.829 -13.992 1.00 15.79 O ANISOU 4040 O ASP A 225 1676 2130 2194 547 -189 231 O ATOM 4041 CB ASP A 225 6.668 -14.916 -10.740 1.00 17.71 C ANISOU 4041 CB ASP A 225 2190 2153 2386 569 -132 67 C ATOM 4042 CG ASP A 225 5.880 -14.775 -9.454 1.00 28.25 C ANISOU 4042 CG ASP A 225 3623 3469 3640 718 -40 24 C ATOM 4043 OD1 ASP A 225 4.641 -14.945 -9.461 1.00 22.87 O ANISOU 4043 OD1 ASP A 225 2797 2953 2940 879 60 78 O ATOM 4044 OD2 ASP A 225 6.524 -14.468 -8.432 1.00 24.71 O ANISOU 4044 OD2 ASP A 225 3404 2848 3136 667 -71 -40 O ATOM 0 H ASP A 225 6.211 -17.330 -10.633 1.00 16.28 H new ATOM 0 HA ASP A 225 5.044 -15.422 -11.909 1.00 15.48 H new ATOM 0 HB2 ASP A 225 7.526 -15.324 -10.543 1.00 17.71 H new ATOM 0 HB3 ASP A 225 6.849 -14.033 -11.099 1.00 17.71 H new ATOM 4049 N ASN A 226 7.794 -16.355 -13.279 1.00 16.32 N ANISOU 4049 N ASN A 226 1742 2152 2306 309 -200 151 N ATOM 4050 CA ASN A 226 8.567 -16.284 -14.514 1.00 13.85 C ANISOU 4050 CA ASN A 226 1421 1828 2014 250 -217 216 C ATOM 4051 C ASN A 226 7.770 -16.822 -15.693 1.00 15.21 C ANISOU 4051 C ASN A 226 1512 2146 2123 250 -207 231 C ATOM 4052 O ASN A 226 7.787 -16.233 -16.779 1.00 16.84 O ANISOU 4052 O ASN A 226 1732 2362 2306 275 -227 295 O ATOM 4053 CB ASN A 226 9.878 -17.048 -14.359 1.00 15.03 C ANISOU 4053 CB ASN A 226 1561 1938 2213 138 -196 242 C ATOM 4054 CG ASN A 226 10.896 -16.294 -13.530 1.00 18.85 C ANISOU 4054 CG ASN A 226 2116 2293 2755 75 -264 297 C ATOM 4055 OD1 ASN A 226 10.686 -15.133 -13.169 1.00 16.39 O ANISOU 4055 OD1 ASN A 226 1928 1872 2427 102 -328 289 O ATOM 4056 ND2 ASN A 226 12.013 -16.947 -13.234 1.00 13.39 N ANISOU 4056 ND2 ASN A 226 1363 1605 2120 -17 -255 373 N ATOM 0 H ASN A 226 8.104 -16.897 -12.688 1.00 16.32 H new ATOM 0 HA ASN A 226 8.767 -15.352 -14.693 1.00 13.85 H new ATOM 0 HB2 ASN A 226 9.701 -17.907 -13.945 1.00 15.03 H new ATOM 0 HB3 ASN A 226 10.250 -17.228 -15.237 1.00 15.03 H new ATOM 0 HD21 ASN A 226 12.627 -16.561 -12.772 1.00 13.39 H new ATOM 0 HD22 ASN A 226 12.122 -17.756 -13.504 1.00 13.39 H new ATOM 4063 N LEU A 227 7.069 -17.941 -15.506 1.00 15.49 N ANISOU 4063 N LEU A 227 1481 2292 2113 194 -194 184 N ATOM 4064 CA LEU A 227 6.250 -18.474 -16.589 1.00 15.99 C ANISOU 4064 CA LEU A 227 1502 2489 2083 131 -232 210 C ATOM 4065 C LEU A 227 5.173 -17.477 -16.998 1.00 16.48 C ANISOU 4065 C LEU A 227 1471 2664 2129 233 -287 304 C ATOM 4066 O LEU A 227 4.870 -17.332 -18.187 1.00 18.24 O ANISOU 4066 O LEU A 227 1687 2963 2280 199 -345 369 O ATOM 4067 CB LEU A 227 5.632 -19.802 -16.168 1.00 14.68 C ANISOU 4067 CB LEU A 227 1301 2407 1870 11 -238 164 C ATOM 4068 CG LEU A 227 6.611 -20.977 -16.153 1.00 14.05 C ANISOU 4068 CG LEU A 227 1351 2216 1772 -81 -168 95 C ATOM 4069 CD1 LEU A 227 6.010 -22.163 -15.410 1.00 19.25 C ANISOU 4069 CD1 LEU A 227 1991 2919 2405 -189 -171 51 C ATOM 4070 CD2 LEU A 227 6.995 -21.368 -17.566 1.00 16.98 C ANISOU 4070 CD2 LEU A 227 1873 2550 2031 -141 -154 101 C ATOM 0 H LEU A 227 7.054 -18.396 -14.776 1.00 15.49 H new ATOM 0 HA LEU A 227 6.817 -18.627 -17.361 1.00 15.99 H new ATOM 0 HB2 LEU A 227 5.250 -19.702 -15.282 1.00 14.68 H new ATOM 0 HB3 LEU A 227 4.901 -20.012 -16.770 1.00 14.68 H new ATOM 0 HG LEU A 227 7.415 -20.701 -15.686 1.00 14.05 H new ATOM 0 HD11 LEU A 227 6.642 -22.899 -15.409 1.00 19.25 H new ATOM 0 HD12 LEU A 227 5.813 -21.906 -14.496 1.00 19.25 H new ATOM 0 HD13 LEU A 227 5.192 -22.441 -15.851 1.00 19.25 H new ATOM 0 HD21 LEU A 227 7.615 -22.113 -17.538 1.00 16.98 H new ATOM 0 HD22 LEU A 227 6.200 -21.627 -18.058 1.00 16.98 H new ATOM 0 HD23 LEU A 227 7.416 -20.614 -18.008 1.00 16.98 H new ATOM 4082 N THR A 228 4.592 -16.769 -16.026 1.00 16.71 N ANISOU 4082 N THR A 228 1444 2699 2207 379 -257 328 N ATOM 4083 CA THR A 228 3.605 -15.744 -16.351 1.00 20.46 C ANISOU 4083 CA THR A 228 1831 3267 2674 544 -265 454 C ATOM 4084 C THR A 228 4.245 -14.602 -17.129 1.00 21.02 C ANISOU 4084 C THR A 228 2021 3205 2759 617 -277 492 C ATOM 4085 O THR A 228 3.630 -14.039 -18.044 1.00 19.16 O ANISOU 4085 O THR A 228 1717 3070 2493 684 -317 614 O ATOM 4086 CB THR A 228 2.951 -15.232 -15.067 1.00 19.64 C ANISOU 4086 CB THR A 228 1706 3156 2601 740 -171 473 C ATOM 4087 OG1 THR A 228 2.300 -16.321 -14.407 1.00 24.84 O ANISOU 4087 OG1 THR A 228 2222 3970 3248 662 -159 472 O ATOM 4088 CG2 THR A 228 1.930 -14.146 -15.373 1.00 23.45 C ANISOU 4088 CG2 THR A 228 2104 3727 3079 979 -132 641 C ATOM 0 H THR A 228 4.754 -16.866 -15.187 1.00 16.71 H new ATOM 0 HA THR A 228 2.920 -16.136 -16.916 1.00 20.46 H new ATOM 0 HB THR A 228 3.639 -14.855 -14.496 1.00 19.64 H new ATOM 0 HG1 THR A 228 2.876 -16.817 -14.049 1.00 24.84 H new ATOM 0 HG21 THR A 228 1.529 -13.837 -14.546 1.00 23.45 H new ATOM 0 HG22 THR A 228 2.370 -13.404 -15.816 1.00 23.45 H new ATOM 0 HG23 THR A 228 1.240 -14.505 -15.953 1.00 23.45 H new ATOM 4096 N ALEU A 229 5.480 -14.235 -16.776 0.40 17.04 N ANISOU 4096 N ALEU A 229 1683 2489 2303 589 -257 419 N ATOM 4097 N BLEU A 229 5.483 -14.251 -16.783 0.60 17.03 N ANISOU 4097 N BLEU A 229 1681 2489 2301 587 -258 419 N ATOM 4098 CA ALEU A 229 6.197 -13.221 -17.541 0.40 17.41 C ANISOU 4098 CA ALEU A 229 1839 2408 2367 611 -281 478 C ATOM 4099 CA BLEU A 229 6.203 -13.226 -17.527 0.60 17.40 C ANISOU 4099 CA BLEU A 229 1838 2406 2366 610 -280 476 C ATOM 4100 C ALEU A 229 6.485 -13.704 -18.957 0.40 24.75 C ANISOU 4100 C ALEU A 229 2726 3433 3243 503 -315 524 C ATOM 4101 C BLEU A 229 6.520 -13.694 -18.942 0.60 26.28 C ANISOU 4101 C BLEU A 229 2923 3622 3439 502 -314 523 C ATOM 4102 O ALEU A 229 6.341 -12.946 -19.923 0.40 20.81 O ANISOU 4102 O ALEU A 229 2238 2949 2718 557 -343 622 O ATOM 4103 O BLEU A 229 6.429 -12.914 -19.897 0.60 20.27 O ANISOU 4103 O BLEU A 229 2179 2867 2655 555 -341 620 O ATOM 4104 CB ALEU A 229 7.509 -12.857 -16.844 0.40 18.85 C ANISOU 4104 CB ALEU A 229 2176 2376 2610 537 -285 433 C ATOM 4105 CB BLEU A 229 7.488 -12.864 -16.785 0.60 18.74 C ANISOU 4105 CB BLEU A 229 2163 2361 2596 539 -283 429 C ATOM 4106 CG ALEU A 229 7.461 -12.015 -15.569 0.40 20.13 C ANISOU 4106 CG ALEU A 229 2512 2358 2780 621 -276 389 C ATOM 4107 CG BLEU A 229 8.341 -11.740 -17.369 0.60 26.12 C ANISOU 4107 CG BLEU A 229 3222 3140 3563 520 -323 515 C ATOM 4108 CD1ALEU A 229 8.828 -12.018 -14.894 0.40 19.62 C ANISOU 4108 CD1ALEU A 229 2564 2136 2756 445 -335 364 C ATOM 4109 CD1BLEU A 229 7.653 -10.404 -17.173 0.60 22.35 C ANISOU 4109 CD1BLEU A 229 2888 2535 3067 696 -317 554 C ATOM 4110 CD2ALEU A 229 7.027 -10.593 -15.876 0.40 19.29 C ANISOU 4110 CD2ALEU A 229 2550 2124 2655 786 -267 462 C ATOM 4111 CD2BLEU A 229 9.720 -11.741 -16.730 0.60 28.73 C ANISOU 4111 CD2BLEU A 229 3634 3331 3953 358 -365 517 C ATOM 0 H ALEU A 229 5.912 -14.558 -16.106 0.40 17.03 H new ATOM 0 H BLEU A 229 5.919 -14.593 -16.125 0.60 17.03 H new ATOM 0 HA ALEU A 229 5.633 -12.434 -17.593 0.40 17.40 H new ATOM 0 HA BLEU A 229 5.639 -12.440 -17.596 0.60 17.40 H new ATOM 0 HB2ALEU A 229 7.967 -13.685 -16.631 0.40 18.74 H new ATOM 0 HB2BLEU A 229 7.251 -12.620 -15.876 0.60 18.74 H new ATOM 0 HB3ALEU A 229 8.061 -12.384 -17.487 0.40 18.74 H new ATOM 0 HB3BLEU A 229 8.038 -13.661 -16.731 0.60 18.74 H new ATOM 0 HG ALEU A 229 6.809 -12.405 -14.966 0.40 26.12 H new ATOM 0 HG BLEU A 229 8.449 -11.888 -18.322 0.60 26.12 H new ATOM 0 HD11ALEU A 229 8.791 -11.482 -14.086 0.40 22.35 H new ATOM 0 HD11BLEU A 229 8.203 -9.698 -17.547 0.60 22.35 H new ATOM 0 HD12ALEU A 229 9.075 -12.928 -14.667 0.40 22.35 H new ATOM 0 HD12BLEU A 229 6.792 -10.414 -17.621 0.60 22.35 H new ATOM 0 HD13ALEU A 229 9.489 -11.645 -15.499 0.40 22.35 H new ATOM 0 HD13BLEU A 229 7.522 -10.243 -16.225 0.60 22.35 H new ATOM 0 HD21ALEU A 229 7.003 -10.077 -15.055 0.40 28.73 H new ATOM 0 HD21BLEU A 229 10.253 -11.024 -17.108 0.60 28.73 H new ATOM 0 HD22ALEU A 229 7.656 -10.189 -16.493 0.40 28.73 H new ATOM 0 HD22BLEU A 229 9.633 -11.609 -15.773 0.60 28.73 H new ATOM 0 HD23ALEU A 229 6.144 -10.603 -16.276 0.40 28.73 H new ATOM 0 HD23BLEU A 229 10.155 -12.591 -16.901 0.60 28.73 H new ATOM 4134 N TRP A 230 6.878 -14.968 -19.099 1.00 19.81 N ANISOU 4134 N TRP A 230 2088 2858 2581 365 -299 458 N ATOM 4135 CA TRP A 230 7.407 -15.486 -20.353 1.00 19.12 C ANISOU 4135 CA TRP A 230 2056 2799 2411 278 -289 482 C ATOM 4136 C TRP A 230 6.352 -16.034 -21.299 1.00 23.49 C ANISOU 4136 C TRP A 230 2582 3522 2821 209 -362 506 C ATOM 4137 O TRP A 230 6.676 -16.308 -22.458 1.00 22.70 O ANISOU 4137 O TRP A 230 2587 3432 2605 147 -359 529 O ATOM 4138 CB TRP A 230 8.411 -16.601 -20.055 1.00 17.69 C ANISOU 4138 CB TRP A 230 1934 2552 2236 195 -204 416 C ATOM 4139 CG TRP A 230 9.639 -16.141 -19.342 1.00 18.34 C ANISOU 4139 CG TRP A 230 2019 2505 2445 212 -161 453 C ATOM 4140 CD1 TRP A 230 10.134 -14.872 -19.291 1.00 18.05 C ANISOU 4140 CD1 TRP A 230 1996 2376 2484 245 -199 539 C ATOM 4141 CD2 TRP A 230 10.535 -16.957 -18.574 1.00 16.61 C ANISOU 4141 CD2 TRP A 230 1791 2237 2283 167 -95 435 C ATOM 4142 NE1 TRP A 230 11.292 -14.849 -18.546 1.00 16.13 N ANISOU 4142 NE1 TRP A 230 1746 2045 2336 184 -187 585 N ATOM 4143 CE2 TRP A 230 11.557 -16.115 -18.092 1.00 19.11 C ANISOU 4143 CE2 TRP A 230 2088 2463 2711 151 -119 534 C ATOM 4144 CE3 TRP A 230 10.570 -18.318 -18.249 1.00 15.77 C ANISOU 4144 CE3 TRP A 230 1700 2151 2142 130 -25 367 C ATOM 4145 CZ2 TRP A 230 12.608 -16.590 -17.301 1.00 15.48 C ANISOU 4145 CZ2 TRP A 230 1578 1972 2333 96 -89 591 C ATOM 4146 CZ3 TRP A 230 11.616 -18.790 -17.465 1.00 16.39 C ANISOU 4146 CZ3 TRP A 230 1744 2177 2307 119 37 410 C ATOM 4147 CH2 TRP A 230 12.621 -17.928 -17.003 1.00 19.49 C ANISOU 4147 CH2 TRP A 230 2072 2520 2814 101 -1 534 C ATOM 0 H ATRP A 230 6.844 -15.550 -18.467 0.40 19.81 H new ATOM 0 H BTRP A 230 6.819 -15.557 -18.475 0.60 19.81 H new ATOM 0 HA TRP A 230 7.820 -14.730 -20.799 1.00 19.12 H new ATOM 0 HB2 TRP A 230 7.974 -17.282 -19.520 1.00 17.69 H new ATOM 0 HB3 TRP A 230 8.671 -17.020 -20.890 1.00 17.69 H new ATOM 0 HD1 TRP A 230 9.747 -14.131 -19.699 1.00 18.05 H new ATOM 0 HE1 TRP A 230 11.772 -14.152 -18.391 1.00 16.13 H new ATOM 0 HE3 TRP A 230 9.906 -18.895 -18.552 1.00 15.77 H new ATOM 0 HZ2 TRP A 230 13.273 -16.020 -16.989 1.00 15.48 H new ATOM 0 HZ3 TRP A 230 11.650 -19.692 -17.243 1.00 16.39 H new ATOM 0 HH2 TRP A 230 13.311 -18.272 -16.483 1.00 19.49 H new ATOM 4158 N THR A 231 5.120 -16.227 -20.840 1.00 23.66 N ANISOU 4158 N THR A 231 2473 3684 2832 203 -429 523 N ATOM 4159 CA THR A 231 4.078 -16.814 -21.675 1.00 28.11 C ANISOU 4159 CA THR A 231 2987 4438 3254 71 -548 585 C ATOM 4160 C THR A 231 2.817 -15.952 -21.670 1.00 49.24 C ANISOU 4160 C THR A 231 5449 7299 5959 182 -625 755 C ATOM 4161 O THR A 231 1.890 -16.186 -22.445 1.00 55.62 O ANISOU 4161 O THR A 231 6164 8310 6658 71 -760 877 O ATOM 4162 CB THR A 231 3.728 -18.239 -21.204 1.00 31.44 C ANISOU 4162 CB THR A 231 3423 4905 3617 -111 -574 500 C ATOM 4163 OG1 THR A 231 3.128 -18.190 -19.903 1.00 25.59 O ANISOU 4163 OG1 THR A 231 2507 4223 2992 -35 -549 512 O ATOM 4164 CG2 THR A 231 4.981 -19.101 -21.140 1.00 26.53 C ANISOU 4164 CG2 THR A 231 3017 4090 2975 -163 -458 360 C ATOM 4165 OXT THR A 231 2.693 -15.000 -20.896 1.00 55.37 O ANISOU 4165 OXT THR A 231 6156 8027 6856 392 -551 795 O ATOM 0 H THR A 231 4.866 -16.024 -20.044 1.00 23.66 H new ATOM 0 HA THR A 231 4.425 -16.857 -22.580 1.00 28.11 H new ATOM 0 HB THR A 231 3.105 -18.626 -21.839 1.00 31.44 H new ATOM 0 HG1 THR A 231 3.726 -18.087 -19.322 1.00 25.59 H new ATOM 0 HG21 THR A 231 4.745 -19.994 -20.842 1.00 26.53 H new ATOM 0 HG22 THR A 231 5.385 -19.150 -22.020 1.00 26.53 H new ATOM 0 HG23 THR A 231 5.612 -18.709 -20.516 1.00 26.53 H new TER 4173 THR A 231 ATOM 4174 N ALA P 125 13.243 -11.351 -15.038 1.00 38.39 N ANISOU 4174 N ALA P 125 4601 5004 4983 219 -558 139 N ATOM 4175 CA ALA P 125 12.901 -12.626 -14.411 1.00 25.42 C ANISOU 4175 CA ALA P 125 2759 3517 3382 132 -454 8 C ATOM 4176 C ALA P 125 13.409 -12.688 -12.972 1.00 21.40 C ANISOU 4176 C ALA P 125 2255 2908 2967 172 -276 -96 C ATOM 4177 O ALA P 125 14.413 -12.061 -12.624 1.00 21.72 O ANISOU 4177 O ALA P 125 2482 2773 2998 162 -219 -100 O ATOM 4178 CB ALA P 125 13.472 -13.788 -15.214 1.00 28.28 C ANISOU 4178 CB ALA P 125 3175 3954 3615 -127 -428 -52 C ATOM 0 HA ALA P 125 11.934 -12.697 -14.397 1.00 25.42 H new ATOM 0 HB1 ALA P 125 13.236 -14.625 -14.785 1.00 28.28 H new ATOM 0 HB2 ALA P 125 13.106 -13.772 -16.112 1.00 28.28 H new ATOM 0 HB3 ALA P 125 14.438 -13.708 -15.257 1.00 28.28 H new ATOM 4184 N HIS P 126 12.701 -13.450 -12.143 1.00 17.85 N ANISOU 4184 N HIS P 126 1596 2600 2585 177 -202 -160 N ATOM 4185 CA HIS P 126 13.106 -13.677 -10.765 1.00 16.72 C ANISOU 4185 CA HIS P 126 1446 2423 2484 175 -43 -239 C ATOM 4186 C HIS P 126 14.127 -14.798 -10.705 1.00 16.04 C ANISOU 4186 C HIS P 126 1420 2304 2371 -39 31 -260 C ATOM 4187 O HIS P 126 13.928 -15.854 -11.296 1.00 14.95 O ANISOU 4187 O HIS P 126 1226 2229 2225 -175 10 -267 O ATOM 4188 CB HIS P 126 11.905 -14.047 -9.889 1.00 25.65 C ANISOU 4188 CB HIS P 126 2316 3757 3673 250 21 -266 C ATOM 4189 CG HIS P 126 10.773 -13.071 -9.958 1.00 58.27 C ANISOU 4189 CG HIS P 126 6309 7967 7862 521 -30 -242 C ATOM 4190 ND1 HIS P 126 10.126 -12.760 -11.135 1.00 71.75 N ANISOU 4190 ND1 HIS P 126 7942 9738 9582 589 -208 -138 N ATOM 4191 CD2 HIS P 126 10.157 -12.353 -8.989 1.00 68.90 C ANISOU 4191 CD2 HIS P 126 7567 9354 9257 765 79 -307 C ATOM 4192 CE1 HIS P 126 9.169 -11.884 -10.891 1.00 76.62 C ANISOU 4192 CE1 HIS P 126 8407 10418 10288 894 -218 -112 C ATOM 4193 NE2 HIS P 126 9.165 -11.621 -9.596 1.00 73.63 N ANISOU 4193 NE2 HIS P 126 8023 10017 9936 1019 -26 -234 N ATOM 0 H HIS P 126 11.973 -13.849 -12.366 1.00 17.85 H new ATOM 0 HA HIS P 126 13.495 -12.854 -10.429 1.00 16.72 H new ATOM 0 HB2 HIS P 126 11.581 -14.922 -10.154 1.00 25.65 H new ATOM 0 HB3 HIS P 126 12.200 -14.121 -8.968 1.00 25.65 H new ATOM 0 HD2 HIS P 126 10.366 -12.355 -8.083 1.00 68.90 H new ATOM 0 HE1 HIS P 126 8.595 -11.515 -11.523 1.00 76.62 H new ATOM 0 HE2 HIS P 126 8.629 -11.080 -9.198 1.00 73.63 H new HETATM 4201 N SEP P 127 15.217 -14.576 -9.989 1.00 13.89 N ANISOU 4201 N SEP P 127 1264 1925 2087 -67 110 -271 N HETATM 4202 CA SEP P 127 16.140 -15.664 -9.706 1.00 14.10 C ANISOU 4202 CA SEP P 127 1293 1939 2127 -208 187 -261 C HETATM 4203 CB SEP P 127 17.568 -15.289 -10.097 1.00 13.09 C ANISOU 4203 CB SEP P 127 1300 1715 1959 -262 200 -226 C HETATM 4204 OG SEP P 127 17.944 -14.123 -9.406 1.00 12.39 O ANISOU 4204 OG SEP P 127 1305 1566 1837 -233 183 -219 O HETATM 4205 C SEP P 127 16.023 -15.980 -8.217 1.00 16.03 C ANISOU 4205 C SEP P 127 1455 2246 2389 -215 266 -258 C HETATM 4206 O SEP P 127 15.283 -15.305 -7.490 1.00 14.48 O ANISOU 4206 O SEP P 127 1217 2116 2170 -116 287 -299 O HETATM 4207 P SEP P 127 19.405 -13.601 -9.812 1.00 13.27 P ANISOU 4207 P SEP P 127 1528 1618 1898 -347 177 -151 P HETATM 4208 O1P SEP P 127 19.387 -13.236 -11.367 1.00 13.35 O ANISOU 4208 O1P SEP P 127 1621 1602 1849 -361 127 -113 O HETATM 4209 O2P SEP P 127 20.517 -14.733 -9.536 1.00 11.78 O ANISOU 4209 O2P SEP P 127 1220 1509 1745 -430 261 -98 O HETATM 4210 O3P SEP P 127 19.648 -12.292 -8.940 1.00 13.19 O ANISOU 4210 O3P SEP P 127 1663 1503 1844 -366 131 -167 O HETATM 0 HB3 SEP P 127 18.175 -16.015 -9.883 1.00 13.09 H new HETATM 0 HB2 SEP P 127 17.626 -15.144 -11.054 1.00 13.09 H new HETATM 0 HA SEP P 127 15.917 -16.449 -10.230 1.00 14.10 H new ATOM 4214 N SER P 128 16.750 -16.989 -7.755 1.00 12.36 N ANISOU 4214 N SER P 128 971 1769 1955 -316 317 -204 N ATOM 4215 CA SER P 128 16.527 -17.493 -6.411 1.00 15.92 C ANISOU 4215 CA SER P 128 1340 2312 2397 -363 373 -155 C ATOM 4216 C SER P 128 16.934 -16.429 -5.394 1.00 18.10 C ANISOU 4216 C SER P 128 1686 2624 2566 -331 388 -181 C ATOM 4217 O SER P 128 17.845 -15.641 -5.642 1.00 17.51 O ANISOU 4217 O SER P 128 1732 2461 2459 -334 346 -192 O ATOM 4218 CB SER P 128 17.301 -18.786 -6.168 1.00 16.79 C ANISOU 4218 CB SER P 128 1437 2362 2581 -457 397 -46 C ATOM 4219 OG SER P 128 18.686 -18.535 -6.033 1.00 18.40 O ANISOU 4219 OG SER P 128 1693 2520 2776 -450 389 13 O ATOM 0 H SER P 128 17.369 -17.390 -8.198 1.00 12.36 H new ATOM 0 HA SER P 128 15.583 -17.693 -6.309 1.00 15.92 H new ATOM 0 HB2 SER P 128 16.969 -19.219 -5.366 1.00 16.79 H new ATOM 0 HB3 SER P 128 17.151 -19.399 -6.905 1.00 16.79 H new ATOM 0 HG SER P 128 18.887 -18.505 -5.218 1.00 18.40 H new HETATM 4225 C02AEOE P 134 17.970 -13.791 -1.560 0.49 23.64 C HETATM 4226 C02BEOE P 134 18.642 -17.448 -2.571 0.51 26.13 C HETATM 4227 C03AEOE P 134 17.911 -14.953 -2.534 0.49 20.81 C HETATM 4228 C03BEOE P 134 18.355 -15.975 -2.813 0.51 9.50 C HETATM 4229 C04AEOE P 134 16.559 -15.012 -3.278 0.49 12.44 C HETATM 4230 C04BEOE P 134 16.885 -15.734 -3.205 0.51 16.15 C HETATM 4231 C05AEOE P 134 15.352 -15.039 -2.314 0.49 13.23 C HETATM 4232 C05BEOE P 134 15.951 -15.778 -1.986 0.51 16.58 C HETATM 4233 C06AEOE P 134 14.554 -16.302 -2.639 0.49 14.69 C HETATM 4234 C06BEOE P 134 15.247 -17.126 -2.045 0.51 14.75 C HETATM 4235 C07AEOE P 134 15.059 -16.744 -4.004 0.49 18.48 C HETATM 4236 C07BEOE P 134 15.237 -17.506 -3.532 0.51 16.40 C HETATM 4237 N08AEOE P 134 16.460 -16.279 -4.054 0.49 17.85 N HETATM 4238 N08BEOE P 134 16.419 -16.836 -4.124 0.51 17.19 N HETATM 4239 O01AEOE P 134 18.507 -12.743 -1.845 0.49 28.30 O HETATM 4240 O01BEOE P 134 18.997 -18.189 -3.464 0.51 20.25 O TER 4241 EOE P 134 HETATM 4242 CA CA A 301 7.180 -22.400 -28.832 0.84 16.64 CA2+ HETATM 4243 CA CA A 302 41.382 -21.000 15.419 0.49 15.96 CA2+ HETATM 4244 CL CL A 303 35.279 6.300 -13.471 1.00 17.37 CL1- HETATM 4245 O HOH A 401 38.202 -29.044 4.315 1.00 37.77 O HETATM 4246 O HOH A 402 10.266 -26.579 11.247 1.00 34.43 O HETATM 4247 O HOH A 403 12.436 -19.704 -14.105 1.00 24.30 O HETATM 4248 O HOH A 404 37.758 2.893 -18.678 1.00 36.82 O HETATM 4249 O HOH A 405 36.841 0.872 -8.988 1.00 41.87 O HETATM 4250 O HOH A 406 34.345 -11.606 -22.943 1.00 33.11 O HETATM 4251 O HOH A 407 38.312 -24.044 13.518 1.00 38.16 O HETATM 4252 O HOH A 408 1.611 -13.746 -19.357 1.00 28.06 O HETATM 4253 O HOH A 409 18.826 -37.484 -0.893 1.00 10.03 O HETATM 4254 O HOH A 410 31.975 14.962 -20.690 1.00 24.81 O HETATM 4255 O HOH A 411 26.074 18.197 -31.451 1.00 47.94 O HETATM 4256 O HOH A 412 33.223 -17.005 19.494 1.00 44.32 O HETATM 4257 O HOH A 413 35.014 -4.206 -19.459 1.00 20.60 O HETATM 4258 O HOH A 414 30.142 -18.089 18.060 1.00 30.12 O HETATM 4259 O HOH A 415 41.729 -14.993 5.159 1.00 21.05 O HETATM 4260 O HOH A 416 36.052 -26.879 2.110 1.00 19.63 O HETATM 4261 O HOH A 417 12.299 -31.446 -11.290 1.00 15.79 O HETATM 4262 O HOH A 418 23.376 -12.130 15.347 1.00 31.06 O HETATM 4263 O HOH A 419 17.923 -3.765 -11.424 1.00 35.63 O HETATM 4264 O HOH A 420 20.126 -1.144 3.236 1.00 59.14 O HETATM 4265 O HOH A 421 30.113 3.847 -24.847 1.00 36.63 O HETATM 4266 O HOH A 422 3.005 -22.161 -21.813 1.00 40.11 O HETATM 4267 O HOH A 423 11.236 -20.459 3.151 1.00 37.33 O HETATM 4268 O HOH A 424 36.281 -29.372 7.335 1.00 21.41 O HETATM 4269 O HOH A 425 33.934 -0.784 -22.772 1.00 38.73 O HETATM 4270 O HOH A 426 5.062 -30.886 -16.830 1.00 29.60 O HETATM 4271 O HOH A 427 27.078 -34.250 -14.851 1.00 43.45 O HETATM 4272 O HOH A 428 35.561 -5.001 -17.521 1.00 27.44 O HETATM 4273 O HOH A 429 19.644 -15.054 5.598 1.00 32.93 O HETATM 4274 O HOH A 430 19.899 -29.437 -19.546 1.00 39.00 O HETATM 4275 O HOH A 431 36.197 -22.903 7.072 1.00 9.82 O HETATM 4276 O HOH A 432 33.998 -22.759 -20.699 1.00 31.84 O HETATM 4277 O HOH A 433 40.226 -26.539 2.372 1.00 29.27 O HETATM 4278 O HOH A 434 25.924 -20.776 11.974 1.00 37.24 O HETATM 4279 O HOH A 435 38.616 7.134 -21.497 1.00 18.96 O HETATM 4280 O HOH A 436 20.373 -1.803 -18.801 1.00 27.47 O HETATM 4281 O HOH A 437 28.730 -21.832 12.660 1.00 16.37 O HETATM 4282 O HOH A 438 29.598 -29.179 5.766 1.00 26.09 O HETATM 4283 O HOH A 439 27.069 -38.120 1.364 1.00 29.36 O HETATM 4284 O HOH A 440 17.277 -30.160 -21.715 1.00 13.65 O HETATM 4285 O HOH A 441 18.412 -34.888 -0.415 1.00 31.53 O HETATM 4286 O HOH A 442 20.800 -15.432 8.633 1.00 38.40 O HETATM 4287 O HOH A 443 26.133 -9.031 -14.013 1.00 11.76 O HETATM 4288 O HOH A 444 34.673 15.160 -21.366 1.00 24.98 O HETATM 4289 O HOH A 445 23.185 -7.827 -19.762 1.00 21.73 O HETATM 4290 O HOH A 446 9.078 -24.709 -24.169 1.00 21.48 O HETATM 4291 O HOH A 447 39.990 -30.186 10.546 1.00 50.11 O HETATM 4292 O HOH A 448 31.019 -20.490 -31.735 1.00 21.97 O HETATM 4293 O HOH A 449 30.039 -4.768 -20.986 1.00 15.29 O HETATM 4294 O HOH A 450 31.840 -26.792 -13.465 1.00 32.14 O HETATM 4295 O HOH A 451 37.766 -7.239 -15.128 1.00 44.42 O HETATM 4296 O HOH A 452 24.051 12.104 -24.523 1.00 47.62 O HETATM 4297 O HOH A 453 27.248 -22.790 -24.050 1.00 19.40 O HETATM 4298 O HOH A 454 20.873 -37.066 -13.101 1.00 23.46 O HETATM 4299 O HOH A 455 5.933 -20.017 1.111 1.00 40.53 O HETATM 4300 O HOH A 456 8.724 -15.310 -23.825 1.00 30.71 O HETATM 4301 O HOH A 457 31.626 -1.835 3.939 1.00 29.14 O HETATM 4302 O HOH A 458 11.163 -30.309 -19.608 1.00 25.00 O HETATM 4303 O HOH A 459 26.913 -3.673 -4.040 1.00 18.18 O HETATM 4304 O HOH A 460 23.443 -16.268 -26.134 1.00 29.98 O HETATM 4305 O HOH A 461 12.248 -21.227 0.385 1.00 25.63 O HETATM 4306 O HOH A 462 19.049 -1.245 -12.316 1.00 21.32 O HETATM 4307 O HOH A 463 41.575 -23.202 10.114 1.00 19.93 O HETATM 4308 O HOH A 464 28.790 -20.703 -25.293 1.00 14.91 O HETATM 4309 O HOH A 465 31.644 -27.095 2.476 1.00 13.31 O HETATM 4310 O HOH A 466 42.283 -20.337 17.718 1.00 14.05 O HETATM 4311 O HOH A 467 24.396 -34.145 -18.332 1.00 39.21 O HETATM 4312 O HOH A 468 3.297 -13.449 -7.683 1.00 49.30 O HETATM 4313 O HOH A 469 12.047 -22.559 6.841 1.00 42.75 O HETATM 4314 O HOH A 470 13.667 -29.803 -13.091 1.00 13.31 O HETATM 4315 O HOH A 471 25.443 -15.986 -3.945 1.00 17.13 O HETATM 4316 O HOH A 472 22.979 -0.357 -6.849 1.00 31.84 O HETATM 4317 O HOH A 473 21.990 -17.482 9.916 1.00 32.56 O HETATM 4318 O HOH A 474 23.866 -13.558 -23.825 1.00 24.82 O HETATM 4319 O HOH A 475 22.820 -2.200 2.581 1.00 35.90 O HETATM 4320 O HOH A 476 33.547 -1.697 5.727 1.00 38.52 O HETATM 4321 O HOH A 477 35.678 -5.966 -6.966 1.00 17.17 O HETATM 4322 O HOH A 478 1.577 -33.222 -3.767 1.00 12.38 O HETATM 4323 O HOH A 479 7.342 -35.526 -8.424 1.00 22.32 O HETATM 4324 O HOH A 480 34.276 7.177 -7.299 1.00 31.78 O HETATM 4325 O HOH A 481 17.901 -23.146 -27.573 1.00 25.02 O HETATM 4326 O HOH A 482 36.082 -21.253 -12.041 1.00 25.08 O HETATM 4327 O HOH A 483 39.486 -22.069 0.975 1.00 39.47 O HETATM 4328 O HOH A 484 26.567 -12.116 18.230 1.00 27.12 O HETATM 4329 O HOH A 485 20.407 -6.729 -8.998 1.00 33.67 O HETATM 4330 O HOH A 486 26.152 -23.945 11.400 1.00 21.27 O HETATM 4331 O HOH A 487 38.762 -15.724 -4.035 1.00 15.65 O HETATM 4332 O HOH A 488 7.735 -16.455 -3.868 1.00 23.03 O HETATM 4333 O HOH A 489 24.257 -18.118 -5.660 1.00 19.43 O HETATM 4334 O HOH A 490 25.766 -32.325 4.744 1.00 19.09 O HETATM 4335 O HOH A 491 5.015 -12.516 -13.357 1.00 20.93 O HETATM 4336 O HOH A 492 30.026 -18.464 15.480 1.00 16.96 O HETATM 4337 O HOH A 493 41.010 -20.119 -6.961 1.00 33.12 O HETATM 4338 O HOH A 494 36.944 3.149 -16.078 1.00 18.77 O HETATM 4339 O HOH A 495 30.870 7.681 -22.766 1.00 18.67 O HETATM 4340 O HOH A 496 36.871 -23.887 3.234 1.00 13.68 O HETATM 4341 O HOH A 497 26.776 -0.868 -21.860 1.00 23.67 O HETATM 4342 O HOH A 498 18.875 -2.946 9.360 1.00 60.12 O HETATM 4343 O HOH A 499 21.107 16.492 -29.574 1.00 38.81 O HETATM 4344 O HOH A 500 37.871 -11.149 3.671 1.00 15.61 O HETATM 4345 O HOH A 501 28.677 6.924 -23.917 1.00 31.84 O HETATM 4346 O HOH A 502 19.032 -14.826 -23.952 1.00 23.59 O HETATM 4347 O HOH A 503 40.879 -16.609 7.014 1.00 12.53 O HETATM 4348 O HOH A 504 18.487 -7.837 0.840 1.00 40.21 O HETATM 4349 O HOH A 505 33.194 -27.108 9.514 1.00 26.01 O HETATM 4350 O HOH A 506 41.453 -10.190 11.300 1.00 32.48 O HETATM 4351 O HOH A 507 10.280 -34.814 -16.737 1.00 18.20 O HETATM 4352 O HOH A 508 30.819 -18.038 -34.282 1.00 37.21 O HETATM 4353 O HOH A 509 6.707 -14.651 -5.692 1.00 33.28 O HETATM 4354 O HOH A 510 23.859 -24.249 12.163 1.00 64.28 O HETATM 4355 O HOH A 511 20.601 -13.480 -15.716 1.00 12.94 O HETATM 4356 O HOH A 512 21.806 -12.401 10.775 1.00 20.98 O HETATM 4357 O HOH A 513 11.035 -30.140 -9.284 1.00 16.98 O HETATM 4358 O HOH A 514 6.198 -37.651 4.845 1.00 34.80 O HETATM 4359 O HOH A 515 36.456 -16.021 -29.521 1.00 39.61 O HETATM 4360 O HOH A 516 34.878 -10.086 -0.542 1.00 20.42 O HETATM 4361 O HOH A 517 20.794 -20.334 -28.390 1.00 48.90 O HETATM 4362 O HOH A 518 23.732 -28.336 -20.605 1.00 14.43 O HETATM 4363 O HOH A 519 43.600 -18.016 9.354 1.00 19.73 O HETATM 4364 O HOH A 520 34.150 -4.554 4.179 1.00 34.31 O HETATM 4365 O HOH A 521 38.602 -20.227 19.924 1.00 26.18 O HETATM 4366 O HOH A 522 33.385 -7.711 0.648 1.00 14.72 O HETATM 4367 O HOH A 523 24.752 -11.679 -21.752 1.00 33.53 O HETATM 4368 O HOH A 524 21.156 -0.926 8.661 1.00 23.75 O HETATM 4369 O HOH A 525 19.668 -10.812 4.399 1.00 31.22 O HETATM 4370 O HOH A 526 18.091 -27.461 -19.270 1.00 19.48 O HETATM 4371 O HOH A 527 33.671 -27.852 0.972 1.00 14.31 O HETATM 4372 O HOH A 528 21.047 -5.423 -0.795 1.00 31.29 O HETATM 4373 O HOH A 529 21.154 14.256 -26.526 1.00 42.87 O HETATM 4374 O HOH A 530 30.648 -36.555 1.994 1.00 27.35 O HETATM 4375 O HOH A 531 17.839 -19.349 -30.195 1.00 55.28 O HETATM 4376 O HOH A 532 32.013 -24.585 -15.337 1.00 20.79 O HETATM 4377 O HOH A 533 2.103 -37.418 -6.725 1.00 14.86 O HETATM 4378 O HOH A 534 7.952 -20.395 -29.857 1.00 27.61 O HETATM 4379 O HOH A 535 15.094 -14.960 -24.689 1.00 33.67 O HETATM 4380 O HOH A 536 35.920 -34.091 1.957 1.00 27.07 O HETATM 4381 O HOH A 537 33.472 -27.549 -11.141 1.00 34.62 O HETATM 4382 O HOH A 538 21.444 -16.383 -2.380 1.00 21.99 O HETATM 4383 O HOH A 539 40.548 -26.761 -8.212 1.00 36.34 O HETATM 4384 O HOH A 540 40.332 -16.861 -1.694 1.00 26.98 O HETATM 4385 O HOH A 541 27.900 -30.252 -19.379 1.00 32.49 O HETATM 4386 O HOH A 542 3.522 -30.340 9.385 1.00 31.54 O HETATM 4387 O HOH A 543 35.513 -17.022 18.728 1.00 21.57 O HETATM 4388 O HOH A 544 35.555 -24.418 -9.467 1.00 20.36 O HETATM 4389 O HOH A 545 38.438 -16.805 -9.963 1.00 35.51 O HETATM 4390 O HOH A 546 11.153 -28.636 1.335 1.00 23.59 O HETATM 4391 O HOH A 547 23.134 -26.342 1.279 1.00 20.05 O HETATM 4392 O HOH A 548 37.773 -31.372 3.725 1.00 39.31 O HETATM 4393 O HOH A 549 15.747 -30.409 -11.016 1.00 19.96 O HETATM 4394 O HOH A 550 25.981 -12.855 15.685 1.00 15.69 O HETATM 4395 O HOH A 551 17.447 -28.562 -10.269 1.00 35.96 O HETATM 4396 O HOH A 552 27.233 -17.688 15.246 1.00 14.96 O HETATM 4397 O HOH A 553 26.706 -29.578 5.399 1.00 16.90 O HETATM 4398 O HOH A 554 22.198 -3.255 -21.041 1.00 46.08 O HETATM 4399 O HOH A 555 37.983 -7.200 -12.234 1.00 22.58 O HETATM 4400 O HOH A 556 23.688 -21.946 -4.114 1.00 20.50 O HETATM 4401 O HOH A 557 20.930 -36.751 -0.719 1.00 36.91 O HETATM 4402 O HOH A 558 18.155 -41.550 -8.090 1.00 43.84 O HETATM 4403 O HOH A 559 40.918 -12.332 4.807 1.00 25.45 O HETATM 4404 O HOH A 560 2.661 -33.120 -11.530 1.00 34.52 O HETATM 4405 O HOH A 561 36.162 -33.620 -5.590 1.00 46.99 O HETATM 4406 O HOH A 562 22.034 -26.385 -21.717 1.00 21.29 O HETATM 4407 O HOH A 563 17.169 -22.024 -3.447 1.00 34.80 O HETATM 4408 O HOH A 564 18.464 5.393 -18.973 1.00 36.68 O HETATM 4409 O HOH A 565 22.891 -7.258 -15.014 1.00 20.86 O HETATM 4410 O HOH A 566 18.064 -5.763 11.906 1.00 41.12 O HETATM 4411 O HOH A 567 34.915 -21.880 -9.590 1.00 20.66 O HETATM 4412 O HOH A 568 39.491 -22.440 11.733 1.00 18.38 O HETATM 4413 O HOH A 569 36.818 -0.765 -10.835 1.00 27.49 O HETATM 4414 O HOH A 570 37.255 -26.761 -5.425 1.00 16.53 O HETATM 4415 O HOH A 571 12.038 -31.417 0.111 1.00 16.20 O HETATM 4416 O HOH A 572 20.231 -23.231 -23.733 1.00 15.73 O HETATM 4417 O HOH A 573 40.174 -12.267 2.770 1.00 33.10 O HETATM 4418 O HOH A 574 17.886 -7.662 -14.460 1.00 40.26 O HETATM 4419 O HOH A 575 40.860 -19.447 -2.204 1.00 25.47 O HETATM 4420 O HOH A 576 28.397 -30.272 -17.045 1.00 27.57 O HETATM 4421 O HOH A 577 1.979 -15.445 -11.671 1.00 40.63 O HETATM 4422 O HOH A 578 22.328 -10.581 -7.081 1.00 16.96 O HETATM 4423 O HOH A 579 2.198 -38.633 1.820 1.00 43.97 O HETATM 4424 O HOH A 580 21.262 -24.775 1.653 1.00 29.47 O HETATM 4425 O HOH A 581 19.979 -9.898 17.559 1.00 43.99 O HETATM 4426 O HOH A 582 32.545 -10.666 -17.835 1.00 12.54 O HETATM 4427 O HOH A 583 35.595 -31.489 -7.616 1.00 30.05 O HETATM 4428 O HOH A 584 9.120 -32.313 5.439 1.00 21.68 O HETATM 4429 O HOH A 585 26.546 -7.673 -22.265 1.00 38.62 O HETATM 4430 O HOH A 586 32.998 -7.317 -21.034 1.00 40.78 O HETATM 4431 O HOH A 587 32.159 -4.275 -22.690 1.00 37.41 O HETATM 4432 O HOH A 588 29.611 10.480 -21.212 1.00 24.91 O HETATM 4433 O HOH A 589 6.374 -28.192 10.000 1.00 20.65 O HETATM 4434 O HOH A 590 11.882 -25.863 7.338 1.00 33.81 O HETATM 4435 O HOH A 591 36.707 -20.515 15.880 1.00 14.33 O HETATM 4436 O HOH A 592 14.661 -31.933 0.484 1.00 34.09 O HETATM 4437 O HOH A 593 26.920 1.412 5.693 1.00 17.91 O HETATM 4438 O HOH A 594 22.590 -19.935 -3.716 1.00 24.40 O HETATM 4439 O HOH A 595 12.912 -12.385 -18.399 1.00 28.92 O HETATM 4440 O HOH A 596 3.214 -13.207 -11.377 1.00 47.74 O HETATM 4441 O HOH A 597 22.260 -18.752 7.355 1.00 21.09 O HETATM 4442 O HOH A 598 30.522 -29.487 2.927 1.00 23.27 O HETATM 4443 O HOH A 599 46.030 -17.315 9.824 1.00 47.96 O HETATM 4444 O HOH A 600 5.900 -17.656 -24.986 1.00 45.25 O HETATM 4445 O HOH A 601 39.044 -10.584 -7.681 1.00 25.41 O HETATM 4446 O HOH A 602 37.954 -24.791 0.938 1.00 28.72 O HETATM 4447 O HOH A 603 41.842 -10.256 14.782 1.00 38.04 O HETATM 4448 O HOH A 604 7.858 -10.571 -21.057 1.00 45.48 O HETATM 4449 O HOH A 605 45.553 -14.759 2.053 1.00 40.00 O HETATM 4450 O HOH A 606 18.939 -31.264 -16.839 1.00 32.34 O HETATM 4451 O HOH A 607 28.186 10.466 -25.456 1.00 49.33 O HETATM 4452 O HOH A 608 42.973 -13.855 1.390 1.00 34.04 O HETATM 4453 O HOH A 609 24.767 -37.074 -0.616 1.00 24.63 O HETATM 4454 O HOH A 610 35.621 -19.534 -18.500 1.00 35.81 O HETATM 4455 O HOH A 611 19.266 4.418 -16.636 1.00 28.77 O HETATM 4456 O HOH A 612 24.482 -20.083 -25.839 1.00 29.74 O HETATM 4457 O HOH A 613 19.196 -11.420 1.467 1.00 32.15 O HETATM 4458 O HOH A 614 33.769 -34.381 4.483 1.00 19.61 O HETATM 4459 O HOH A 615 41.924 -9.120 2.714 1.00 48.88 O HETATM 4460 O HOH A 616 35.416 5.464 -5.631 1.00 41.66 O HETATM 4461 O HOH A 617 0.939 -12.530 -21.271 1.00 42.38 O HETATM 4462 O HOH A 618 23.084 -30.024 4.303 1.00 30.20 O HETATM 4463 O HOH A 619 14.104 -30.960 -15.519 1.00 22.94 O HETATM 4464 O HOH A 620 13.110 -29.921 -18.401 1.00 31.91 O HETATM 4465 O HOH A 621 29.233 -3.317 4.443 1.00 11.36 O HETATM 4466 O HOH A 622 46.341 -14.695 6.638 1.00 30.22 O HETATM 4467 O HOH A 623 32.825 -15.140 -27.677 1.00 31.66 O HETATM 4468 O HOH A 624 24.807 -0.386 4.971 1.00 39.63 O HETATM 4469 O HOH A 625 19.889 -35.312 -15.170 1.00 52.91 O HETATM 4470 O HOH A 626 33.132 6.695 -25.045 1.00 27.28 O HETATM 4471 O HOH A 627 32.654 -5.012 -3.056 1.00 34.74 O HETATM 4472 O HOH A 628 25.209 -3.264 1.907 1.00 36.40 O HETATM 4473 O HOH A 629 41.982 -13.353 -27.116 1.00 29.03 O HETATM 4474 O HOH A 630 7.050 -26.155 -22.597 1.00 27.40 O HETATM 4475 O HOH A 631 34.623 -34.731 -2.150 1.00 38.09 O HETATM 4476 O HOH A 632 38.651 -9.244 15.699 1.00 30.31 O HETATM 4477 O HOH A 633 21.252 -5.898 -3.497 1.00 45.61 O HETATM 4478 O HOH A 634 36.355 -11.828 -15.114 1.00 39.38 O HETATM 4479 O HOH A 635 36.908 6.650 -10.910 1.00 21.28 O HETATM 4480 O HOH A 636 21.564 -18.189 -29.868 1.00 35.74 O HETATM 4481 O HOH A 637 12.613 -27.622 3.487 1.00 26.52 O HETATM 4482 O HOH A 638 40.620 -17.812 -4.319 1.00 37.78 O HETATM 4483 O HOH A 639 32.136 16.391 -22.484 1.00 37.02 O HETATM 4484 O HOH A 640 38.655 -22.087 15.364 1.00 33.73 O HETATM 4485 O HOH A 641 0.136 -31.721 -1.787 1.00 24.67 O HETATM 4486 O HOH A 642 2.353 -19.816 -3.301 1.00 51.30 O HETATM 4487 O HOH A 643 37.617 0.355 -15.175 1.00 25.81 O HETATM 4488 O HOH A 644 34.422 9.851 -25.931 1.00 37.56 O HETATM 4489 O HOH A 645 2.204 -21.562 -6.615 1.00 52.79 O HETATM 4490 O HOH A 646 41.300 -30.549 4.012 1.00 41.94 O HETATM 4491 O HOH A 647 3.241 -22.122 -4.852 1.00 43.15 O HETATM 4492 O HOH A 648 2.278 -22.917 -17.236 1.00 46.32 O HETATM 4493 O HOH A 649 35.797 7.837 -25.719 1.00 33.40 O HETATM 4494 O HOH A 650 19.589 -23.075 -0.335 1.00 41.69 O HETATM 4495 O HOH A 651 37.076 -31.688 6.292 1.00 46.55 O HETATM 4496 O HOH A 652 27.313 -2.702 2.222 1.00 34.84 O HETATM 4497 O HOH A 653 19.112 -26.344 2.895 1.00 29.04 O HETATM 4498 O HOH A 654 39.412 -22.605 17.042 1.00 33.38 O HETATM 4499 O HOH A 655 35.113 -5.791 1.371 1.00 45.80 O HETATM 4500 O HOH A 656 27.673 9.785 -22.990 1.00 34.49 O HETATM 4501 O HOH A 657 19.880 -27.612 -22.831 1.00 31.87 O HETATM 4502 O HOH A 658 -0.122 -30.170 -17.024 1.00 52.14 O HETATM 4503 O HOH A 659 21.565 -16.948 5.572 1.00 39.37 O HETATM 4504 O HOH A 660 25.248 -37.014 -11.012 1.00 37.79 O HETATM 4505 O HOH A 661 21.773 -10.407 -20.086 1.00 39.46 O HETATM 4506 O HOH A 662 17.706 -9.063 -11.390 1.00 49.36 O HETATM 4507 O HOH A 663 15.892 11.837 -39.090 1.00 44.29 O HETATM 4508 O HOH A 664 35.237 -14.517 -30.912 1.00 47.94 O HETATM 4509 O HOH A 665 33.894 -10.329 -20.175 1.00 23.28 O HETATM 4510 O HOH A 666 15.986 -33.707 1.020 1.00 37.90 O HETATM 4511 O HOH A 667 4.200 -18.924 -1.695 1.00 49.21 O HETATM 4512 O HOH A 668 36.433 -1.848 -4.973 1.00 48.74 O HETATM 4513 O HOH A 669 17.167 -6.355 8.294 1.00 48.96 O HETATM 4514 O HOH A 670 22.468 -11.053 17.942 1.00 41.30 O HETATM 4515 O HOH A 671 3.046 -21.787 -18.814 1.00 51.44 O HETATM 4516 O HOH A 672 18.055 -0.393 -14.953 1.00 32.61 O HETATM 4517 O HOH A 673 34.401 -4.365 -4.870 1.00 47.58 O HETATM 4518 O HOH A 674 33.662 -35.352 -4.393 1.00 50.72 O HETATM 4519 O HOH A 675 26.461 -15.458 19.169 1.00 34.11 O HETATM 4520 O HOH A 676 25.363 -6.408 -14.536 1.00 10.65 O HETATM 4521 O HOH A 677 17.719 -29.442 -17.360 1.00 30.73 O HETATM 4522 O HOH A 678 29.854 -2.384 -24.807 1.00 35.91 O HETATM 4523 O HOH A 679 25.523 -38.043 -8.354 1.00 46.87 O HETATM 4524 O HOH A 680 38.538 3.182 -11.803 1.00 44.82 O HETATM 4525 O HOH A 681 21.878 -14.184 14.708 1.00 46.96 O HETATM 4526 O HOH A 682 10.658 -22.572 8.723 1.00 44.88 O HETATM 4527 O HOH A 683 38.047 -2.746 -9.584 1.00 38.72 O HETATM 4528 O HOH A 684 19.237 -25.777 -24.526 1.00 22.05 O HETATM 4529 O HOH A 685 19.729 -3.857 0.796 1.00 46.60 O HETATM 4530 O HOH A 686 3.910 -10.915 -15.245 1.00 44.56 O HETATM 4531 O HOH A 687 40.641 -23.476 14.348 1.00 55.78 O HETATM 4532 O HOH A 688 36.282 -19.474 18.720 1.00 36.08 O HETATM 4533 O HOH A 689 34.805 -12.162 -17.088 1.00 24.11 O HETATM 4534 O HOH A 690 19.969 -22.755 6.813 1.00 42.67 O HETATM 4535 O HOH A 691 18.855 -11.323 9.925 1.00 45.13 O HETATM 4536 O HOH A 692 34.638 -9.240 -3.007 1.00 25.12 O HETATM 4537 O HOH A 693 37.596 4.771 -14.265 1.00 26.16 O HETATM 4538 O HOH A 694 29.409 -21.614 -29.952 1.00 20.54 O HETATM 4539 O HOH A 695 20.650 -22.184 -2.904 1.00 51.07 O HETATM 4540 O HOH A 696 12.243 -23.822 9.268 1.00 51.08 O HETATM 4541 O HOH A 697 17.224 -26.049 1.520 1.00 41.61 O HETATM 4542 O HOH A 698 34.986 -22.798 15.372 1.00 22.00 O HETATM 4543 O HOH A 699 18.973 -39.263 -12.561 1.00 38.17 O HETATM 4544 O HOH A 700 27.001 -3.957 -0.931 1.00 34.48 O HETATM 4545 O HOH A 701 21.894 -2.710 -3.209 1.00 42.62 O HETATM 4546 O HOH A 702 20.651 1.359 5.662 1.00 45.33 O HETATM 4547 O HOH A 703 38.979 -31.338 5.301 1.00 26.83 O HETATM 4548 O HOH A 704 38.349 0.243 -12.809 1.00 37.41 O HETATM 4549 O HOH A 705 25.854 -15.583 16.420 1.00 28.85 O HETATM 4550 O HOH A 706 36.303 -5.560 -2.392 1.00 40.77 O HETATM 4551 O HOH A 707 11.136 -33.508 3.977 1.00 22.15 O HETATM 4552 O HOH A 708 28.372 -3.297 -22.522 1.00 27.86 O HETATM 4553 O HOH A 709 30.905 -14.236 -28.992 1.00 41.75 O HETATM 4554 O HOH A 710 21.784 -7.393 -17.388 1.00 30.18 O HETATM 4555 O HOH A 711 9.103 -19.002 -26.623 1.00 42.41 O HETATM 4556 O HOH A 712 5.573 -16.552 -2.107 1.00 48.66 O HETATM 4557 O HOH A 713 25.750 -4.988 -22.971 1.00 36.57 O HETATM 4558 O HOH A 714 24.794 10.623 -22.205 1.00 44.97 O HETATM 4559 O HOH A 715 18.968 -7.845 -17.325 1.00 43.27 O HETATM 4560 O HOH A 716 39.582 -7.426 11.804 1.00 41.62 O HETATM 4561 O HOH A 717 39.140 -8.362 4.198 1.00 38.26 O HETATM 4562 O HOH A 718 36.358 -22.807 -21.407 1.00 26.96 O HETATM 4563 O HOH A 719 27.032 -20.277 -29.380 1.00 26.22 O HETATM 4564 O HOH A 720 17.501 2.607 -15.551 1.00 35.06 O HETATM 4565 O HOH A 721 8.388 -12.609 -4.663 1.00 47.83 O HETATM 4566 O HOH A 722 37.081 -9.328 1.179 1.00 30.61 O HETATM 4567 O HOH A 723 20.115 -20.666 7.127 1.00 32.61 O HETATM 4568 O HOH A 724 36.352 -17.288 -18.577 1.00 40.97 O HETATM 4569 O HOH A 725 32.829 -7.486 -1.985 1.00 24.85 O HETATM 4570 O HOH A 726 16.933 -3.727 12.991 1.00 48.51 O HETATM 4571 O HOH A 727 9.550 -14.574 -2.816 1.00 31.64 O HETATM 4572 O HOH A 728 22.209 -5.799 -21.286 1.00 38.85 O HETATM 4573 O HOH A 729 24.604 -11.535 19.968 1.00 34.70 O HETATM 4574 O HOH A 730 27.433 -16.110 -27.284 1.00 31.12 O HETATM 4575 O HOH A 731 41.019 -13.584 -15.615 0.50 52.66 O HETATM 4576 O HOH A 732 26.948 -19.222 -26.691 1.00 23.97 O HETATM 4577 O HOH A 733 1.712 -24.011 -4.949 1.00 33.78 O HETATM 4578 O HOH A 734 41.019 2.113 -15.615 0.50 39.76 O HETATM 4579 O HOH A 735 6.363 -14.888 0.213 1.00 48.04 O HETATM 4580 O HOH A 736 0.000 -7.801 -15.615 0.50 45.54 O HETATM 4581 O HOH P 201 18.142 -10.408 -9.251 1.00 36.11 O HETATM 4582 O HOH P 202 20.082 -16.132 -7.408 1.00 12.27 O HETATM 4583 O HOH P 203 14.043 -13.956 -5.581 1.00 36.66 O HETATM 4584 O HOH P 204 17.249 -11.966 -12.494 1.00 28.64 O HETATM 4585 O HOH P 205 18.618 -12.858 -5.315 1.00 46.43 O HETATM 4586 O HOH P 206 17.109 -12.817 -6.595 1.00 41.24 O HETATM 4587 O HOH P 207 15.430 -11.814 -8.584 1.00 30.08 O HETATM 4588 O HOH P 208 5.967 -10.684 -9.709 1.00 43.91 O HETATM 4589 O HOH P 209 6.562 -11.008 -12.197 1.00 65.71 O HETATM 4590 O HOH P 210 19.545 -8.585 -7.157 1.00 39.49 O HETATM 4591 O HOH P 211 9.821 -7.658 -10.830 1.00 46.85 O HETATM 4592 O HOH P 212 11.998 -14.647 -3.030 1.00 44.29 O HETATM 4593 O HOH P 213 12.747 -14.612 -0.286 1.00 40.29 O CONECT 79 4243 CONECT 3356 4242 CONECT 4186 4201 CONECT 4201 4186 4202 CONECT 4202 4201 4203 4205 4211 CONECT 4203 4202 4204 4212 4213 CONECT 4204 4203 4207 CONECT 4205 4202 4206 4214 CONECT 4206 4205 CONECT 4207 4204 4208 4209 4210 CONECT 4208 4207 CONECT 4209 4207 CONECT 4210 4207 CONECT 4211 4202 CONECT 4212 4203 CONECT 4213 4203 CONECT 4214 4205 CONECT 4216 4237 4238 CONECT 4225 4227 4239 CONECT 4226 4228 4240 CONECT 4227 4225 4229 CONECT 4228 4226 4230 CONECT 4229 4227 4231 4237 CONECT 4230 4228 4232 4238 CONECT 4231 4229 4233 CONECT 4232 4230 4234 CONECT 4233 4231 4235 CONECT 4234 4232 4236 CONECT 4235 4233 4237 CONECT 4236 4234 4238 CONECT 4237 4216 4229 4235 CONECT 4238 4216 4230 4236 CONECT 4239 4225 CONECT 4240 4226 CONECT 4242 3356 4378 CONECT 4243 79 4310 4484 4498 CONECT 4243 4531 CONECT 4310 4243 CONECT 4378 4242 CONECT 4484 4243 CONECT 4498 4243 CONECT 4531 4243 END