USER MOD reduce.3.24.130724 H: found=0, std=0, add=2327, rem=0, adj=129 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE/HYDROLASE INHIBITOR 30-JUL-11 3T7P TITLE ENDOTHIAPEPSIN IN COMPLEX WITH A HYDRAZIDE DERIVATIVE COMPND MOL_ID: 1; COMPND 2 MOLECULE: ENDOTHIAPEPSIN; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: ASPARTATE PROTEASE; COMPND 5 EC: 3.4.23.22 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: CRYPHONECTRIA PARASITICA; SOURCE 3 ORGANISM_COMMON: CHESNUT BLIGHT FUNGUS; SOURCE 4 ORGANISM_TAXID: 5116 KEYWDS HYDROLASE-HYDROLASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR H.KOESTER,A.HEINE,G.KLEBE REVDAT 1 01-AUG-12 3T7P 0 JRNL AUTH H.KOESTER,A.HEINE,S.BRASS,G.KLEBE JRNL TITL ENDOTHIAPEPSIN IN COMPLEX WITH A HYDRAZIDE DERIVATIVE JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 1.35 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: 1.6.4_486) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VICENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE- REMARK 3 : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO, REMARK 3 : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL REMARK 3 : MORIARTY,REETAL PAI,RANDY READ,JANE REMARK 3 : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM REMARK 3 : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH, REMARK 3 : LAURENT STORONI,TOM TERWILLIGER,PETER REMARK 3 : ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.35 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 39.69 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 96.6 REMARK 3 NUMBER OF REFLECTIONS : 68919 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.153 REMARK 3 R VALUE (WORKING SET) : 0.153 REMARK 3 FREE R VALUE : 0.169 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.090 REMARK 3 FREE R VALUE TEST SET COUNT : 3510 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 39.7039 - 2.9082 1.00 6820 406 0.1603 0.1654 REMARK 3 2 2.9082 - 2.3084 1.00 6767 378 0.1634 0.1943 REMARK 3 3 2.3084 - 2.0166 1.00 6761 363 0.1448 0.1519 REMARK 3 4 2.0166 - 1.8322 1.00 6758 341 0.1426 0.1609 REMARK 3 5 1.8322 - 1.7009 0.99 6660 387 0.1416 0.1688 REMARK 3 6 1.7009 - 1.6006 0.98 6668 353 0.1401 0.1523 REMARK 3 7 1.6006 - 1.5204 0.98 6620 342 0.1411 0.1724 REMARK 3 8 1.5204 - 1.4542 0.97 6553 352 0.1448 0.1630 REMARK 3 9 1.4542 - 1.3983 0.94 6329 319 0.1610 0.1877 REMARK 3 10 1.3983 - 1.3500 0.81 5473 269 0.1769 0.2002 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.00 REMARK 3 SHRINKAGE RADIUS : 0.72 REMARK 3 K_SOL : 0.40 REMARK 3 B_SOL : 59.08 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.130 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 15.000 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.90340 REMARK 3 B22 (A**2) : 0.34950 REMARK 3 B33 (A**2) : 0.55390 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -0.98080 REMARK 3 B23 (A**2) : -0.00000 REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.005 2526 REMARK 3 ANGLE : 1.096 3460 REMARK 3 CHIRALITY : 0.071 407 REMARK 3 PLANARITY : 0.005 437 REMARK 3 DIHEDRAL : 11.728 831 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL 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 3T7P COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-AUG-11. REMARK 100 THE RCSB ID CODE IS RCSB067141. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-AUG-09 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 4.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SLS REMARK 200 BEAMLINE : X06DA REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : BARTELS MONOCHROMATOR WITH DUAL REMARK 200 CHANNEL CUT CRYSTALS (DCCM) IN (+ REMARK 200 --+) GEOMETRY REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 70171 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.350 REMARK 200 RESOLUTION RANGE LOW (A) : 40.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 3.600 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 4.50000 REMARK 200 FOR THE DATA SET : 27.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.35 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.37 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 2.30 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 17.80000 REMARK 200 FOR SHELL : 5.100 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: PDB ENTRY 1OEW REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 49.69 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.45 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1M NH4AC, 0.1M ACETATE-BUFFER, 26% REMARK 280 PEG 4000, PH 4.6, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 289K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,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 36.55500 REMARK 290 SMTRY3 2 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: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 63 CG CD CE NZ REMARK 470 LYS A 68 CG CD CE NZ REMARK 470 LYS A 149 CG CD CE NZ REMARK 470 LYS A 191 CG CD CE NZ REMARK 470 LYS A 243 CG CD CE NZ 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 THR A 49 121.23 -39.71 REMARK 500 ALA A 129 -169.54 -79.27 REMARK 500 REMARK 500 REMARK: NULL REMARK 610 REMARK 610 MISSING HETEROATOM REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 610 I=INSERTION CODE): REMARK 610 M RES C SSEQI REMARK 610 7SP A 2001 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 7SP A 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 7SP A 2001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PGE A 3001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL A 3002 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE DMS A 3003 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PGE A 3004 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3T6I RELATED DB: PDB REMARK 900 RELATED ID: 3T7Q RELATED DB: PDB REMARK 900 RELATED ID: 3T7X RELATED DB: PDB DBREF 3T7P A 1 330 UNP P11838 CARP_CRYPA 90 419 SEQRES 1 A 330 SER THR GLY SER ALA THR THR THR PRO ILE ASP SER LEU SEQRES 2 A 330 ASP ASP ALA TYR ILE THR PRO VAL GLN ILE GLY THR PRO SEQRES 3 A 330 ALA GLN THR LEU ASN LEU ASP PHE ASP THR GLY SER SER SEQRES 4 A 330 ASP LEU TRP VAL PHE SER SER GLU THR THR ALA SER GLU SEQRES 5 A 330 VAL ASP GLY GLN THR ILE TYR THR PRO SER LYS SER THR SEQRES 6 A 330 THR ALA LYS LEU LEU SER GLY ALA THR TRP SER ILE SER SEQRES 7 A 330 TYR GLY ASP GLY SER SER SER SER GLY ASP VAL TYR THR SEQRES 8 A 330 ASP THR VAL SER VAL GLY GLY LEU THR VAL THR GLY GLN SEQRES 9 A 330 ALA VAL GLU SER ALA LYS LYS VAL SER SER SER PHE THR SEQRES 10 A 330 GLU ASP SER THR ILE ASP GLY LEU LEU GLY LEU ALA PHE SEQRES 11 A 330 SER THR LEU ASN THR VAL SER PRO THR GLN GLN LYS THR SEQRES 12 A 330 PHE PHE ASP ASN ALA LYS ALA SER LEU ASP SER PRO VAL SEQRES 13 A 330 PHE THR ALA ASP LEU GLY TYR HIS ALA PRO GLY THR TYR SEQRES 14 A 330 ASN PHE GLY PHE ILE ASP THR THR ALA TYR THR GLY SER SEQRES 15 A 330 ILE THR TYR THR ALA VAL SER THR LYS GLN GLY PHE TRP SEQRES 16 A 330 GLU TRP THR SER THR GLY TYR ALA VAL GLY SER GLY THR SEQRES 17 A 330 PHE LYS SER THR SER ILE ASP GLY ILE ALA ASP THR GLY SEQRES 18 A 330 THR THR LEU LEU TYR LEU PRO ALA THR VAL VAL SER ALA SEQRES 19 A 330 TYR TRP ALA GLN VAL SER GLY ALA LYS SER SER SER SER SEQRES 20 A 330 VAL GLY GLY TYR VAL PHE PRO CYS SER ALA THR LEU PRO SEQRES 21 A 330 SER PHE THR PHE GLY VAL GLY SER ALA ARG ILE VAL ILE SEQRES 22 A 330 PRO GLY ASP TYR ILE ASP PHE GLY PRO ILE SER THR GLY SEQRES 23 A 330 SER SER SER CYS PHE GLY GLY ILE GLN SER SER ALA GLY SEQRES 24 A 330 ILE GLY ILE ASN ILE PHE GLY ASP VAL ALA LEU LYS ALA SEQRES 25 A 330 ALA PHE VAL VAL PHE ASN GLY ALA THR THR PRO THR LEU SEQRES 26 A 330 GLY PHE ALA SER LYS HET 7SP A1001 24 HET 7SP A2001 15 HET PGE A3001 10 HET GOL A3002 6 HET DMS A3003 4 HET PGE A3004 10 HETNAM 7SP (2R)-2-AMINO-N'-[(E)-(4-HYDROXYNAPHTHALEN-1-YL) HETNAM 2 7SP METHYLIDENE]-2-PHENYLETHANEHYDRAZIDE HETNAM PGE TRIETHYLENE GLYCOL HETNAM GOL GLYCEROL HETNAM DMS DIMETHYL SULFOXIDE HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 2 7SP 2(C19 H17 N3 O2) FORMUL 4 PGE 2(C6 H14 O4) FORMUL 5 GOL C3 H8 O3 FORMUL 6 DMS C2 H6 O S FORMUL 8 HOH *425(H2 O) HELIX 1 1 THR A 49 VAL A 53 5 5 HELIX 2 2 THR A 60 SER A 64 5 5 HELIX 3 3 SER A 113 ASP A 119 1 7 HELIX 4 4 PHE A 130 ASN A 134 5 5 HELIX 5 5 THR A 143 LYS A 149 1 7 HELIX 6 6 ALA A 150 LEU A 152 5 3 HELIX 7 7 PRO A 228 ALA A 237 1 10 HELIX 8 8 PRO A 274 TYR A 277 5 4 HELIX 9 9 GLY A 306 LYS A 311 1 6 SHEET 1 A 9 LYS A 68 SER A 78 0 SHEET 2 A 9 SER A 84 VAL A 96 -1 O VAL A 89 N LEU A 70 SHEET 3 A 9 TYR A 17 ILE A 23 -1 N GLN A 22 O SER A 95 SHEET 4 A 9 GLY A 3 PRO A 9 -1 N THR A 8 O ILE A 18 SHEET 5 A 9 GLY A 167 PHE A 171 -1 O PHE A 171 N GLY A 3 SHEET 6 A 9 VAL A 156 ASP A 160 -1 N THR A 158 O ASN A 170 SHEET 7 A 9 PHE A 314 ASN A 318 -1 O PHE A 317 N PHE A 157 SHEET 8 A 9 THR A 324 ALA A 328 -1 O GLY A 326 N VAL A 316 SHEET 9 A 9 THR A 184 ALA A 187 -1 N THR A 184 O PHE A 327 SHEET 1 B13 LYS A 68 SER A 78 0 SHEET 2 B13 SER A 84 VAL A 96 -1 O VAL A 89 N LEU A 70 SHEET 3 B13 LEU A 99 VAL A 112 -1 O VAL A 106 N TYR A 90 SHEET 4 B13 LEU A 41 VAL A 43 1 N LEU A 41 O GLU A 107 SHEET 5 B13 GLY A 124 GLY A 127 -1 O LEU A 125 N TRP A 42 SHEET 6 B13 GLN A 28 ASP A 35 1 N ASP A 33 O GLY A 124 SHEET 7 B13 TYR A 17 ILE A 23 -1 N THR A 19 O LEU A 32 SHEET 8 B13 GLY A 3 PRO A 9 -1 N THR A 8 O ILE A 18 SHEET 9 B13 GLY A 167 PHE A 171 -1 O PHE A 171 N GLY A 3 SHEET 10 B13 VAL A 156 ASP A 160 -1 N THR A 158 O ASN A 170 SHEET 11 B13 PHE A 314 ASN A 318 -1 O PHE A 317 N PHE A 157 SHEET 12 B13 THR A 324 ALA A 328 -1 O GLY A 326 N VAL A 316 SHEET 13 B13 THR A 184 ALA A 187 -1 N THR A 184 O PHE A 327 SHEET 1 C 7 ALA A 269 ILE A 273 0 SHEET 2 C 7 PHE A 262 VAL A 266 -1 N PHE A 262 O ILE A 273 SHEET 3 C 7 GLU A 196 VAL A 204 -1 N ALA A 203 O THR A 263 SHEET 4 C 7 LYS A 210 ALA A 218 -1 O LYS A 210 N TYR A 202 SHEET 5 C 7 ASN A 303 PHE A 305 1 O PHE A 305 N ILE A 217 SHEET 6 C 7 LEU A 225 LEU A 227 -1 N TYR A 226 O ILE A 304 SHEET 7 C 7 ILE A 294 SER A 296 1 O GLN A 295 N LEU A 225 SHEET 1 D 4 LYS A 243 SER A 245 0 SHEET 2 D 4 GLY A 250 PRO A 254 -1 O GLY A 250 N SER A 245 SHEET 3 D 4 SER A 289 GLY A 292 -1 O CYS A 290 N PHE A 253 SHEET 4 D 4 ASP A 279 PRO A 282 -1 N GLY A 281 O PHE A 291 SSBOND *** CYS A 255 CYS A 290 1555 1555 2.05 CISPEP 1 THR A 25 PRO A 26 0 -6.79 CISPEP 2 SER A 137 PRO A 138 0 5.94 SITE *** AC1 10 ASP A 35 GLY A 37 TYR A 79 GLY A 80 SITE *** AC1 10 ASP A 81 SER A 83 LEU A 125 GLY A 221 SITE *** AC1 10 HOH A 510 7SP A2001 SITE *** AC2 6 GLY A 80 ILE A 217 ASP A 219 THR A 222 SITE *** AC2 6 ILE A 304 7SP A1001 SITE *** AC3 3 ASP A 15 PHE A 280 PHE A 291 SITE *** AC4 7 VAL A 272 TYR A 277 ALA A 312 SER A 329 SITE *** AC4 7 LYS A 330 HOH A 422 HOH A 604 SITE *** AC5 6 PRO A 61 SER A 62 SER A 64 ALA A 67 SITE *** AC5 6 HOH A 387 HOH A 650 SITE *** AC6 7 ALA A 187 SER A 189 GLU A 196 TRP A 197 SITE *** AC6 7 THR A 198 HOH A 523 HOH A 735 CRYST1 45.390 73.110 52.890 90.00 109.59 90.00 P 1 21 1 2 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 0.022031 0.000000 0.007841 0.00000 SCALE2 0.000000 0.013678 0.000000 0.00000 SCALE3 0.000000 0.000000 0.020069 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 318 ASN : amide:sc= 0.646 K(o=1,f=-1.2) USER MOD Set 1.2: A 324 THR OG1 : rot 180:sc= 0.399 USER MOD Set 2.1: A 297 SER OG : rot -167:sc= 2.5 USER MOD Set 2.2: A 303 ASN : amide:sc= 1.97 K(o=4.5,f=-1.2) USER MOD Set 3.1: A 245 SER OG : rot 140:sc= 0.351 USER MOD Set 3.2: A 247 SER OG : rot -15:sc= 0.574 USER MOD Set 4.1: A 36 THR OG1 : rot 105:sc= 1.25 USER MOD Set 4.2: A 220 THR OG1 : rot 109:sc= 1.35 USER MOD Set 5.1: A 104 GLN : amide:sc= 0.122 K(o=3.3,f=-0.96!) USER MOD Set 5.2: A 147 ASN : amide:sc= 3.17 K(o=3.3,f=0.84) USER MOD Set 6.1: A 95 SER OG : rot 116:sc= 2.28 USER MOD Set 6.2: A 100 THR OG1 : rot -65:sc= 2.26 USER MOD Set 7.1: A 25 THR OG1 : rot 94:sc= 2.06 USER MOD Set 7.2: A 64 SER OG : rot -166:sc= 0.95 USER MOD Set 7.3: A 66 THR OG1 : rot 97:sc= 2.18 USER MOD Set 8.1: A 45 SER OG : rot -169:sc= 1.19 USER MOD Set 8.2: A 48 THR OG1 : rot -31:sc= 1.52 USER MOD Set 8.3: A 108 SER OG : rot -125:sc= 2.13 USER MOD Set 9.1: A 22 GLN : amide:sc= 2.15 K(o=2.5,f=1.2) USER MOD Set 9.2: A 29 THR OG1 : rot 170:sc= 0.363 USER MOD Set10.1: A 7 THR OG1 : rot 89:sc= 0.177 USER MOD Set10.2: A 19 THR OG1 : rot -159:sc= 1.39 USER MOD Set11.1: A 4 SER OG : rot 75:sc= 1.87 USER MOD Set11.2: A 170 ASN : amide:sc= 1.74 K(o=3.6,f=-1.2) USER MOD Single : A 1 SER N :NH3+ -169:sc= 2.4 (180deg=2.23) USER MOD Single : A 1 SER OG : rot -65:sc= 1.03 USER MOD Single : A 2 THR OG1 : rot -80:sc= 1.98 USER MOD Single : A 6 THR OG1 : rot -35:sc= 0.866 USER MOD Single : A 8 THR OG1 : rot 86:sc= 1.28 USER MOD Single : A 12 SER OG : rot 117:sc= 1.42 USER MOD Single : A 17 TYR OH : rot -14:sc= 1.17 USER MOD Single : A 28 GLN : amide:sc= 1.6 K(o=1.6,f=-5.3!) USER MOD Single : A 31 ASN : amide:sc= 1.74 K(o=1.7,f=0.62) USER MOD Single : A 38 SER OG : rot -106:sc= 2.38 USER MOD Single : A 39 SER OG : rot -166:sc= 0.062 USER MOD Single : A 46 SER OG : rot 89:sc= 1.39 USER MOD Single : A 49 THR OG1 : rot 74:sc= 1.46 USER MOD Single : A 51 SER OG : rot -134:sc= 2.18 USER MOD Single : A 56 GLN : amide:sc= 1.34 K(o=1.3,f=-8.1!) USER MOD Single : A 57 THR OG1 : rot 123:sc= 2.85 USER MOD Single : A 59 TYR OH : rot -162:sc= 1.12 USER MOD Single : A 60 THR OG1 : rot 91:sc= 2.1 USER MOD Single : A 62 SER OG : rot -144:sc= 2.76 USER MOD Single : A 65 THR OG1 : rot 105:sc= 2.11 USER MOD Single : A 71 SER OG : rot 166:sc= 1.97 USER MOD Single : A 74 THR OG1 : rot 90:sc= 2.13 USER MOD Single : A 76 SER OG : rot 15:sc= 0.754 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot -171:sc= 1.03 USER MOD Single : A 83 SER OG : rot -71:sc= 1.06 USER MOD Single : A 84 SER OG : rot -96:sc= 1.72 USER MOD Single : A 85 SER OG : rot -169:sc= 0.399 USER MOD Single : A 86 SER OG : rot -104:sc= 1.71 USER MOD Single : A 90 TYR OH : rot -177:sc= 1.27 USER MOD Single : A 91 THR OG1 : rot -93:sc= 2.07 USER MOD Single : A 93 THR OG1 : rot -163:sc= 1.99 USER MOD Single : A 102 THR OG1 : rot 95:sc= 1.16 USER MOD Single : A 110 LYS NZ :NH3+ -117:sc= 0.228 (180deg=-0.196) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 100:sc= 1.53 USER MOD Single : A 114 SER OG : rot 94:sc= 1.3 USER MOD Single : A 115 SER OG A: rot -82:sc= 2.13 USER MOD Single : A 115 SER OG B: rot 6:sc= 0.279 USER MOD Single : A 117 THR OG1 : rot -73:sc= 2.21 USER MOD Single : A 120 SER OG : rot -79:sc= 0.658 USER MOD Single : A 121 THR OG1 : rot -56:sc= 1.05 USER MOD Single : A 131 SER OG : rot 124:sc= 1.3 USER MOD Single : A 132 THR OG1 : rot -147:sc= 0.745 USER MOD Single : A 134 ASN : amide:sc= 1.2 K(o=1.2,f=-5.5!) USER MOD Single : A 135 THR OG1 : rot -65:sc= 1.04 USER MOD Single : A 137 SER OG : rot -93:sc= 1.93 USER MOD Single : A 139 THR OG1 : rot -76:sc= 0.686 USER MOD Single : A 140 GLN : amide:sc= 2.75 K(o=2.7,f=0.92) USER MOD Single : A 141 GLN : amide:sc= 2.5 K(o=2.5,f=-0.26) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot -170:sc= 1.21 USER MOD Single : A 151 SER OG : rot 79:sc= 1.32 USER MOD Single : A 154 SER OG : rot 72:sc= 0.872 USER MOD Single : A 158 THR OG1 : rot 93:sc= 2.07 USER MOD Single : A 163 TYR OH : rot -85:sc= 1.38 USER MOD Single : A 164 HIS : no HE2:sc= 0.491 K(o=0.49,f=-0.076) USER MOD Single : A 168 THR OG1 : rot 93:sc= 2.83 USER MOD Single : A 169 TYR OH : rot -39:sc= 1.35 USER MOD Single : A 176 THR OG1 : rot 95:sc= 1.89 USER MOD Single : A 177 THR OG1 : rot -55:sc= 1.06 USER MOD Single : A 179 TYR OH : rot -15:sc= 1.38 USER MOD Single : A 180 THR OG1 : rot -154:sc= 1.01 USER MOD Single : A 182 SER OG A: rot -172:sc= 1.78 USER MOD Single : A 182 SER OG B: rot 180:sc= 0 USER MOD Single : A 184 THR OG1 : rot 99:sc= 2.46 USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD Single : A 186 THR OG1 : rot -86:sc= 2.79 USER MOD Single : A 189 SER OG : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot -154:sc= 1.17 USER MOD Single : A 192 GLN : amide:sc= -0.0767 X(o=-0.077,f=-0.49) USER MOD Single : A 198 THR OG1 : rot -95:sc= 1.44 USER MOD Single : A 199 SER OG : rot 50:sc= 0.968 USER MOD Single : A 200 THR OG1 : rot -174:sc= 0.949 USER MOD Single : A 202 TYR OH : rot 143:sc= 2.53 USER MOD Single : A 206 SER OG : rot 97:sc= 0.616 USER MOD Single : A 208 THR OG1 : rot -108:sc= 0.0047 USER MOD Single : A 210 LYS NZ :NH3+ -133:sc= 0.00861 (180deg=0) USER MOD Single : A 211 SER OG : rot 81:sc= 1.09 USER MOD Single : A 212 THR OG1 : rot -91:sc= 2.37 USER MOD Single : A 213 SER OG : rot -35:sc= 1.16 USER MOD Single : A 222 THR OG1 : rot 94:sc= 1.32 USER MOD Single : A 223 THR OG1 : rot -73:sc= 1.3 USER MOD Single : A 226 TYR OH : rot 9:sc= 2.17 USER MOD Single : A 230 THR OG1 : rot 148:sc= 0.76 USER MOD Single : A 233 SER OG : rot -11:sc= 0.71 USER MOD Single : A 235 TYR OH : rot 172:sc= 1.08 USER MOD Single : A 238 GLN : amide:sc= 1.27 K(o=1.3,f=0.11) USER MOD Single : A 240 SER OG A: rot 74:sc= 1.05 USER MOD Single : A 240 SER OG B: rot 86:sc= 1.04 USER MOD Single : A 244 SER OG : rot 119:sc= 1.04 USER MOD Single : A 246 SER OG : rot -75:sc= 1.16 USER MOD Single : A 251 TYR OH : rot 143:sc= 2.58 USER MOD Single : A 256 SER OG : rot 180:sc= 0 USER MOD Single : A 258 THR OG1 : rot 91:sc= 0.649 USER MOD Single : A 261 SER OG : rot -158:sc= 2.08 USER MOD Single : A 263 THR OG1 : rot 179:sc= 2.04 USER MOD Single : A 268 SER OG : rot -2:sc= 0.606 USER MOD Single : A 277 TYR OH : rot 7:sc= 2.19 USER MOD Single : A 284 SER OG : rot 3:sc= 1.12 USER MOD Single : A 285 THR OG1 : rot 161:sc= 2.06 USER MOD Single : A 287 SER OG : rot 102:sc= 0.684 USER MOD Single : A 288 SER OG : rot 98:sc= 0.0929 USER MOD Single : A 289 SER OG A: rot 64:sc= 1.35 USER MOD Single : A 289 SER OG B: rot -163:sc= 1.32 USER MOD Single : A 295 GLN : amide:sc= 2.55 K(o=2.6,f=-5.9!) USER MOD Single : A 296 SER OG : rot -173:sc= 1.3 USER MOD Single : A 311 LYS NZ :NH3+ -166:sc= 2.51 (180deg=2.19) USER MOD Single : A 321 THR OG1 : rot 180:sc= 0 USER MOD Single : A 322 THR OG1 : rot 98:sc= 0.845 USER MOD Single : A 329 SER OG : rot 73:sc= 1.92 USER MOD Single : A 330 LYS NZ :NH3+ -166:sc= 2.53 (180deg=2.2) USER MOD Single : A1001 7SP O23 : rot 120:sc= 0 USER MOD Single : A2001 7SP O23 : rot 22:sc= 0.681 USER MOD Single : A3001 PGE O1 : rot 180:sc= 0 USER MOD Single : A3001 PGE O4 : rot 180:sc= 0 USER MOD Single : A3002 GOL O1 : rot 72:sc= 2.17 USER MOD Single : A3002 GOL O2 : rot -135:sc= 1.46 USER MOD Single : A3002 GOL O3 : rot -35:sc= 1.06 USER MOD Single : A3003 DMS C1 :methyl -112:sc= -2.66! (180deg=-4.44!) USER MOD Single : A3003 DMS C2 :methyl 180:sc= -0.153 (180deg=-0.153) USER MOD Single : A3004 PGE O1 : rot -16:sc= 0.827 USER MOD Single : A3004 PGE O4 : rot -3:sc= 0.86 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 24.004 -12.568 11.502 1.00 9.66 N ATOM 2 CA SER A 1 22.716 -13.247 11.379 1.00 9.85 C ATOM 3 C SER A 1 21.840 -12.604 10.309 1.00 8.40 C ATOM 4 O SER A 1 22.097 -11.478 9.875 1.00 8.59 O ATOM 5 CB SER A 1 21.976 -13.206 12.713 1.00 10.14 C ATOM 6 OG SER A 1 21.694 -11.870 13.087 1.00 13.52 O ATOM 0 H1 SER A 1 24.549 -13.054 12.011 1.00 9.66 H new ATOM 0 H2 SER A 1 24.365 -12.467 10.695 1.00 9.66 H new ATOM 0 H3 SER A 1 23.884 -11.769 11.875 1.00 9.66 H new ATOM 0 HA SER A 1 22.895 -14.165 11.121 1.00 9.85 H new ATOM 0 HB2 SER A 1 21.150 -13.709 12.645 1.00 10.14 H new ATOM 0 HB3 SER A 1 22.513 -13.633 13.399 1.00 10.14 H new ATOM 0 HG SER A 1 22.414 -11.461 13.230 1.00 13.52 H new ATOM 7 N THR A 2 20.804 -13.328 9.890 1.00 8.31 N ATOM 8 CA THR A 2 19.795 -12.791 8.976 1.00 7.38 C ATOM 9 C THR A 2 18.428 -13.343 9.358 1.00 7.50 C ATOM 10 O THR A 2 18.327 -14.281 10.149 1.00 8.90 O ATOM 11 CB THR A 2 20.055 -13.182 7.506 1.00 8.35 C ATOM 12 OG1 THR A 2 19.988 -14.607 7.358 1.00 10.31 O ATOM 13 CG2 THR A 2 21.419 -12.688 7.034 1.00 9.57 C ATOM 0 H THR A 2 20.666 -14.143 10.127 1.00 8.31 H new ATOM 0 HA THR A 2 19.834 -11.825 9.052 1.00 7.38 H new ATOM 0 HB THR A 2 19.371 -12.762 6.962 1.00 8.35 H new ATOM 0 HG1 THR A 2 20.710 -14.950 7.615 1.00 10.31 H new ATOM 0 HG21 THR A 2 21.555 -12.947 6.109 1.00 9.57 H new ATOM 0 HG22 THR A 2 21.456 -11.721 7.107 1.00 9.57 H new ATOM 0 HG23 THR A 2 22.114 -13.081 7.585 1.00 9.57 H new ATOM 14 N GLY A 3 17.380 -12.763 8.781 1.00 6.90 N ATOM 15 CA GLY A 3 16.040 -13.318 8.879 1.00 7.27 C ATOM 16 C GLY A 3 15.295 -13.085 7.582 1.00 7.03 C ATOM 17 O GLY A 3 15.620 -12.166 6.829 1.00 6.74 O ATOM 0 H GLY A 3 17.428 -12.037 8.322 1.00 6.90 H new ATOM 0 HA2 GLY A 3 16.087 -14.268 9.069 1.00 7.27 H new ATOM 0 HA3 GLY A 3 15.562 -12.905 9.615 1.00 7.27 H new ATOM 18 N SER A 4 14.307 -13.926 7.303 1.00 6.43 N ATOM 19 CA SER A 4 13.506 -13.787 6.091 1.00 6.31 C ATOM 20 C SER A 4 12.113 -14.319 6.367 1.00 7.38 C ATOM 21 O SER A 4 11.962 -15.470 6.787 1.00 9.28 O ATOM 22 CB SER A 4 14.153 -14.570 4.944 1.00 8.23 C ATOM 23 OG SER A 4 13.399 -14.460 3.748 1.00 9.75 O ATOM 0 H SER A 4 14.082 -14.588 7.804 1.00 6.43 H new ATOM 0 HA SER A 4 13.455 -12.853 5.834 1.00 6.31 H new ATOM 0 HB2 SER A 4 15.052 -14.240 4.792 1.00 8.23 H new ATOM 0 HB3 SER A 4 14.232 -15.504 5.193 1.00 8.23 H new ATOM 0 HG SER A 4 13.519 -13.701 3.409 1.00 9.75 H new ATOM 24 N ALA A 5 11.098 -13.487 6.149 1.00 6.48 N ATOM 25 CA ALA A 5 9.721 -13.889 6.407 1.00 6.99 C ATOM 26 C ALA A 5 8.830 -13.440 5.271 1.00 6.32 C ATOM 27 O ALA A 5 9.028 -12.362 4.698 1.00 7.25 O ATOM 28 CB ALA A 5 9.220 -13.302 7.716 1.00 7.26 C ATOM 0 H ALA A 5 11.187 -12.685 5.852 1.00 6.48 H new ATOM 0 HA ALA A 5 9.695 -14.856 6.475 1.00 6.99 H new ATOM 0 HB1 ALA A 5 8.304 -13.582 7.867 1.00 7.26 H new ATOM 0 HB2 ALA A 5 9.777 -13.615 8.446 1.00 7.26 H new ATOM 0 HB3 ALA A 5 9.259 -12.334 7.672 1.00 7.26 H new ATOM 29 N THR A 6 7.833 -14.255 4.960 1.00 5.96 N ATOM 30 CA THR A 6 6.855 -13.933 3.938 1.00 5.40 C ATOM 31 C THR A 6 5.794 -13.010 4.502 1.00 6.14 C ATOM 32 O THR A 6 5.331 -13.193 5.635 1.00 7.24 O ATOM 33 CB THR A 6 6.192 -15.214 3.433 1.00 6.06 C ATOM 34 OG1 THR A 6 7.194 -16.037 2.827 1.00 8.22 O ATOM 35 CG2 THR A 6 5.082 -14.922 2.435 1.00 7.59 C ATOM 0 H THR A 6 7.705 -15.016 5.340 1.00 5.96 H new ATOM 0 HA THR A 6 7.308 -13.489 3.204 1.00 5.40 H new ATOM 0 HB THR A 6 5.786 -15.671 4.186 1.00 6.06 H new ATOM 0 HG1 THR A 6 7.759 -15.551 2.440 1.00 8.22 H new ATOM 0 HG21 THR A 6 4.686 -15.756 2.138 1.00 7.59 H new ATOM 0 HG22 THR A 6 4.402 -14.375 2.858 1.00 7.59 H new ATOM 0 HG23 THR A 6 5.449 -14.449 1.672 1.00 7.59 H new ATOM 36 N THR A 7 5.426 -12.005 3.712 1.00 5.66 N ATOM 37 CA THR A 7 4.369 -11.079 4.088 1.00 5.97 C ATOM 38 C THR A 7 3.192 -11.239 3.117 1.00 5.57 C ATOM 39 O THR A 7 3.390 -11.391 1.907 1.00 7.17 O ATOM 40 CB THR A 7 4.902 -9.636 4.185 1.00 5.40 C ATOM 41 OG1 THR A 7 3.920 -8.813 4.818 1.00 7.15 O ATOM 42 CG2 THR A 7 5.255 -9.052 2.819 1.00 7.46 C ATOM 0 H THR A 7 5.782 -11.843 2.946 1.00 5.66 H new ATOM 0 HA THR A 7 4.042 -11.289 4.977 1.00 5.97 H new ATOM 0 HB THR A 7 5.718 -9.659 4.709 1.00 5.40 H new ATOM 0 HG1 THR A 7 4.035 -8.829 5.650 1.00 7.15 H new ATOM 0 HG21 THR A 7 5.585 -8.146 2.929 1.00 7.46 H new ATOM 0 HG22 THR A 7 5.941 -9.597 2.401 1.00 7.46 H new ATOM 0 HG23 THR A 7 4.464 -9.042 2.257 1.00 7.46 H new ATOM 43 N THR A 8 1.973 -11.225 3.648 1.00 5.99 N ATOM 44 CA THR A 8 0.790 -11.648 2.887 1.00 8.38 C ATOM 45 C THR A 8 -0.299 -10.571 2.961 1.00 7.43 C ATOM 46 O THR A 8 -0.590 -10.074 4.048 1.00 7.67 O ATOM 47 CB THR A 8 0.234 -12.988 3.460 1.00 8.21 C ATOM 48 OG1 THR A 8 1.258 -13.995 3.424 1.00 8.69 O ATOM 49 CG2 THR A 8 -0.962 -13.488 2.659 1.00 10.20 C ATOM 0 H THR A 8 1.804 -10.973 4.453 1.00 5.99 H new ATOM 0 HA THR A 8 1.049 -11.778 1.961 1.00 8.38 H new ATOM 0 HB THR A 8 -0.049 -12.819 4.372 1.00 8.21 H new ATOM 0 HG1 THR A 8 1.728 -13.942 4.118 1.00 8.69 H new ATOM 0 HG21 THR A 8 -1.282 -14.320 3.041 1.00 10.20 H new ATOM 0 HG22 THR A 8 -1.670 -12.826 2.688 1.00 10.20 H new ATOM 0 HG23 THR A 8 -0.696 -13.636 1.738 1.00 10.20 H new ATOM 50 N PRO A 9 -0.911 -10.200 1.818 1.00 6.86 N ATOM 51 CA PRO A 9 -2.001 -9.213 1.898 1.00 7.96 C ATOM 52 C PRO A 9 -3.153 -9.732 2.754 1.00 7.37 C ATOM 53 O PRO A 9 -3.470 -10.922 2.719 1.00 8.01 O ATOM 54 CB PRO A 9 -2.475 -9.071 0.446 1.00 7.65 C ATOM 55 CG PRO A 9 -1.376 -9.604 -0.394 1.00 15.32 C ATOM 56 CD PRO A 9 -0.600 -10.598 0.433 1.00 8.26 C ATOM 0 HA PRO A 9 -1.707 -8.379 2.298 1.00 7.96 H new ATOM 0 HB2 PRO A 9 -3.296 -9.565 0.299 1.00 7.65 H new ATOM 0 HB3 PRO A 9 -2.659 -8.144 0.230 1.00 7.65 H new ATOM 0 HG2 PRO A 9 -1.733 -10.029 -1.190 1.00 15.32 H new ATOM 0 HG3 PRO A 9 -0.797 -8.885 -0.692 1.00 15.32 H new ATOM 0 HD2 PRO A 9 -0.878 -11.509 0.251 1.00 8.26 H new ATOM 0 HD3 PRO A 9 0.352 -10.550 0.251 1.00 8.26 H new ATOM 57 N ILE A 10 -3.786 -8.845 3.514 1.00 7.05 N ATOM 58 CA ILE A 10 -4.875 -9.269 4.400 1.00 8.07 C ATOM 59 C ILE A 10 -6.195 -9.497 3.670 1.00 9.27 C ATOM 60 O ILE A 10 -7.099 -10.133 4.210 1.00 10.39 O ATOM 61 CB ILE A 10 -5.109 -8.294 5.569 1.00 7.77 C ATOM 62 CG1 ILE A 10 -5.579 -6.924 5.058 1.00 8.39 C ATOM 63 CG2 ILE A 10 -3.860 -8.201 6.436 1.00 9.58 C ATOM 64 CD1 ILE A 10 -6.176 -6.033 6.148 1.00 10.90 C ATOM 0 H ILE A 10 -3.607 -8.004 3.535 1.00 7.05 H new ATOM 0 HA ILE A 10 -4.573 -10.119 4.756 1.00 8.07 H new ATOM 0 HB ILE A 10 -5.823 -8.637 6.129 1.00 7.77 H new ATOM 0 HG12 ILE A 10 -4.828 -6.464 4.651 1.00 8.39 H new ATOM 0 HG13 ILE A 10 -6.241 -7.057 4.362 1.00 8.39 H new ATOM 0 HG21 ILE A 10 -4.019 -7.585 7.168 1.00 9.58 H new ATOM 0 HG22 ILE A 10 -3.647 -9.078 6.792 1.00 9.58 H new ATOM 0 HG23 ILE A 10 -3.117 -7.881 5.900 1.00 9.58 H new ATOM 0 HD11 ILE A 10 -6.451 -5.187 5.760 1.00 10.90 H new ATOM 0 HD12 ILE A 10 -6.945 -6.474 6.541 1.00 10.90 H new ATOM 0 HD13 ILE A 10 -5.510 -5.872 6.835 1.00 10.90 H new ATOM 65 N ASP A 11 -6.305 -8.970 2.456 1.00 7.96 N ATOM 66 CA ASP A 11 -7.539 -9.069 1.686 1.00 8.52 C ATOM 67 C ASP A 11 -7.243 -8.887 0.207 1.00 8.19 C ATOM 68 O ASP A 11 -6.082 -8.712 -0.190 1.00 8.88 O ATOM 69 CB ASP A 11 -8.605 -8.072 2.181 1.00 8.55 C ATOM 70 CG ASP A 11 -8.178 -6.614 2.066 1.00 10.68 C ATOM 71 OD1 ASP A 11 -8.729 -5.782 2.832 1.00 12.33 O ATOM 72 OD2 ASP A 11 -7.311 -6.283 1.225 1.00 9.74 O ATOM 0 H ASP A 11 -5.671 -8.547 2.057 1.00 7.96 H new ATOM 0 HA ASP A 11 -7.910 -9.955 1.818 1.00 8.52 H new ATOM 0 HB2 ASP A 11 -9.420 -8.203 1.672 1.00 8.55 H new ATOM 0 HB3 ASP A 11 -8.814 -8.268 3.108 1.00 8.55 H new ATOM 73 N SER A 12 -8.289 -8.923 -0.612 1.00 10.26 N ATOM 74 CA SER A 12 -8.133 -8.923 -2.063 1.00 9.45 C ATOM 75 C SER A 12 -7.697 -7.572 -2.635 1.00 10.06 C ATOM 76 O SER A 12 -7.375 -7.479 -3.824 1.00 12.79 O ATOM 77 CB SER A 12 -9.428 -9.382 -2.734 1.00 11.43 C ATOM 78 OG SER A 12 -10.454 -8.448 -2.480 1.00 14.24 O ATOM 0 H SER A 12 -9.106 -8.948 -0.344 1.00 10.26 H new ATOM 0 HA SER A 12 -7.416 -9.547 -2.258 1.00 9.45 H new ATOM 0 HB2 SER A 12 -9.292 -9.474 -3.690 1.00 11.43 H new ATOM 0 HB3 SER A 12 -9.684 -10.256 -2.399 1.00 11.43 H new ATOM 0 HG SER A 12 -10.713 -8.112 -3.205 1.00 14.24 H new ATOM 79 N LEU A 13 -7.671 -6.545 -1.788 1.00 8.53 N ATOM 80 CA LEU A 13 -7.280 -5.201 -2.204 1.00 10.31 C ATOM 81 C LEU A 13 -5.863 -4.806 -1.780 1.00 9.86 C ATOM 82 O LEU A 13 -5.423 -3.695 -2.076 1.00 10.73 O ATOM 83 CB LEU A 13 -8.249 -4.166 -1.632 1.00 13.27 C ATOM 84 CG LEU A 13 -9.721 -4.260 -2.014 1.00 14.78 C ATOM 85 CD1 LEU A 13 -10.499 -3.184 -1.276 1.00 14.34 C ATOM 86 CD2 LEU A 13 -9.892 -4.111 -3.519 1.00 15.28 C ATOM 0 H LEU A 13 -7.880 -6.608 -0.956 1.00 8.53 H new ATOM 0 HA LEU A 13 -7.305 -5.216 -3.174 1.00 10.31 H new ATOM 0 HB2 LEU A 13 -8.192 -4.211 -0.665 1.00 13.27 H new ATOM 0 HB3 LEU A 13 -7.932 -3.288 -1.894 1.00 13.27 H new ATOM 0 HG LEU A 13 -10.064 -5.131 -1.761 1.00 14.78 H new ATOM 0 HD11 LEU A 13 -11.437 -3.240 -1.516 1.00 14.34 H new ATOM 0 HD12 LEU A 13 -10.402 -3.313 -0.319 1.00 14.34 H new ATOM 0 HD13 LEU A 13 -10.155 -2.311 -1.520 1.00 14.34 H new ATOM 0 HD21 LEU A 13 -10.833 -4.173 -3.746 1.00 15.28 H new ATOM 0 HD22 LEU A 13 -9.548 -3.249 -3.800 1.00 15.28 H new ATOM 0 HD23 LEU A 13 -9.404 -4.816 -3.972 1.00 15.28 H new ATOM 87 N ASP A 14 -5.152 -5.689 -1.078 1.00 8.39 N ATOM 88 CA ASP A 14 -3.859 -5.338 -0.484 1.00 8.59 C ATOM 89 C ASP A 14 -4.025 -4.161 0.485 1.00 8.31 C ATOM 90 O ASP A 14 -3.216 -3.235 0.496 1.00 9.25 O ATOM 91 CB ASP A 14 -2.808 -4.965 -1.545 1.00 9.72 C ATOM 92 CG ASP A 14 -2.488 -6.092 -2.509 1.00 9.22 C ATOM 93 OD1 ASP A 14 -2.872 -7.256 -2.270 1.00 11.19 O ATOM 94 OD2 ASP A 14 -1.831 -5.804 -3.532 1.00 9.48 O ATOM 0 H ASP A 14 -5.401 -6.499 -0.933 1.00 8.39 H new ATOM 0 HA ASP A 14 -3.545 -6.125 -0.011 1.00 8.59 H new ATOM 0 HB2 ASP A 14 -3.126 -4.200 -2.049 1.00 9.72 H new ATOM 0 HB3 ASP A 14 -1.992 -4.691 -1.098 1.00 9.72 H new ATOM 95 N ASP A 15 -5.063 -4.179 1.308 1.00 8.58 N ATOM 96 CA ASP A 15 -5.256 -3.070 2.244 1.00 9.26 C ATOM 97 C ASP A 15 -4.117 -2.963 3.262 1.00 8.73 C ATOM 98 O ASP A 15 -3.768 -1.874 3.746 1.00 11.29 O ATOM 99 CB ASP A 15 -6.608 -3.176 2.948 1.00 11.32 C ATOM 100 CG ASP A 15 -7.747 -2.690 2.080 1.00 15.03 C ATOM 101 OD1 ASP A 15 -7.586 -1.623 1.448 1.00 17.26 O ATOM 102 OD2 ASP A 15 -8.791 -3.373 2.011 1.00 14.15 O ATOM 0 H ASP A 15 -5.654 -4.802 1.345 1.00 8.58 H new ATOM 0 HA ASP A 15 -5.246 -2.254 1.720 1.00 9.26 H new ATOM 0 HB2 ASP A 15 -6.767 -4.099 3.200 1.00 11.32 H new ATOM 0 HB3 ASP A 15 -6.585 -2.658 3.768 1.00 11.32 H new ATOM 103 N ALA A 16 -3.529 -4.107 3.582 1.00 8.42 N ATOM 104 CA ALA A 16 -2.377 -4.157 4.465 1.00 7.84 C ATOM 105 C ALA A 16 -1.749 -5.519 4.292 1.00 6.51 C ATOM 106 O ALA A 16 -2.304 -6.386 3.601 1.00 7.72 O ATOM 107 CB ALA A 16 -2.785 -3.926 5.923 1.00 9.91 C ATOM 0 H ALA A 16 -3.787 -4.875 3.293 1.00 8.42 H new ATOM 0 HA ALA A 16 -1.747 -3.455 4.240 1.00 7.84 H new ATOM 0 HB1 ALA A 16 -1.998 -3.965 6.489 1.00 9.91 H new ATOM 0 HB2 ALA A 16 -3.202 -3.054 6.008 1.00 9.91 H new ATOM 0 HB3 ALA A 16 -3.413 -4.613 6.196 1.00 9.91 H new ATOM 108 N TYR A 17 -0.593 -5.705 4.914 1.00 6.55 N ATOM 109 CA TYR A 17 0.159 -6.944 4.809 1.00 7.20 C ATOM 110 C TYR A 17 0.464 -7.455 6.211 1.00 5.98 C ATOM 111 O TYR A 17 0.778 -6.664 7.109 1.00 7.47 O ATOM 112 CB TYR A 17 1.464 -6.710 4.033 1.00 7.69 C ATOM 113 CG TYR A 17 1.250 -6.300 2.588 1.00 6.62 C ATOM 114 CD1 TYR A 17 1.399 -7.215 1.560 1.00 8.32 C ATOM 115 CD2 TYR A 17 0.902 -4.995 2.257 1.00 8.34 C ATOM 116 CE1 TYR A 17 1.190 -6.845 0.229 1.00 7.02 C ATOM 117 CE2 TYR A 17 0.694 -4.622 0.950 1.00 8.53 C ATOM 118 CZ TYR A 17 0.849 -5.543 -0.053 1.00 7.49 C ATOM 119 OH TYR A 17 0.635 -5.141 -1.349 1.00 8.05 O ATOM 0 H TYR A 17 -0.221 -5.111 5.412 1.00 6.55 H new ATOM 0 HA TYR A 17 -0.365 -7.604 4.329 1.00 7.20 H new ATOM 0 HB2 TYR A 17 1.979 -6.022 4.483 1.00 7.69 H new ATOM 0 HB3 TYR A 17 1.994 -7.522 4.055 1.00 7.69 H new ATOM 0 HD1 TYR A 17 1.642 -8.090 1.759 1.00 8.32 H new ATOM 0 HD2 TYR A 17 0.808 -4.363 2.932 1.00 8.34 H new ATOM 0 HE1 TYR A 17 1.280 -7.469 -0.455 1.00 7.02 H new ATOM 0 HE2 TYR A 17 0.449 -3.748 0.747 1.00 8.53 H new ATOM 0 HH TYR A 17 0.928 -5.726 -1.876 1.00 8.05 H new ATOM 120 N ILE A 18 0.368 -8.771 6.394 1.00 5.61 N ATOM 121 CA ILE A 18 0.707 -9.394 7.669 1.00 5.04 C ATOM 122 C ILE A 18 1.860 -10.376 7.548 1.00 6.12 C ATOM 123 O ILE A 18 1.987 -11.102 6.554 1.00 6.76 O ATOM 124 CB ILE A 18 -0.498 -10.102 8.337 1.00 4.92 C ATOM 125 CG1 ILE A 18 -1.232 -11.020 7.355 1.00 5.64 C ATOM 126 CG2 ILE A 18 -1.436 -9.066 8.949 1.00 7.19 C ATOM 127 CD1 ILE A 18 -2.326 -11.878 8.011 1.00 7.39 C ATOM 0 H ILE A 18 0.107 -9.322 5.788 1.00 5.61 H new ATOM 0 HA ILE A 18 0.981 -8.657 8.238 1.00 5.04 H new ATOM 0 HB ILE A 18 -0.163 -10.671 9.048 1.00 4.92 H new ATOM 0 HG12 ILE A 18 -1.632 -10.479 6.656 1.00 5.64 H new ATOM 0 HG13 ILE A 18 -0.587 -11.604 6.927 1.00 5.64 H new ATOM 0 HG21 ILE A 18 -2.188 -9.516 9.365 1.00 7.19 H new ATOM 0 HG22 ILE A 18 -0.958 -8.551 9.617 1.00 7.19 H new ATOM 0 HG23 ILE A 18 -1.760 -8.472 8.254 1.00 7.19 H new ATOM 0 HD11 ILE A 18 -2.749 -12.433 7.338 1.00 7.39 H new ATOM 0 HD12 ILE A 18 -1.929 -12.443 8.693 1.00 7.39 H new ATOM 0 HD13 ILE A 18 -2.991 -11.300 8.417 1.00 7.39 H new ATOM 128 N THR A 19 2.680 -10.403 8.593 1.00 4.59 N ATOM 129 CA THR A 19 3.891 -11.207 8.636 1.00 5.42 C ATOM 130 C THR A 19 3.899 -11.962 9.964 1.00 5.37 C ATOM 131 O THR A 19 3.695 -11.352 11.009 1.00 5.25 O ATOM 132 CB THR A 19 5.121 -10.291 8.544 1.00 6.20 C ATOM 133 OG1 THR A 19 4.996 -9.417 7.407 1.00 6.30 O ATOM 134 CG2 THR A 19 6.397 -11.111 8.409 1.00 7.46 C ATOM 0 H THR A 19 2.544 -9.946 9.309 1.00 4.59 H new ATOM 0 HA THR A 19 3.917 -11.831 7.893 1.00 5.42 H new ATOM 0 HB THR A 19 5.170 -9.766 9.358 1.00 6.20 H new ATOM 0 HG1 THR A 19 5.755 -9.135 7.186 1.00 6.30 H new ATOM 0 HG21 THR A 19 7.160 -10.515 8.352 1.00 7.46 H new ATOM 0 HG22 THR A 19 6.494 -11.688 9.183 1.00 7.46 H new ATOM 0 HG23 THR A 19 6.350 -11.653 7.606 1.00 7.46 H new ATOM 135 N PRO A 20 4.123 -13.293 9.940 1.00 4.66 N ATOM 136 CA PRO A 20 4.103 -14.046 11.196 1.00 5.45 C ATOM 137 C PRO A 20 5.334 -13.737 12.024 1.00 4.75 C ATOM 138 O PRO A 20 6.448 -13.635 11.494 1.00 5.34 O ATOM 139 CB PRO A 20 4.125 -15.507 10.731 1.00 6.72 C ATOM 140 CG PRO A 20 4.810 -15.465 9.393 1.00 5.98 C ATOM 141 CD PRO A 20 4.370 -14.163 8.770 1.00 5.30 C ATOM 0 HA PRO A 20 3.339 -13.833 11.755 1.00 5.45 H new ATOM 0 HB2 PRO A 20 4.607 -16.070 11.357 1.00 6.72 H new ATOM 0 HB3 PRO A 20 3.228 -15.868 10.657 1.00 6.72 H new ATOM 0 HG2 PRO A 20 5.774 -15.499 9.491 1.00 5.98 H new ATOM 0 HG3 PRO A 20 4.554 -16.222 8.843 1.00 5.98 H new ATOM 0 HD2 PRO A 20 5.054 -13.795 8.188 1.00 5.30 H new ATOM 0 HD3 PRO A 20 3.571 -14.275 8.232 1.00 5.30 H new ATOM 142 N VAL A 21 5.117 -13.604 13.329 1.00 4.77 N ATOM 143 CA VAL A 21 6.158 -13.263 14.289 1.00 5.35 C ATOM 144 C VAL A 21 6.021 -14.193 15.488 1.00 5.36 C ATOM 145 O VAL A 21 4.914 -14.383 16.001 1.00 6.02 O ATOM 146 CB VAL A 21 5.995 -11.807 14.753 1.00 4.92 C ATOM 147 CG1 VAL A 21 7.027 -11.432 15.814 1.00 6.41 C ATOM 148 CG2 VAL A 21 6.094 -10.868 13.551 1.00 6.86 C ATOM 0 H VAL A 21 4.343 -13.712 13.687 1.00 4.77 H new ATOM 0 HA VAL A 21 7.031 -13.362 13.877 1.00 5.35 H new ATOM 0 HB VAL A 21 5.119 -11.717 15.160 1.00 4.92 H new ATOM 0 HG11 VAL A 21 6.895 -10.509 16.083 1.00 6.41 H new ATOM 0 HG12 VAL A 21 6.923 -12.011 16.585 1.00 6.41 H new ATOM 0 HG13 VAL A 21 7.920 -11.537 15.449 1.00 6.41 H new ATOM 0 HG21 VAL A 21 5.991 -9.950 13.848 1.00 6.86 H new ATOM 0 HG22 VAL A 21 6.960 -10.975 13.127 1.00 6.86 H new ATOM 0 HG23 VAL A 21 5.394 -11.082 12.914 1.00 6.86 H new ATOM 149 N GLN A 22 7.128 -14.801 15.904 1.00 5.14 N ATOM 150 CA GLN A 22 7.130 -15.659 17.086 1.00 5.31 C ATOM 151 C GLN A 22 7.476 -14.852 18.334 1.00 6.38 C ATOM 152 O GLN A 22 8.512 -14.176 18.381 1.00 6.86 O ATOM 153 CB GLN A 22 8.137 -16.793 16.913 1.00 5.14 C ATOM 154 CG GLN A 22 7.668 -17.934 15.995 1.00 5.25 C ATOM 155 CD GLN A 22 7.516 -17.531 14.532 1.00 6.27 C ATOM 156 OE1 GLN A 22 8.427 -16.960 13.929 1.00 6.37 O ATOM 157 NE2 GLN A 22 6.370 -17.869 13.943 1.00 6.78 N ATOM 0 H GLN A 22 7.891 -14.730 15.514 1.00 5.14 H new ATOM 0 HA GLN A 22 6.242 -16.034 17.191 1.00 5.31 H new ATOM 0 HB2 GLN A 22 8.961 -16.426 16.557 1.00 5.14 H new ATOM 0 HB3 GLN A 22 8.344 -17.161 17.786 1.00 5.14 H new ATOM 0 HG2 GLN A 22 8.302 -18.666 16.055 1.00 5.25 H new ATOM 0 HG3 GLN A 22 6.817 -18.268 16.319 1.00 5.25 H new ATOM 0 HE21 GLN A 22 5.756 -18.267 14.394 1.00 6.78 H new ATOM 0 HE22 GLN A 22 6.245 -17.689 13.111 1.00 6.78 H new ATOM 158 N ILE A 23 6.633 -14.953 19.359 1.00 6.65 N ATOM 159 CA ILE A 23 6.853 -14.213 20.604 1.00 6.97 C ATOM 160 C ILE A 23 6.803 -15.178 21.779 1.00 6.39 C ATOM 161 O ILE A 23 5.858 -15.948 21.904 1.00 6.92 O ATOM 162 CB ILE A 23 5.785 -13.108 20.808 1.00 6.85 C ATOM 163 CG1 ILE A 23 5.686 -12.216 19.565 1.00 6.63 C ATOM 164 CG2 ILE A 23 6.109 -12.266 22.041 1.00 8.60 C ATOM 165 CD1 ILE A 23 4.572 -11.168 19.633 1.00 9.46 C ATOM 0 H ILE A 23 5.927 -15.444 19.356 1.00 6.65 H new ATOM 0 HA ILE A 23 7.723 -13.787 20.550 1.00 6.97 H new ATOM 0 HB ILE A 23 4.927 -13.539 20.947 1.00 6.85 H new ATOM 0 HG12 ILE A 23 6.534 -11.764 19.435 1.00 6.63 H new ATOM 0 HG13 ILE A 23 5.542 -12.777 18.787 1.00 6.63 H new ATOM 0 HG21 ILE A 23 5.431 -11.581 22.153 1.00 8.60 H new ATOM 0 HG22 ILE A 23 6.125 -12.835 22.826 1.00 8.60 H new ATOM 0 HG23 ILE A 23 6.976 -11.847 21.928 1.00 8.60 H new ATOM 0 HD11 ILE A 23 4.570 -10.644 18.817 1.00 9.46 H new ATOM 0 HD12 ILE A 23 3.715 -11.612 19.734 1.00 9.46 H new ATOM 0 HD13 ILE A 23 4.724 -10.583 20.392 1.00 9.46 H new ATOM 166 N GLY A 24 7.809 -15.144 22.643 1.00 6.96 N ATOM 167 CA GLY A 24 7.746 -15.914 23.874 1.00 7.87 C ATOM 168 C GLY A 24 8.250 -17.339 23.789 1.00 8.31 C ATOM 169 O GLY A 24 8.700 -17.810 22.740 1.00 8.51 O ATOM 0 H GLY A 24 8.529 -14.686 22.536 1.00 6.96 H new ATOM 0 HA2 GLY A 24 8.258 -15.448 24.553 1.00 7.87 H new ATOM 0 HA3 GLY A 24 6.825 -15.933 24.177 1.00 7.87 H new ATOM 170 N THR A 25 8.177 -18.026 24.924 1.00 7.95 N ATOM 171 CA THR A 25 8.670 -19.395 25.045 1.00 9.67 C ATOM 172 C THR A 25 7.661 -20.192 25.858 1.00 8.78 C ATOM 173 O THR A 25 7.397 -19.844 27.009 1.00 10.38 O ATOM 174 CB THR A 25 10.010 -19.414 25.811 1.00 9.08 C ATOM 175 OG1 THR A 25 10.931 -18.482 25.225 1.00 10.08 O ATOM 176 CG2 THR A 25 10.618 -20.815 25.807 1.00 12.06 C ATOM 0 H THR A 25 7.839 -17.711 25.649 1.00 7.95 H new ATOM 0 HA THR A 25 8.794 -19.770 24.159 1.00 9.67 H new ATOM 0 HB THR A 25 9.836 -19.155 26.730 1.00 9.08 H new ATOM 0 HG1 THR A 25 10.878 -17.746 25.625 1.00 10.08 H new ATOM 0 HG21 THR A 25 11.458 -20.805 26.293 1.00 12.06 H new ATOM 0 HG22 THR A 25 10.006 -21.435 26.233 1.00 12.06 H new ATOM 0 HG23 THR A 25 10.777 -21.096 24.892 1.00 12.06 H new ATOM 177 N PRO A 26 7.057 -21.241 25.272 1.00 9.14 N ATOM 178 CA PRO A 26 7.159 -21.636 23.864 1.00 9.82 C ATOM 179 C PRO A 26 6.597 -20.541 22.964 1.00 8.22 C ATOM 180 O PRO A 26 5.876 -19.651 23.425 1.00 9.00 O ATOM 181 CB PRO A 26 6.271 -22.882 23.788 1.00 10.55 C ATOM 182 CG PRO A 26 5.277 -22.693 24.888 1.00 10.50 C ATOM 183 CD PRO A 26 6.070 -22.058 25.999 1.00 11.00 C ATOM 0 HA PRO A 26 8.072 -21.792 23.576 1.00 9.82 H new ATOM 0 HB2 PRO A 26 5.835 -22.954 22.925 1.00 10.55 H new ATOM 0 HB3 PRO A 26 6.788 -23.693 23.913 1.00 10.55 H new ATOM 0 HG2 PRO A 26 4.542 -22.125 24.608 1.00 10.50 H new ATOM 0 HG3 PRO A 26 4.892 -23.539 25.166 1.00 10.50 H new ATOM 0 HD2 PRO A 26 5.510 -21.516 26.576 1.00 11.00 H new ATOM 0 HD3 PRO A 26 6.498 -22.723 26.561 1.00 11.00 H new ATOM 184 N ALA A 27 6.928 -20.608 21.682 1.00 7.48 N ATOM 185 CA ALA A 27 6.533 -19.571 20.748 1.00 6.61 C ATOM 186 C ALA A 27 5.026 -19.406 20.664 1.00 7.77 C ATOM 187 O ALA A 27 4.266 -20.388 20.608 1.00 7.95 O ATOM 188 CB ALA A 27 7.086 -19.866 19.371 1.00 8.37 C ATOM 0 H ALA A 27 7.383 -21.249 21.334 1.00 7.48 H new ATOM 0 HA ALA A 27 6.902 -18.738 21.082 1.00 6.61 H new ATOM 0 HB1 ALA A 27 6.815 -19.166 18.757 1.00 8.37 H new ATOM 0 HB2 ALA A 27 8.054 -19.903 19.412 1.00 8.37 H new ATOM 0 HB3 ALA A 27 6.743 -20.719 19.060 1.00 8.37 H new ATOM 189 N GLN A 28 4.604 -18.147 20.635 1.00 6.83 N ATOM 190 CA GLN A 28 3.243 -17.770 20.292 1.00 7.57 C ATOM 191 C GLN A 28 3.337 -16.985 18.996 1.00 6.78 C ATOM 192 O GLN A 28 3.983 -15.939 18.955 1.00 7.91 O ATOM 193 CB GLN A 28 2.635 -16.896 21.387 1.00 6.49 C ATOM 194 CG GLN A 28 2.557 -17.609 22.733 1.00 8.19 C ATOM 195 CD GLN A 28 1.956 -16.739 23.821 1.00 6.93 C ATOM 196 OE1 GLN A 28 0.999 -16.006 23.593 1.00 8.10 O ATOM 197 NE2 GLN A 28 2.524 -16.816 25.012 1.00 8.16 N ATOM 0 H GLN A 28 5.112 -17.477 20.818 1.00 6.83 H new ATOM 0 HA GLN A 28 2.677 -18.552 20.198 1.00 7.57 H new ATOM 0 HB2 GLN A 28 3.165 -16.089 21.483 1.00 6.49 H new ATOM 0 HB3 GLN A 28 1.744 -16.621 21.119 1.00 6.49 H new ATOM 0 HG2 GLN A 28 2.026 -18.415 22.638 1.00 8.19 H new ATOM 0 HG3 GLN A 28 3.447 -17.886 23.000 1.00 8.19 H new ATOM 0 HE21 GLN A 28 3.194 -17.341 25.136 1.00 8.16 H new ATOM 0 HE22 GLN A 28 2.224 -16.341 25.663 1.00 8.16 H new ATOM 198 N THR A 29 2.732 -17.495 17.930 1.00 5.53 N ATOM 199 CA THR A 29 2.850 -16.846 16.623 1.00 5.56 C ATOM 200 C THR A 29 1.674 -15.912 16.391 1.00 5.61 C ATOM 201 O THR A 29 0.517 -16.336 16.424 1.00 6.87 O ATOM 202 CB THR A 29 2.943 -17.873 15.486 1.00 5.41 C ATOM 203 OG1 THR A 29 4.117 -18.667 15.675 1.00 6.10 O ATOM 204 CG2 THR A 29 3.024 -17.158 14.141 1.00 6.58 C ATOM 0 H THR A 29 2.252 -18.209 17.938 1.00 5.53 H new ATOM 0 HA THR A 29 3.672 -16.331 16.624 1.00 5.56 H new ATOM 0 HB THR A 29 2.154 -18.438 15.495 1.00 5.41 H new ATOM 0 HG1 THR A 29 4.105 -19.316 15.142 1.00 6.10 H new ATOM 0 HG21 THR A 29 3.082 -17.814 13.429 1.00 6.58 H new ATOM 0 HG22 THR A 29 2.231 -16.614 14.015 1.00 6.58 H new ATOM 0 HG23 THR A 29 3.811 -16.591 14.123 1.00 6.58 H new ATOM 205 N LEU A 30 1.979 -14.631 16.198 1.00 5.45 N ATOM 206 CA LEU A 30 0.980 -13.617 15.872 1.00 4.68 C ATOM 207 C LEU A 30 1.305 -13.030 14.507 1.00 5.57 C ATOM 208 O LEU A 30 2.472 -12.939 14.121 1.00 6.71 O ATOM 209 CB LEU A 30 0.964 -12.496 16.924 1.00 6.76 C ATOM 210 CG LEU A 30 0.115 -12.709 18.183 1.00 6.84 C ATOM 211 CD1 LEU A 30 0.636 -13.853 19.034 1.00 7.63 C ATOM 212 CD2 LEU A 30 0.072 -11.418 19.001 1.00 7.96 C ATOM 0 H LEU A 30 2.780 -14.323 16.253 1.00 5.45 H new ATOM 0 HA LEU A 30 0.104 -14.033 15.862 1.00 4.68 H new ATOM 0 HB2 LEU A 30 1.879 -12.338 17.205 1.00 6.76 H new ATOM 0 HB3 LEU A 30 0.656 -11.685 16.490 1.00 6.76 H new ATOM 0 HG LEU A 30 -0.782 -12.946 17.900 1.00 6.84 H new ATOM 0 HD11 LEU A 30 0.074 -13.955 19.818 1.00 7.63 H new ATOM 0 HD12 LEU A 30 0.622 -14.674 18.517 1.00 7.63 H new ATOM 0 HD13 LEU A 30 1.546 -13.662 19.311 1.00 7.63 H new ATOM 0 HD21 LEU A 30 -0.466 -11.556 19.796 1.00 7.96 H new ATOM 0 HD22 LEU A 30 0.973 -11.168 19.260 1.00 7.96 H new ATOM 0 HD23 LEU A 30 -0.319 -10.709 18.467 1.00 7.96 H new ATOM 213 N ASN A 31 0.271 -12.618 13.790 1.00 5.01 N ATOM 214 CA ASN A 31 0.443 -11.996 12.487 1.00 6.09 C ATOM 215 C ASN A 31 0.427 -10.484 12.609 1.00 5.31 C ATOM 216 O ASN A 31 -0.618 -9.891 12.889 1.00 5.98 O ATOM 217 CB ASN A 31 -0.639 -12.491 11.536 1.00 6.54 C ATOM 218 CG ASN A 31 -0.547 -13.979 11.302 1.00 5.91 C ATOM 219 OD1 ASN A 31 0.543 -14.550 11.313 1.00 7.57 O ATOM 220 ND2 ASN A 31 -1.690 -14.618 11.097 1.00 6.62 N ATOM 0 H ASN A 31 -0.548 -12.690 14.043 1.00 5.01 H new ATOM 0 HA ASN A 31 1.307 -12.247 12.124 1.00 6.09 H new ATOM 0 HB2 ASN A 31 -1.512 -12.275 11.900 1.00 6.54 H new ATOM 0 HB3 ASN A 31 -0.561 -12.026 10.689 1.00 6.54 H new ATOM 0 HD21 ASN A 31 -1.690 -15.468 10.964 1.00 6.62 H new ATOM 0 HD22 ASN A 31 -2.432 -14.183 11.097 1.00 6.62 H new ATOM 221 N LEU A 32 1.600 -9.880 12.431 1.00 5.18 N ATOM 222 CA LEU A 32 1.764 -8.453 12.691 1.00 4.97 C ATOM 223 C LEU A 32 1.884 -7.647 11.407 1.00 4.44 C ATOM 224 O LEU A 32 2.359 -8.136 10.378 1.00 5.42 O ATOM 225 CB LEU A 32 2.986 -8.199 13.582 1.00 5.62 C ATOM 226 CG LEU A 32 3.008 -8.968 14.906 1.00 5.75 C ATOM 227 CD1 LEU A 32 4.167 -8.487 15.771 1.00 6.97 C ATOM 228 CD2 LEU A 32 1.692 -8.834 15.647 1.00 6.90 C ATOM 0 H LEU A 32 2.312 -10.279 12.160 1.00 5.18 H new ATOM 0 HA LEU A 32 0.964 -8.158 13.153 1.00 4.97 H new ATOM 0 HB2 LEU A 32 3.785 -8.426 13.081 1.00 5.62 H new ATOM 0 HB3 LEU A 32 3.033 -7.250 13.776 1.00 5.62 H new ATOM 0 HG LEU A 32 3.135 -9.909 14.707 1.00 5.75 H new ATOM 0 HD11 LEU A 32 4.173 -8.979 16.607 1.00 6.97 H new ATOM 0 HD12 LEU A 32 5.004 -8.635 15.303 1.00 6.97 H new ATOM 0 HD13 LEU A 32 4.063 -7.540 15.954 1.00 6.97 H new ATOM 0 HD21 LEU A 32 1.737 -9.331 16.479 1.00 6.90 H new ATOM 0 HD22 LEU A 32 1.522 -7.898 15.838 1.00 6.90 H new ATOM 0 HD23 LEU A 32 0.974 -9.187 15.099 1.00 6.90 H new ATOM 229 N ASP A 33 1.435 -6.400 11.477 1.00 5.07 N ATOM 230 CA ASP A 33 1.557 -5.447 10.382 1.00 4.83 C ATOM 231 C ASP A 33 2.905 -4.735 10.541 1.00 5.02 C ATOM 232 O ASP A 33 3.070 -3.924 11.463 1.00 5.87 O ATOM 233 CB ASP A 33 0.384 -4.464 10.499 1.00 7.14 C ATOM 234 CG ASP A 33 0.298 -3.482 9.359 1.00 6.94 C ATOM 235 OD1 ASP A 33 1.229 -3.376 8.540 1.00 7.50 O ATOM 236 OD2 ASP A 33 -0.735 -2.774 9.311 1.00 8.59 O ATOM 0 H ASP A 33 1.045 -6.079 12.173 1.00 5.07 H new ATOM 0 HA ASP A 33 1.527 -5.869 9.509 1.00 4.83 H new ATOM 0 HB2 ASP A 33 -0.445 -4.966 10.546 1.00 7.14 H new ATOM 0 HB3 ASP A 33 0.466 -3.974 11.332 1.00 7.14 H new ATOM 237 N PHE A 34 3.877 -5.062 9.689 1.00 5.09 N ATOM 238 CA PHE A 34 5.198 -4.418 9.726 1.00 5.46 C ATOM 239 C PHE A 34 5.070 -2.997 9.173 1.00 5.49 C ATOM 240 O PHE A 34 4.669 -2.796 8.021 1.00 6.57 O ATOM 241 CB PHE A 34 6.219 -5.197 8.895 1.00 5.79 C ATOM 242 CG PHE A 34 6.751 -6.441 9.551 1.00 4.91 C ATOM 243 CD1 PHE A 34 7.992 -6.926 9.171 1.00 6.91 C ATOM 244 CD2 PHE A 34 6.032 -7.133 10.524 1.00 5.69 C ATOM 245 CE1 PHE A 34 8.520 -8.078 9.738 1.00 7.76 C ATOM 246 CE2 PHE A 34 6.559 -8.289 11.104 1.00 6.11 C ATOM 247 CZ PHE A 34 7.808 -8.757 10.710 1.00 6.06 C ATOM 0 H PHE A 34 3.793 -5.659 9.076 1.00 5.09 H new ATOM 0 HA PHE A 34 5.509 -4.400 10.645 1.00 5.46 H new ATOM 0 HB2 PHE A 34 5.810 -5.442 8.050 1.00 5.79 H new ATOM 0 HB3 PHE A 34 6.964 -4.611 8.690 1.00 5.79 H new ATOM 0 HD1 PHE A 34 8.481 -6.471 8.524 1.00 6.91 H new ATOM 0 HD2 PHE A 34 5.196 -6.823 10.789 1.00 5.69 H new ATOM 0 HE1 PHE A 34 9.351 -8.393 9.465 1.00 7.76 H new ATOM 0 HE2 PHE A 34 6.075 -8.746 11.754 1.00 6.11 H new ATOM 0 HZ PHE A 34 8.163 -9.524 11.099 1.00 6.06 H new ATOM 248 N ASP A 35 5.395 -2.016 10.006 1.00 6.15 N ATOM 249 CA ASP A 35 5.050 -0.633 9.735 1.00 6.88 C ATOM 250 C ASP A 35 6.277 0.270 9.791 1.00 4.67 C ATOM 251 O ASP A 35 6.735 0.623 10.878 1.00 5.17 O ATOM 252 CB ASP A 35 4.023 -0.150 10.761 1.00 6.33 C ATOM 253 CG ASP A 35 3.597 1.276 10.525 1.00 8.40 C ATOM 254 OD1 ASP A 35 3.903 1.802 9.438 1.00 8.44 O ATOM 255 OD2 ASP A 35 2.941 1.853 11.417 1.00 9.73 O ATOM 0 H ASP A 35 5.821 -2.136 10.743 1.00 6.15 H new ATOM 0 HA ASP A 35 4.678 -0.588 8.840 1.00 6.88 H new ATOM 0 HB2 ASP A 35 3.244 -0.726 10.730 1.00 6.33 H new ATOM 0 HB3 ASP A 35 4.399 -0.229 11.652 1.00 6.33 H new ATOM 256 N THR A 36 6.810 0.654 8.632 1.00 4.81 N ATOM 257 CA THR A 36 7.980 1.528 8.610 1.00 5.97 C ATOM 258 C THR A 36 7.637 2.975 8.956 1.00 5.41 C ATOM 259 O THR A 36 8.536 3.825 8.976 1.00 6.97 O ATOM 260 CB THR A 36 8.743 1.473 7.271 1.00 5.37 C ATOM 261 OG1 THR A 36 7.896 1.947 6.212 1.00 5.83 O ATOM 262 CG2 THR A 36 9.193 0.063 6.963 1.00 6.85 C ATOM 0 H THR A 36 6.514 0.423 7.858 1.00 4.81 H new ATOM 0 HA THR A 36 8.566 1.182 9.301 1.00 5.97 H new ATOM 0 HB THR A 36 9.528 2.039 7.343 1.00 5.37 H new ATOM 0 HG1 THR A 36 8.132 2.722 5.990 1.00 5.83 H new ATOM 0 HG21 THR A 36 9.670 0.052 6.118 1.00 6.85 H new ATOM 0 HG22 THR A 36 9.780 -0.251 7.669 1.00 6.85 H new ATOM 0 HG23 THR A 36 8.419 -0.518 6.904 1.00 6.85 H new ATOM 263 N GLY A 37 6.363 3.237 9.255 1.00 6.44 N ATOM 264 CA GLY A 37 5.897 4.538 9.701 1.00 6.87 C ATOM 265 C GLY A 37 5.592 4.670 11.184 1.00 7.37 C ATOM 266 O GLY A 37 5.000 5.660 11.609 1.00 10.51 O ATOM 0 H GLY A 37 5.738 2.648 9.201 1.00 6.44 H new ATOM 0 HA2 GLY A 37 6.568 5.198 9.468 1.00 6.87 H new ATOM 0 HA3 GLY A 37 5.095 4.761 9.204 1.00 6.87 H new ATOM 267 N SER A 38 5.982 3.685 11.984 1.00 6.00 N ATOM 268 CA SER A 38 5.837 3.800 13.434 1.00 6.99 C ATOM 269 C SER A 38 6.896 2.946 14.107 1.00 5.96 C ATOM 270 O SER A 38 7.617 2.216 13.438 1.00 6.15 O ATOM 271 CB SER A 38 4.431 3.403 13.889 1.00 8.51 C ATOM 272 OG SER A 38 4.188 2.023 13.665 1.00 7.32 O ATOM 0 H SER A 38 6.330 2.947 11.713 1.00 6.00 H new ATOM 0 HA SER A 38 5.962 4.727 13.692 1.00 6.99 H new ATOM 0 HB2 SER A 38 4.325 3.603 14.832 1.00 8.51 H new ATOM 0 HB3 SER A 38 3.773 3.931 13.411 1.00 8.51 H new ATOM 0 HG SER A 38 3.665 1.932 13.014 1.00 7.32 H new ATOM 273 N SER A 39 6.978 3.022 15.431 1.00 6.58 N ATOM 274 CA SER A 39 8.127 2.449 16.124 1.00 5.56 C ATOM 275 C SER A 39 7.772 1.685 17.387 1.00 6.26 C ATOM 276 O SER A 39 8.611 1.515 18.278 1.00 7.00 O ATOM 277 CB SER A 39 9.163 3.535 16.403 1.00 7.28 C ATOM 278 OG SER A 39 9.471 4.177 15.175 1.00 7.41 O ATOM 0 H SER A 39 6.392 3.393 15.939 1.00 6.58 H new ATOM 0 HA SER A 39 8.506 1.785 15.527 1.00 5.56 H new ATOM 0 HB2 SER A 39 8.817 4.177 17.043 1.00 7.28 H new ATOM 0 HB3 SER A 39 9.963 3.148 16.793 1.00 7.28 H new ATOM 0 HG SER A 39 10.169 4.636 15.266 1.00 7.41 H new ATOM 279 N ASP A 40 6.532 1.208 17.454 1.00 6.04 N ATOM 280 CA ASP A 40 6.073 0.380 18.567 1.00 6.60 C ATOM 281 C ASP A 40 5.769 -1.031 18.061 1.00 6.52 C ATOM 282 O ASP A 40 5.162 -1.199 16.988 1.00 7.42 O ATOM 283 CB ASP A 40 4.814 0.973 19.229 1.00 8.77 C ATOM 284 CG ASP A 40 5.099 2.215 20.065 1.00 8.02 C ATOM 285 OD1 ASP A 40 5.806 3.121 19.587 1.00 8.40 O ATOM 286 OD2 ASP A 40 4.619 2.275 21.215 1.00 8.95 O ATOM 0 H ASP A 40 5.932 1.355 16.855 1.00 6.04 H new ATOM 0 HA ASP A 40 6.778 0.351 19.233 1.00 6.60 H new ATOM 0 HB2 ASP A 40 4.169 1.196 18.540 1.00 8.77 H new ATOM 0 HB3 ASP A 40 4.405 0.298 19.793 1.00 8.77 H new ATOM 287 N LEU A 41 6.206 -2.038 18.812 1.00 6.67 N ATOM 288 CA LEU A 41 5.788 -3.412 18.562 1.00 5.16 C ATOM 289 C LEU A 41 4.716 -3.682 19.601 1.00 6.45 C ATOM 290 O LEU A 41 5.030 -3.819 20.790 1.00 6.60 O ATOM 291 CB LEU A 41 6.970 -4.378 18.711 1.00 6.69 C ATOM 292 CG LEU A 41 6.776 -5.815 18.202 1.00 6.28 C ATOM 293 CD1 LEU A 41 8.083 -6.592 18.294 1.00 8.23 C ATOM 294 CD2 LEU A 41 5.681 -6.561 18.953 1.00 7.88 C ATOM 0 H LEU A 41 6.747 -1.945 19.474 1.00 6.67 H new ATOM 0 HA LEU A 41 5.456 -3.540 17.660 1.00 5.16 H new ATOM 0 HB2 LEU A 41 7.731 -3.995 18.246 1.00 6.69 H new ATOM 0 HB3 LEU A 41 7.205 -4.422 19.651 1.00 6.69 H new ATOM 0 HG LEU A 41 6.498 -5.747 17.275 1.00 6.28 H new ATOM 0 HD11 LEU A 41 7.946 -7.496 17.970 1.00 8.23 H new ATOM 0 HD12 LEU A 41 8.759 -6.154 17.753 1.00 8.23 H new ATOM 0 HD13 LEU A 41 8.378 -6.621 19.218 1.00 8.23 H new ATOM 0 HD21 LEU A 41 5.598 -7.459 18.596 1.00 7.88 H new ATOM 0 HD22 LEU A 41 5.908 -6.608 19.895 1.00 7.88 H new ATOM 0 HD23 LEU A 41 4.839 -6.092 18.847 1.00 7.88 H new ATOM 295 N TRP A 42 3.453 -3.705 19.181 1.00 5.44 N ATOM 296 CA TRP A 42 2.346 -3.926 20.119 1.00 5.11 C ATOM 297 C TRP A 42 1.441 -5.038 19.624 1.00 6.26 C ATOM 298 O TRP A 42 1.344 -5.276 18.414 1.00 6.25 O ATOM 299 CB TRP A 42 1.555 -2.640 20.430 1.00 6.56 C ATOM 300 CG TRP A 42 0.638 -2.129 19.337 1.00 7.49 C ATOM 301 CD1 TRP A 42 0.901 -1.125 18.452 1.00 7.62 C ATOM 302 CD2 TRP A 42 -0.694 -2.579 19.049 1.00 6.92 C ATOM 303 NE1 TRP A 42 -0.176 -0.928 17.626 1.00 8.12 N ATOM 304 CE2 TRP A 42 -1.168 -1.810 17.970 1.00 6.95 C ATOM 305 CE3 TRP A 42 -1.532 -3.556 19.604 1.00 8.50 C ATOM 306 CZ2 TRP A 42 -2.443 -1.988 17.432 1.00 8.61 C ATOM 307 CZ3 TRP A 42 -2.790 -3.738 19.066 1.00 8.62 C ATOM 308 CH2 TRP A 42 -3.234 -2.955 17.990 1.00 9.86 C ATOM 0 H TRP A 42 3.213 -3.596 18.362 1.00 5.44 H new ATOM 0 HA TRP A 42 2.738 -4.204 20.962 1.00 5.11 H new ATOM 0 HB2 TRP A 42 1.022 -2.796 21.225 1.00 6.56 H new ATOM 0 HB3 TRP A 42 2.189 -1.939 20.647 1.00 6.56 H new ATOM 0 HD1 TRP A 42 1.696 -0.644 18.414 1.00 7.62 H new ATOM 0 HE1 TRP A 42 -0.222 -0.346 16.995 1.00 8.12 H new ATOM 0 HE3 TRP A 42 -1.245 -4.073 20.322 1.00 8.50 H new ATOM 0 HZ2 TRP A 42 -2.744 -1.469 16.721 1.00 8.61 H new ATOM 0 HZ3 TRP A 42 -3.351 -4.389 19.422 1.00 8.62 H new ATOM 0 HH2 TRP A 42 -4.087 -3.097 17.648 1.00 9.86 H new ATOM 309 N VAL A 43 0.803 -5.732 20.559 1.00 6.34 N ATOM 310 CA VAL A 43 0.022 -6.911 20.230 1.00 6.05 C ATOM 311 C VAL A 43 -1.292 -6.951 20.996 1.00 7.73 C ATOM 312 O VAL A 43 -1.386 -6.468 22.136 1.00 7.36 O ATOM 313 CB VAL A 43 0.818 -8.192 20.529 1.00 6.14 C ATOM 314 CG1 VAL A 43 2.044 -8.278 19.620 1.00 7.43 C ATOM 315 CG2 VAL A 43 1.224 -8.252 21.990 1.00 7.59 C ATOM 0 H VAL A 43 0.812 -5.533 21.396 1.00 6.34 H new ATOM 0 HA VAL A 43 -0.175 -6.862 19.281 1.00 6.05 H new ATOM 0 HB VAL A 43 0.247 -8.955 20.349 1.00 6.14 H new ATOM 0 HG11 VAL A 43 2.537 -9.089 19.818 1.00 7.43 H new ATOM 0 HG12 VAL A 43 1.759 -8.291 18.693 1.00 7.43 H new ATOM 0 HG13 VAL A 43 2.614 -7.508 19.772 1.00 7.43 H new ATOM 0 HG21 VAL A 43 1.724 -9.067 22.154 1.00 7.59 H new ATOM 0 HG22 VAL A 43 1.778 -7.485 22.204 1.00 7.59 H new ATOM 0 HG23 VAL A 43 0.430 -8.242 22.547 1.00 7.59 H new ATOM 316 N PHE A 44 -2.315 -7.494 20.353 1.00 5.91 N ATOM 317 CA PHE A 44 -3.494 -7.960 21.068 1.00 6.14 C ATOM 318 C PHE A 44 -3.015 -8.979 22.096 1.00 6.94 C ATOM 319 O PHE A 44 -2.089 -9.755 21.838 1.00 7.02 O ATOM 320 CB PHE A 44 -4.483 -8.620 20.104 1.00 6.91 C ATOM 321 CG PHE A 44 -5.368 -7.642 19.367 1.00 6.98 C ATOM 322 CD1 PHE A 44 -4.897 -6.923 18.274 1.00 7.57 C ATOM 323 CD2 PHE A 44 -6.688 -7.464 19.762 1.00 9.15 C ATOM 324 CE1 PHE A 44 -5.735 -6.038 17.594 1.00 8.58 C ATOM 325 CE2 PHE A 44 -7.526 -6.587 19.088 1.00 8.07 C ATOM 326 CZ PHE A 44 -7.052 -5.875 18.007 1.00 8.42 C ATOM 0 H PHE A 44 -2.347 -7.602 19.500 1.00 5.91 H new ATOM 0 HA PHE A 44 -3.950 -7.217 21.494 1.00 6.14 H new ATOM 0 HB2 PHE A 44 -3.988 -9.145 19.456 1.00 6.91 H new ATOM 0 HB3 PHE A 44 -5.042 -9.237 20.601 1.00 6.91 H new ATOM 0 HD1 PHE A 44 -4.017 -7.033 17.994 1.00 7.57 H new ATOM 0 HD2 PHE A 44 -7.016 -7.941 20.490 1.00 9.15 H new ATOM 0 HE1 PHE A 44 -5.413 -5.558 16.866 1.00 8.58 H new ATOM 0 HE2 PHE A 44 -8.407 -6.480 19.366 1.00 8.07 H new ATOM 0 HZ PHE A 44 -7.613 -5.287 17.555 1.00 8.42 H new ATOM 327 N SER A 45 -3.650 -9.002 23.262 1.00 8.18 N ATOM 328 CA SER A 45 -3.144 -9.816 24.354 1.00 9.02 C ATOM 329 C SER A 45 -4.257 -10.294 25.273 1.00 8.25 C ATOM 330 O SER A 45 -5.418 -9.911 25.128 1.00 8.78 O ATOM 331 CB SER A 45 -2.131 -9.011 25.169 1.00 9.84 C ATOM 332 OG SER A 45 -2.811 -8.066 25.978 1.00 11.28 O ATOM 0 H SER A 45 -4.366 -8.559 23.438 1.00 8.18 H new ATOM 0 HA SER A 45 -2.721 -10.597 23.964 1.00 9.02 H new ATOM 0 HB2 SER A 45 -1.604 -9.606 25.725 1.00 9.84 H new ATOM 0 HB3 SER A 45 -1.513 -8.556 24.575 1.00 9.84 H new ATOM 0 HG SER A 45 -2.256 -7.531 26.311 1.00 11.28 H new ATOM 333 N SER A 46 -3.874 -11.122 26.240 1.00 9.49 N ATOM 334 CA SER A 46 -4.790 -11.574 27.283 1.00 11.20 C ATOM 335 C SER A 46 -5.256 -10.413 28.161 1.00 12.55 C ATOM 336 O SER A 46 -6.197 -10.564 28.937 1.00 14.07 O ATOM 337 CB SER A 46 -4.110 -12.632 28.150 1.00 12.38 C ATOM 338 OG SER A 46 -2.875 -12.152 28.642 1.00 12.48 O ATOM 0 H SER A 46 -3.077 -11.437 26.310 1.00 9.49 H new ATOM 0 HA SER A 46 -5.569 -11.956 26.849 1.00 11.20 H new ATOM 0 HB2 SER A 46 -4.688 -12.871 28.891 1.00 12.38 H new ATOM 0 HB3 SER A 46 -3.966 -13.439 27.631 1.00 12.38 H new ATOM 0 HG SER A 46 -2.998 -11.759 29.374 1.00 12.48 H new ATOM 339 N GLU A 47 -4.594 -9.266 28.040 1.00 9.90 N ATOM 340 CA GLU A 47 -4.942 -8.068 28.800 1.00 9.97 C ATOM 341 C GLU A 47 -5.890 -7.146 28.043 1.00 10.09 C ATOM 342 O GLU A 47 -6.390 -6.171 28.604 1.00 12.11 O ATOM 343 CB GLU A 47 -3.678 -7.299 29.182 1.00 11.69 C ATOM 344 CG GLU A 47 -2.693 -8.146 29.972 1.00 14.25 C ATOM 345 CD GLU A 47 -1.419 -7.405 30.324 1.00 16.99 C ATOM 346 OE1 GLU A 47 -1.038 -6.490 29.566 1.00 17.00 O ATOM 347 OE2 GLU A 47 -0.796 -7.735 31.360 1.00 18.60 O ATOM 0 H GLU A 47 -3.925 -9.160 27.510 1.00 9.90 H new ATOM 0 HA GLU A 47 -5.404 -8.368 29.599 1.00 9.97 H new ATOM 0 HB2 GLU A 47 -3.246 -6.974 28.377 1.00 11.69 H new ATOM 0 HB3 GLU A 47 -3.923 -6.521 29.707 1.00 11.69 H new ATOM 0 HG2 GLU A 47 -3.119 -8.451 30.788 1.00 14.25 H new ATOM 0 HG3 GLU A 47 -2.469 -8.937 29.457 1.00 14.25 H new ATOM 348 N THR A 48 -6.144 -7.436 26.771 1.00 9.16 N ATOM 349 CA THR A 48 -6.957 -6.533 25.967 1.00 10.36 C ATOM 350 C THR A 48 -8.420 -6.630 26.389 1.00 10.95 C ATOM 351 O THR A 48 -8.954 -7.731 26.514 1.00 11.41 O ATOM 352 CB THR A 48 -6.825 -6.836 24.457 1.00 8.78 C ATOM 353 OG1 THR A 48 -5.437 -6.881 24.096 1.00 8.52 O ATOM 354 CG2 THR A 48 -7.538 -5.766 23.630 1.00 9.55 C ATOM 0 H THR A 48 -5.861 -8.137 26.361 1.00 9.16 H new ATOM 0 HA THR A 48 -6.634 -5.631 26.119 1.00 10.36 H new ATOM 0 HB THR A 48 -7.238 -7.695 24.274 1.00 8.78 H new ATOM 0 HG1 THR A 48 -5.001 -6.361 24.591 1.00 8.52 H new ATOM 0 HG21 THR A 48 -7.446 -5.971 22.686 1.00 9.55 H new ATOM 0 HG22 THR A 48 -8.479 -5.748 23.866 1.00 9.55 H new ATOM 0 HG23 THR A 48 -7.143 -4.899 23.812 1.00 9.55 H new ATOM 355 N THR A 49 -9.049 -5.478 26.610 1.00 10.78 N ATOM 356 CA THR A 49 -10.480 -5.408 26.904 1.00 13.72 C ATOM 357 C THR A 49 -11.241 -6.408 26.038 1.00 13.54 C ATOM 358 O THR A 49 -11.196 -6.340 24.809 1.00 11.63 O ATOM 359 CB THR A 49 -11.018 -3.986 26.655 1.00 14.86 C ATOM 360 OG1 THR A 49 -10.300 -3.053 27.472 1.00 16.80 O ATOM 361 CG2 THR A 49 -12.500 -3.899 26.982 1.00 17.33 C ATOM 0 H THR A 49 -8.657 -4.713 26.594 1.00 10.78 H new ATOM 0 HA THR A 49 -10.611 -5.629 27.839 1.00 13.72 H new ATOM 0 HB THR A 49 -10.894 -3.773 25.717 1.00 14.86 H new ATOM 0 HG1 THR A 49 -9.528 -2.943 27.159 1.00 16.80 H new ATOM 0 HG21 THR A 49 -12.815 -2.997 26.818 1.00 17.33 H new ATOM 0 HG22 THR A 49 -12.992 -4.520 26.422 1.00 17.33 H new ATOM 0 HG23 THR A 49 -12.640 -4.125 27.915 1.00 17.33 H new ATOM 362 N ALA A 50 -11.954 -7.328 26.683 1.00 14.64 N ATOM 363 CA ALA A 50 -12.573 -8.450 25.991 1.00 14.47 C ATOM 364 C ALA A 50 -13.472 -8.038 24.826 1.00 14.14 C ATOM 365 O ALA A 50 -13.443 -8.652 23.758 1.00 15.52 O ATOM 366 CB ALA A 50 -13.347 -9.315 26.982 1.00 20.99 C ATOM 0 H ALA A 50 -12.091 -7.318 27.532 1.00 14.64 H new ATOM 0 HA ALA A 50 -11.848 -8.962 25.599 1.00 14.47 H new ATOM 0 HB1 ALA A 50 -13.755 -10.059 26.512 1.00 20.99 H new ATOM 0 HB2 ALA A 50 -12.740 -9.654 27.659 1.00 20.99 H new ATOM 0 HB3 ALA A 50 -14.038 -8.782 27.406 1.00 20.99 H new ATOM 367 N SER A 51 -14.280 -7.006 25.033 1.00 15.78 N ATOM 368 CA SER A 51 -15.204 -6.555 24.002 1.00 15.10 C ATOM 369 C SER A 51 -14.491 -5.940 22.799 1.00 15.85 C ATOM 370 O SER A 51 -15.114 -5.657 21.772 1.00 17.05 O ATOM 371 CB SER A 51 -16.184 -5.537 24.584 1.00 17.10 C ATOM 372 OG SER A 51 -15.495 -4.391 25.045 1.00 20.66 O ATOM 0 H SER A 51 -14.309 -6.553 25.764 1.00 15.78 H new ATOM 0 HA SER A 51 -15.680 -7.340 23.690 1.00 15.10 H new ATOM 0 HB2 SER A 51 -16.832 -5.281 23.909 1.00 17.10 H new ATOM 0 HB3 SER A 51 -16.679 -5.939 25.315 1.00 17.10 H new ATOM 0 HG SER A 51 -15.776 -4.183 25.809 1.00 20.66 H new ATOM 373 N GLU A 52 -13.188 -5.715 22.933 1.00 13.21 N ATOM 374 CA GLU A 52 -12.409 -5.084 21.870 1.00 12.94 C ATOM 375 C GLU A 52 -11.592 -6.111 21.094 1.00 11.94 C ATOM 376 O GLU A 52 -10.831 -5.754 20.200 1.00 12.52 O ATOM 377 CB GLU A 52 -11.517 -3.975 22.438 1.00 12.90 C ATOM 378 CG GLU A 52 -12.327 -2.862 23.101 1.00 13.26 C ATOM 379 CD GLU A 52 -11.479 -1.723 23.649 1.00 19.14 C ATOM 380 OE1 GLU A 52 -10.248 -1.885 23.798 1.00 15.50 O ATOM 381 OE2 GLU A 52 -12.057 -0.653 23.937 1.00 20.94 O ATOM 0 H GLU A 52 -12.734 -5.921 23.634 1.00 13.21 H new ATOM 0 HA GLU A 52 -13.030 -4.679 21.245 1.00 12.94 H new ATOM 0 HB2 GLU A 52 -10.904 -4.356 23.086 1.00 12.90 H new ATOM 0 HB3 GLU A 52 -10.978 -3.599 21.725 1.00 12.90 H new ATOM 0 HG2 GLU A 52 -12.956 -2.503 22.455 1.00 13.26 H new ATOM 0 HG3 GLU A 52 -12.849 -3.242 23.825 1.00 13.26 H new ATOM 382 N VAL A 53 -11.745 -7.380 21.452 1.00 10.53 N ATOM 383 CA VAL A 53 -11.129 -8.480 20.710 1.00 12.33 C ATOM 384 C VAL A 53 -12.203 -9.210 19.916 1.00 11.98 C ATOM 385 O VAL A 53 -13.218 -9.637 20.482 1.00 15.23 O ATOM 386 CB VAL A 53 -10.434 -9.483 21.650 1.00 11.79 C ATOM 387 CG1 VAL A 53 -9.732 -10.584 20.847 1.00 11.26 C ATOM 388 CG2 VAL A 53 -9.459 -8.761 22.554 1.00 12.39 C ATOM 0 H VAL A 53 -12.208 -7.631 22.132 1.00 10.53 H new ATOM 0 HA VAL A 53 -10.458 -8.104 20.119 1.00 12.33 H new ATOM 0 HB VAL A 53 -11.107 -9.907 22.205 1.00 11.79 H new ATOM 0 HG11 VAL A 53 -9.301 -11.204 21.456 1.00 11.26 H new ATOM 0 HG12 VAL A 53 -10.385 -11.060 20.310 1.00 11.26 H new ATOM 0 HG13 VAL A 53 -9.065 -10.186 20.266 1.00 11.26 H new ATOM 0 HG21 VAL A 53 -9.027 -9.401 23.141 1.00 12.39 H new ATOM 0 HG22 VAL A 53 -8.788 -8.314 22.015 1.00 12.39 H new ATOM 0 HG23 VAL A 53 -9.936 -8.105 23.086 1.00 12.39 H new ATOM 389 N ASP A 54 -11.982 -9.353 18.614 1.00 11.38 N ATOM 390 CA ASP A 54 -12.942 -10.011 17.736 1.00 13.63 C ATOM 391 C ASP A 54 -12.213 -10.831 16.669 1.00 10.70 C ATOM 392 O ASP A 54 -12.131 -10.427 15.509 1.00 13.33 O ATOM 393 CB ASP A 54 -13.862 -8.960 17.096 1.00 14.56 C ATOM 394 CG ASP A 54 -14.991 -9.572 16.285 1.00 18.14 C ATOM 395 OD1 ASP A 54 -15.172 -10.803 16.339 1.00 19.53 O ATOM 396 OD2 ASP A 54 -15.699 -8.808 15.594 1.00 22.47 O ATOM 0 H ASP A 54 -11.273 -9.072 18.216 1.00 11.38 H new ATOM 0 HA ASP A 54 -13.488 -10.621 18.257 1.00 13.63 H new ATOM 0 HB2 ASP A 54 -14.238 -8.400 17.793 1.00 14.56 H new ATOM 0 HB3 ASP A 54 -13.335 -8.383 16.522 1.00 14.56 H new ATOM 397 N GLY A 55 -11.667 -11.970 17.078 1.00 11.71 N ATOM 398 CA GLY A 55 -11.050 -12.903 16.150 1.00 11.97 C ATOM 399 C GLY A 55 -9.537 -12.852 16.055 1.00 10.77 C ATOM 400 O GLY A 55 -8.936 -13.737 15.441 1.00 11.29 O ATOM 0 H GLY A 55 -11.645 -12.222 17.900 1.00 11.71 H new ATOM 0 HA2 GLY A 55 -11.309 -13.802 16.405 1.00 11.97 H new ATOM 0 HA3 GLY A 55 -11.416 -12.741 15.267 1.00 11.97 H new ATOM 401 N GLN A 56 -8.918 -11.827 16.643 1.00 8.51 N ATOM 402 CA GLN A 56 -7.457 -11.723 16.635 1.00 8.23 C ATOM 403 C GLN A 56 -6.831 -12.824 17.477 1.00 9.80 C ATOM 404 O GLN A 56 -7.427 -13.303 18.441 1.00 11.23 O ATOM 405 CB GLN A 56 -6.993 -10.367 17.177 1.00 7.45 C ATOM 406 CG GLN A 56 -7.369 -9.166 16.319 1.00 8.69 C ATOM 407 CD GLN A 56 -8.800 -8.700 16.546 1.00 7.54 C ATOM 408 OE1 GLN A 56 -9.476 -9.132 17.490 1.00 9.11 O ATOM 409 NE2 GLN A 56 -9.263 -7.806 15.681 1.00 10.16 N ATOM 0 H GLN A 56 -9.322 -11.186 17.049 1.00 8.51 H new ATOM 0 HA GLN A 56 -7.171 -11.814 15.713 1.00 8.23 H new ATOM 0 HB2 GLN A 56 -7.367 -10.243 18.063 1.00 7.45 H new ATOM 0 HB3 GLN A 56 -6.028 -10.387 17.276 1.00 7.45 H new ATOM 0 HG2 GLN A 56 -6.761 -8.435 16.511 1.00 8.69 H new ATOM 0 HG3 GLN A 56 -7.253 -9.394 15.383 1.00 8.69 H new ATOM 0 HE21 GLN A 56 -8.763 -7.530 15.038 1.00 10.16 H new ATOM 0 HE22 GLN A 56 -10.063 -7.502 15.763 1.00 10.16 H new ATOM 410 N THR A 57 -5.614 -13.210 17.116 1.00 7.99 N ATOM 411 CA THR A 57 -4.808 -14.064 17.970 1.00 7.83 C ATOM 412 C THR A 57 -4.139 -13.196 19.025 1.00 7.91 C ATOM 413 O THR A 57 -3.625 -12.121 18.710 1.00 9.41 O ATOM 414 CB THR A 57 -3.755 -14.815 17.151 1.00 8.64 C ATOM 415 OG1 THR A 57 -4.422 -15.698 16.238 1.00 9.14 O ATOM 416 CG2 THR A 57 -2.813 -15.623 18.058 1.00 9.12 C ATOM 0 H THR A 57 -5.237 -12.986 16.376 1.00 7.99 H new ATOM 0 HA THR A 57 -5.375 -14.726 18.396 1.00 7.83 H new ATOM 0 HB THR A 57 -3.219 -14.169 16.666 1.00 8.64 H new ATOM 0 HG1 THR A 57 -4.184 -15.521 15.452 1.00 9.14 H new ATOM 0 HG21 THR A 57 -2.158 -16.087 17.513 1.00 9.12 H new ATOM 0 HG22 THR A 57 -2.358 -15.023 18.669 1.00 9.12 H new ATOM 0 HG23 THR A 57 -3.328 -16.270 18.565 1.00 9.12 H new ATOM 417 N ILE A 58 -4.163 -13.654 20.275 1.00 7.99 N ATOM 418 CA ILE A 58 -3.628 -12.873 21.380 1.00 9.36 C ATOM 419 C ILE A 58 -2.333 -13.451 21.945 1.00 8.49 C ATOM 420 O ILE A 58 -2.115 -14.661 21.926 1.00 9.70 O ATOM 421 CB ILE A 58 -4.654 -12.722 22.530 1.00 9.57 C ATOM 422 CG1 ILE A 58 -4.983 -14.081 23.158 1.00 12.29 C ATOM 423 CG2 ILE A 58 -5.909 -12.019 22.036 1.00 11.72 C ATOM 424 CD1 ILE A 58 -5.801 -13.979 24.446 1.00 14.28 C ATOM 0 H ILE A 58 -4.487 -14.418 20.502 1.00 7.99 H new ATOM 0 HA ILE A 58 -3.434 -12.001 21.003 1.00 9.36 H new ATOM 0 HB ILE A 58 -4.256 -12.172 23.223 1.00 9.57 H new ATOM 0 HG12 ILE A 58 -5.473 -14.616 22.514 1.00 12.29 H new ATOM 0 HG13 ILE A 58 -4.155 -14.551 23.346 1.00 12.29 H new ATOM 0 HG21 ILE A 58 -6.541 -11.932 22.767 1.00 11.72 H new ATOM 0 HG22 ILE A 58 -5.677 -11.138 21.704 1.00 11.72 H new ATOM 0 HG23 ILE A 58 -6.311 -12.538 21.322 1.00 11.72 H new ATOM 0 HD11 ILE A 58 -5.974 -14.869 24.791 1.00 14.28 H new ATOM 0 HD12 ILE A 58 -5.305 -13.468 25.105 1.00 14.28 H new ATOM 0 HD13 ILE A 58 -6.643 -13.535 24.260 1.00 14.28 H new ATOM 425 N TYR A 59 -1.468 -12.561 22.420 1.00 8.09 N ATOM 426 CA TYR A 59 -0.287 -12.914 23.197 1.00 6.96 C ATOM 427 C TYR A 59 -0.684 -13.027 24.665 1.00 7.92 C ATOM 428 O TYR A 59 -1.339 -12.132 25.209 1.00 8.59 O ATOM 429 CB TYR A 59 0.763 -11.814 23.017 1.00 7.47 C ATOM 430 CG TYR A 59 1.967 -11.832 23.930 1.00 7.25 C ATOM 431 CD1 TYR A 59 2.279 -10.719 24.705 1.00 7.93 C ATOM 432 CD2 TYR A 59 2.821 -12.928 23.979 1.00 7.91 C ATOM 433 CE1 TYR A 59 3.396 -10.700 25.511 1.00 8.60 C ATOM 434 CE2 TYR A 59 3.953 -12.920 24.790 1.00 8.10 C ATOM 435 CZ TYR A 59 4.229 -11.795 25.552 1.00 6.59 C ATOM 436 OH TYR A 59 5.337 -11.751 26.371 1.00 8.41 O ATOM 0 H TYR A 59 -1.554 -11.714 22.296 1.00 8.09 H new ATOM 0 HA TYR A 59 0.081 -13.761 22.899 1.00 6.96 H new ATOM 0 HB2 TYR A 59 1.082 -11.854 22.102 1.00 7.47 H new ATOM 0 HB3 TYR A 59 0.320 -10.958 23.126 1.00 7.47 H new ATOM 0 HD1 TYR A 59 1.723 -9.974 24.678 1.00 7.93 H new ATOM 0 HD2 TYR A 59 2.633 -13.678 23.462 1.00 7.91 H new ATOM 0 HE1 TYR A 59 3.587 -9.949 26.026 1.00 8.60 H new ATOM 0 HE2 TYR A 59 4.516 -13.659 24.820 1.00 8.10 H new ATOM 0 HH TYR A 59 5.884 -12.343 26.135 1.00 8.41 H new ATOM 437 N THR A 60 -0.301 -14.133 25.292 1.00 7.87 N ATOM 438 CA THR A 60 -0.565 -14.347 26.713 1.00 8.91 C ATOM 439 C THR A 60 0.770 -14.431 27.443 1.00 7.83 C ATOM 440 O THR A 60 1.404 -15.488 27.474 1.00 8.26 O ATOM 441 CB THR A 60 -1.370 -15.641 26.944 1.00 9.40 C ATOM 442 OG1 THR A 60 -2.596 -15.585 26.207 1.00 10.65 O ATOM 443 CG2 THR A 60 -1.696 -15.815 28.426 1.00 11.19 C ATOM 0 H THR A 60 0.118 -14.779 24.909 1.00 7.87 H new ATOM 0 HA THR A 60 -1.093 -13.608 27.053 1.00 8.91 H new ATOM 0 HB THR A 60 -0.833 -16.391 26.644 1.00 9.40 H new ATOM 0 HG1 THR A 60 -2.480 -15.918 25.445 1.00 10.65 H new ATOM 0 HG21 THR A 60 -2.202 -16.633 28.552 1.00 11.19 H new ATOM 0 HG22 THR A 60 -0.872 -15.863 28.935 1.00 11.19 H new ATOM 0 HG23 THR A 60 -2.222 -15.060 28.733 1.00 11.19 H new ATOM 444 N PRO A 61 1.222 -13.306 28.022 1.00 8.35 N ATOM 445 CA PRO A 61 2.561 -13.317 28.622 1.00 8.75 C ATOM 446 C PRO A 61 2.694 -14.309 29.776 1.00 8.88 C ATOM 447 O PRO A 61 3.780 -14.832 29.983 1.00 9.60 O ATOM 448 CB PRO A 61 2.769 -11.868 29.094 1.00 10.29 C ATOM 449 CG PRO A 61 1.422 -11.256 29.114 1.00 11.14 C ATOM 450 CD PRO A 61 0.587 -11.979 28.086 1.00 10.34 C ATOM 0 HA PRO A 61 3.233 -13.609 27.986 1.00 8.75 H new ATOM 0 HB2 PRO A 61 3.176 -11.843 29.974 1.00 10.29 H new ATOM 0 HB3 PRO A 61 3.361 -11.388 28.494 1.00 10.29 H new ATOM 0 HG2 PRO A 61 1.024 -11.334 29.995 1.00 11.14 H new ATOM 0 HG3 PRO A 61 1.473 -10.309 28.909 1.00 11.14 H new ATOM 0 HD2 PRO A 61 -0.343 -12.038 28.355 1.00 10.34 H new ATOM 0 HD3 PRO A 61 0.606 -11.529 27.227 1.00 10.34 H new ATOM 451 N SER A 62 1.604 -14.600 30.482 1.00 10.08 N ATOM 452 CA SER A 62 1.679 -15.536 31.604 1.00 10.27 C ATOM 453 C SER A 62 2.054 -16.951 31.163 1.00 11.73 C ATOM 454 O SER A 62 2.502 -17.762 31.973 1.00 14.92 O ATOM 455 CB SER A 62 0.374 -15.556 32.405 1.00 13.39 C ATOM 456 OG SER A 62 -0.693 -16.072 31.635 1.00 15.49 O ATOM 0 H SER A 62 0.823 -14.273 30.332 1.00 10.08 H new ATOM 0 HA SER A 62 2.390 -15.213 32.179 1.00 10.27 H new ATOM 0 HB2 SER A 62 0.490 -16.095 33.203 1.00 13.39 H new ATOM 0 HB3 SER A 62 0.159 -14.657 32.699 1.00 13.39 H new ATOM 0 HG SER A 62 -1.401 -15.663 31.827 1.00 15.49 H new ATOM 457 N LYS A 63 1.883 -17.239 29.877 1.00 9.75 N ATOM 458 CA LYS A 63 2.212 -18.555 29.325 1.00 9.89 C ATOM 459 C LYS A 63 3.616 -18.600 28.731 1.00 9.17 C ATOM 460 O LYS A 63 4.029 -19.628 28.190 1.00 10.71 O ATOM 461 CB LYS A 63 1.203 -18.956 28.271 1.00 12.33 C ATOM 0 H LYS A 63 1.574 -16.681 29.300 1.00 9.75 H new ATOM 0 HA LYS A 63 2.182 -19.184 30.063 1.00 9.89 H new ATOM 462 N SER A 64 4.348 -17.493 28.828 1.00 9.48 N ATOM 463 CA SER A 64 5.708 -17.427 28.307 1.00 8.12 C ATOM 464 C SER A 64 6.725 -17.397 29.433 1.00 9.35 C ATOM 465 O SER A 64 6.711 -16.487 30.257 1.00 10.35 O ATOM 466 CB SER A 64 5.888 -16.189 27.431 1.00 7.91 C ATOM 467 OG SER A 64 7.245 -16.073 27.045 1.00 8.40 O ATOM 0 H SER A 64 4.072 -16.766 29.195 1.00 9.48 H new ATOM 0 HA SER A 64 5.855 -18.224 27.774 1.00 8.12 H new ATOM 0 HB2 SER A 64 5.323 -16.253 26.645 1.00 7.91 H new ATOM 0 HB3 SER A 64 5.611 -15.396 27.916 1.00 7.91 H new ATOM 0 HG SER A 64 7.384 -15.304 26.737 1.00 8.40 H new ATOM 468 N THR A 65 7.618 -18.379 29.451 1.00 8.79 N ATOM 469 CA THR A 65 8.600 -18.486 30.526 1.00 9.27 C ATOM 470 C THR A 65 9.699 -17.438 30.440 1.00 11.69 C ATOM 471 O THR A 65 10.479 -17.271 31.379 1.00 14.93 O ATOM 472 CB THR A 65 9.218 -19.892 30.586 1.00 10.38 C ATOM 473 OG1 THR A 65 9.779 -20.225 29.310 1.00 13.63 O ATOM 474 CG2 THR A 65 8.158 -20.917 30.952 1.00 15.81 C ATOM 0 H THR A 65 7.673 -18.993 28.852 1.00 8.79 H new ATOM 0 HA THR A 65 8.109 -18.320 31.346 1.00 9.27 H new ATOM 0 HB THR A 65 9.914 -19.900 31.262 1.00 10.38 H new ATOM 0 HG1 THR A 65 10.616 -20.169 29.349 1.00 13.63 H new ATOM 0 HG21 THR A 65 8.559 -21.799 30.987 1.00 15.81 H new ATOM 0 HG22 THR A 65 7.782 -20.699 31.819 1.00 15.81 H new ATOM 0 HG23 THR A 65 7.455 -20.908 30.284 1.00 15.81 H new ATOM 475 N THR A 66 9.756 -16.732 29.315 1.00 9.73 N ATOM 476 CA THR A 66 10.754 -15.696 29.100 1.00 9.78 C ATOM 477 C THR A 66 10.169 -14.284 29.203 1.00 7.67 C ATOM 478 O THR A 66 10.905 -13.306 29.112 1.00 11.72 O ATOM 479 CB THR A 66 11.467 -15.874 27.737 1.00 9.94 C ATOM 480 OG1 THR A 66 10.507 -16.240 26.738 1.00 9.76 O ATOM 481 CG2 THR A 66 12.525 -16.971 27.823 1.00 10.89 C ATOM 0 H THR A 66 9.215 -16.842 28.655 1.00 9.73 H new ATOM 0 HA THR A 66 11.405 -15.797 29.812 1.00 9.78 H new ATOM 0 HB THR A 66 11.894 -15.035 27.503 1.00 9.94 H new ATOM 0 HG1 THR A 66 10.271 -15.556 26.312 1.00 9.76 H new ATOM 0 HG21 THR A 66 12.961 -17.069 26.962 1.00 10.89 H new ATOM 0 HG22 THR A 66 13.184 -16.733 28.493 1.00 10.89 H new ATOM 0 HG23 THR A 66 12.103 -17.809 28.068 1.00 10.89 H new ATOM 482 N ALA A 67 8.859 -14.171 29.396 1.00 8.33 N ATOM 483 CA ALA A 67 8.239 -12.850 29.512 1.00 9.11 C ATOM 484 C ALA A 67 8.519 -12.241 30.880 1.00 10.40 C ATOM 485 O ALA A 67 8.462 -12.929 31.900 1.00 12.61 O ATOM 486 CB ALA A 67 6.752 -12.945 29.271 1.00 9.73 C ATOM 0 H ALA A 67 8.316 -14.835 29.462 1.00 8.33 H new ATOM 0 HA ALA A 67 8.626 -12.271 28.837 1.00 9.11 H new ATOM 0 HB1 ALA A 67 6.354 -12.064 29.351 1.00 9.73 H new ATOM 0 HB2 ALA A 67 6.590 -13.293 28.380 1.00 9.73 H new ATOM 0 HB3 ALA A 67 6.355 -13.539 29.927 1.00 9.73 H new ATOM 487 N LYS A 68 8.825 -10.949 30.895 1.00 8.49 N ATOM 488 CA LYS A 68 9.027 -10.214 32.139 1.00 9.96 C ATOM 489 C LYS A 68 8.304 -8.876 32.032 1.00 9.38 C ATOM 490 O LYS A 68 8.468 -8.150 31.057 1.00 9.78 O ATOM 491 CB LYS A 68 10.503 -10.000 32.381 1.00 13.50 C ATOM 0 H LYS A 68 8.922 -10.473 30.185 1.00 8.49 H new ATOM 0 HA LYS A 68 8.670 -10.719 32.886 1.00 9.96 H new ATOM 492 N LEU A 69 7.487 -8.550 33.023 1.00 8.49 N ATOM 493 CA LEU A 69 6.813 -7.257 33.033 1.00 9.64 C ATOM 494 C LEU A 69 7.867 -6.167 33.136 1.00 8.45 C ATOM 495 O LEU A 69 8.760 -6.252 33.972 1.00 10.33 O ATOM 496 CB LEU A 69 5.846 -7.169 34.213 1.00 11.90 C ATOM 497 CG LEU A 69 4.988 -5.910 34.289 1.00 12.81 C ATOM 498 CD1 LEU A 69 4.055 -5.818 33.105 1.00 13.94 C ATOM 499 CD2 LEU A 69 4.190 -5.925 35.584 1.00 16.87 C ATOM 0 H LEU A 69 7.309 -9.057 33.695 1.00 8.49 H new ATOM 0 HA LEU A 69 6.301 -7.147 32.217 1.00 9.64 H new ATOM 0 HB2 LEU A 69 5.256 -7.938 34.182 1.00 11.90 H new ATOM 0 HB3 LEU A 69 6.359 -7.238 35.033 1.00 11.90 H new ATOM 0 HG LEU A 69 5.569 -5.134 34.271 1.00 12.81 H new ATOM 0 HD11 LEU A 69 3.521 -5.011 33.175 1.00 13.94 H new ATOM 0 HD12 LEU A 69 4.573 -5.792 32.286 1.00 13.94 H new ATOM 0 HD13 LEU A 69 3.470 -6.592 33.092 1.00 13.94 H new ATOM 0 HD21 LEU A 69 3.643 -5.126 35.636 1.00 16.87 H new ATOM 0 HD22 LEU A 69 3.619 -6.709 35.604 1.00 16.87 H new ATOM 0 HD23 LEU A 69 4.798 -5.950 36.339 1.00 16.87 H new ATOM 500 N LEU A 70 7.776 -5.156 32.281 1.00 7.72 N ATOM 501 CA LEU A 70 8.670 -4.009 32.381 1.00 7.12 C ATOM 502 C LEU A 70 8.014 -3.032 33.351 1.00 7.56 C ATOM 503 O LEU A 70 7.042 -2.355 33.007 1.00 8.19 O ATOM 504 CB LEU A 70 8.890 -3.372 31.011 1.00 8.06 C ATOM 505 CG LEU A 70 9.930 -2.248 30.973 1.00 8.48 C ATOM 506 CD1 LEU A 70 11.300 -2.729 31.451 1.00 11.09 C ATOM 507 CD2 LEU A 70 10.020 -1.669 29.571 1.00 10.36 C ATOM 0 H LEU A 70 7.206 -5.114 31.638 1.00 7.72 H new ATOM 0 HA LEU A 70 9.546 -4.273 32.702 1.00 7.12 H new ATOM 0 HB2 LEU A 70 9.161 -4.065 30.388 1.00 8.06 H new ATOM 0 HB3 LEU A 70 8.043 -3.020 30.694 1.00 8.06 H new ATOM 0 HG LEU A 70 9.641 -1.552 31.584 1.00 8.48 H new ATOM 0 HD11 LEU A 70 11.932 -1.994 31.414 1.00 11.09 H new ATOM 0 HD12 LEU A 70 11.230 -3.049 32.364 1.00 11.09 H new ATOM 0 HD13 LEU A 70 11.608 -3.449 30.879 1.00 11.09 H new ATOM 0 HD21 LEU A 70 10.680 -0.959 29.556 1.00 10.36 H new ATOM 0 HD22 LEU A 70 10.281 -2.366 28.949 1.00 10.36 H new ATOM 0 HD23 LEU A 70 9.156 -1.312 29.312 1.00 10.36 H new ATOM 508 N SER A 71 8.534 -3.005 34.574 1.00 8.59 N ATOM 509 CA SER A 71 7.878 -2.332 35.688 1.00 10.36 C ATOM 510 C SER A 71 7.629 -0.862 35.440 1.00 8.84 C ATOM 511 O SER A 71 8.565 -0.122 35.152 1.00 8.98 O ATOM 512 CB SER A 71 8.720 -2.497 36.951 1.00 14.28 C ATOM 513 OG SER A 71 8.012 -2.011 38.078 1.00 22.64 O ATOM 0 H SER A 71 9.281 -3.378 34.781 1.00 8.59 H new ATOM 0 HA SER A 71 7.009 -2.750 35.793 1.00 10.36 H new ATOM 0 HB2 SER A 71 8.943 -3.432 37.079 1.00 14.28 H new ATOM 0 HB3 SER A 71 9.557 -2.017 36.855 1.00 14.28 H new ATOM 0 HG SER A 71 8.388 -2.276 38.781 1.00 22.64 H new ATOM 514 N GLY A 72 6.367 -0.452 35.560 1.00 7.20 N ATOM 515 CA GLY A 72 5.981 0.942 35.456 1.00 8.26 C ATOM 516 C GLY A 72 5.855 1.476 34.047 1.00 9.00 C ATOM 517 O GLY A 72 5.484 2.628 33.859 1.00 10.54 O ATOM 0 H GLY A 72 5.708 -0.985 35.706 1.00 7.20 H new ATOM 0 HA2 GLY A 72 5.131 1.061 35.908 1.00 8.26 H new ATOM 0 HA3 GLY A 72 6.633 1.479 35.932 1.00 8.26 H new ATOM 518 N ALA A 73 6.157 0.648 33.053 1.00 8.17 N ATOM 519 CA ALA A 73 6.154 1.121 31.671 1.00 8.88 C ATOM 520 C ALA A 73 4.768 1.035 31.050 1.00 7.90 C ATOM 521 O ALA A 73 4.072 0.030 31.190 1.00 10.35 O ATOM 522 CB ALA A 73 7.158 0.347 30.836 1.00 10.21 C ATOM 0 H ALA A 73 6.364 -0.181 33.153 1.00 8.17 H new ATOM 0 HA ALA A 73 6.414 2.055 31.684 1.00 8.88 H new ATOM 0 HB1 ALA A 73 7.141 0.675 29.923 1.00 10.21 H new ATOM 0 HB2 ALA A 73 8.047 0.466 31.206 1.00 10.21 H new ATOM 0 HB3 ALA A 73 6.928 -0.595 30.845 1.00 10.21 H new ATOM 523 N THR A 74 4.363 2.101 30.378 1.00 8.18 N ATOM 524 CA THR A 74 3.107 2.094 29.636 1.00 8.93 C ATOM 525 C THR A 74 3.353 2.659 28.255 1.00 8.55 C ATOM 526 O THR A 74 4.404 3.230 27.985 1.00 9.34 O ATOM 527 CB THR A 74 2.000 2.924 30.334 1.00 10.30 C ATOM 528 OG1 THR A 74 2.417 4.289 30.459 1.00 11.25 O ATOM 529 CG2 THR A 74 1.692 2.354 31.710 1.00 13.58 C ATOM 0 H THR A 74 4.799 2.841 30.337 1.00 8.18 H new ATOM 0 HA THR A 74 2.796 1.176 29.590 1.00 8.93 H new ATOM 0 HB THR A 74 1.197 2.882 29.792 1.00 10.30 H new ATOM 0 HG1 THR A 74 2.177 4.719 29.779 1.00 11.25 H new ATOM 0 HG21 THR A 74 0.998 2.884 32.132 1.00 13.58 H new ATOM 0 HG22 THR A 74 1.388 1.437 31.620 1.00 13.58 H new ATOM 0 HG23 THR A 74 2.493 2.376 32.256 1.00 13.58 H new ATOM 530 N TRP A 75 2.366 2.512 27.381 1.00 8.69 N ATOM 531 CA TRP A 75 2.484 3.027 26.031 1.00 8.69 C ATOM 532 C TRP A 75 1.111 3.457 25.549 1.00 7.12 C ATOM 533 O TRP A 75 0.084 2.969 26.029 1.00 8.96 O ATOM 534 CB TRP A 75 3.078 1.970 25.090 1.00 8.75 C ATOM 535 CG TRP A 75 2.228 0.746 24.955 1.00 6.89 C ATOM 536 CD1 TRP A 75 2.162 -0.307 25.819 1.00 7.47 C ATOM 537 CD2 TRP A 75 1.303 0.455 23.898 1.00 7.02 C ATOM 538 NE1 TRP A 75 1.257 -1.236 25.367 1.00 7.91 N ATOM 539 CE2 TRP A 75 0.721 -0.793 24.186 1.00 7.64 C ATOM 540 CE3 TRP A 75 0.919 1.127 22.730 1.00 8.00 C ATOM 541 CZ2 TRP A 75 -0.224 -1.387 23.351 1.00 8.35 C ATOM 542 CZ3 TRP A 75 -0.024 0.539 21.903 1.00 7.43 C ATOM 543 CH2 TRP A 75 -0.588 -0.706 22.221 1.00 8.23 C ATOM 0 H TRP A 75 1.621 2.117 27.552 1.00 8.69 H new ATOM 0 HA TRP A 75 3.084 3.789 26.031 1.00 8.69 H new ATOM 0 HB2 TRP A 75 3.207 2.364 24.213 1.00 8.75 H new ATOM 0 HB3 TRP A 75 3.954 1.712 25.417 1.00 8.75 H new ATOM 0 HD1 TRP A 75 2.658 -0.385 26.602 1.00 7.47 H new ATOM 0 HE1 TRP A 75 1.059 -1.975 25.761 1.00 7.91 H new ATOM 0 HE3 TRP A 75 1.290 1.952 22.514 1.00 8.00 H new ATOM 0 HZ2 TRP A 75 -0.594 -2.216 23.554 1.00 8.35 H new ATOM 0 HZ3 TRP A 75 -0.287 0.976 21.125 1.00 7.43 H new ATOM 0 HH2 TRP A 75 -1.223 -1.076 21.651 1.00 8.23 H new ATOM 544 N SER A 76 1.107 4.376 24.592 1.00 8.08 N ATOM 545 CA SER A 76 -0.125 4.898 24.030 1.00 10.04 C ATOM 546 C SER A 76 0.219 5.534 22.701 1.00 9.17 C ATOM 547 O SER A 76 1.087 6.403 22.621 1.00 10.44 O ATOM 548 CB SER A 76 -0.733 5.938 24.967 1.00 10.89 C ATOM 549 OG SER A 76 -1.965 6.426 24.453 1.00 14.21 O ATOM 0 H SER A 76 1.821 4.714 24.251 1.00 8.08 H new ATOM 0 HA SER A 76 -0.774 4.187 23.912 1.00 10.04 H new ATOM 0 HB2 SER A 76 -0.876 5.545 25.842 1.00 10.89 H new ATOM 0 HB3 SER A 76 -0.113 6.675 25.085 1.00 10.89 H new ATOM 0 HG SER A 76 -2.235 5.917 23.842 1.00 14.21 H new ATOM 550 N ILE A 77 -0.449 5.080 21.648 1.00 9.64 N ATOM 551 CA ILE A 77 -0.133 5.564 20.320 1.00 11.63 C ATOM 552 C ILE A 77 -1.397 5.990 19.592 1.00 10.97 C ATOM 553 O ILE A 77 -2.445 5.344 19.699 1.00 12.09 O ATOM 554 CB ILE A 77 0.678 4.503 19.526 1.00 9.95 C ATOM 555 CG1 ILE A 77 1.248 5.084 18.235 1.00 12.39 C ATOM 556 CG2 ILE A 77 -0.150 3.260 19.269 1.00 11.52 C ATOM 557 CD1 ILE A 77 2.378 4.256 17.678 1.00 14.40 C ATOM 0 H ILE A 77 -1.081 4.498 21.683 1.00 9.64 H new ATOM 0 HA ILE A 77 0.430 6.350 20.398 1.00 11.63 H new ATOM 0 HB ILE A 77 1.433 4.238 20.074 1.00 9.95 H new ATOM 0 HG12 ILE A 77 0.542 5.148 17.573 1.00 12.39 H new ATOM 0 HG13 ILE A 77 1.564 5.986 18.402 1.00 12.39 H new ATOM 0 HG21 ILE A 77 0.379 2.616 18.773 1.00 11.52 H new ATOM 0 HG22 ILE A 77 -0.422 2.872 20.115 1.00 11.52 H new ATOM 0 HG23 ILE A 77 -0.937 3.496 18.754 1.00 11.52 H new ATOM 0 HD11 ILE A 77 2.706 4.664 16.861 1.00 14.40 H new ATOM 0 HD12 ILE A 77 3.097 4.211 18.328 1.00 14.40 H new ATOM 0 HD13 ILE A 77 2.059 3.360 17.486 1.00 14.40 H new ATOM 558 N SER A 78 -1.293 7.107 18.883 1.00 13.80 N ATOM 559 CA SER A 78 -2.372 7.603 18.044 1.00 16.52 C ATOM 560 C SER A 78 -1.821 7.751 16.640 1.00 17.15 C ATOM 561 O SER A 78 -0.938 8.573 16.399 1.00 20.06 O ATOM 562 CB SER A 78 -2.861 8.958 18.549 1.00 23.55 C ATOM 563 OG SER A 78 -3.208 8.899 19.922 1.00 32.03 O ATOM 0 H SER A 78 -0.589 7.601 18.876 1.00 13.80 H new ATOM 0 HA SER A 78 -3.122 6.988 18.062 1.00 16.52 H new ATOM 0 HB2 SER A 78 -2.169 9.624 18.416 1.00 23.55 H new ATOM 0 HB3 SER A 78 -3.630 9.241 18.030 1.00 23.55 H new ATOM 0 HG SER A 78 -3.472 9.654 20.177 1.00 32.03 H new ATOM 564 N TYR A 79 -2.335 6.943 15.723 1.00 13.78 N ATOM 565 CA TYR A 79 -1.857 6.935 14.349 1.00 15.90 C ATOM 566 C TYR A 79 -2.459 8.095 13.563 1.00 21.14 C ATOM 567 O TYR A 79 -3.464 8.680 13.974 1.00 22.72 O ATOM 568 CB TYR A 79 -2.153 5.580 13.691 1.00 15.59 C ATOM 569 CG TYR A 79 -1.398 4.443 14.358 1.00 11.84 C ATOM 570 CD1 TYR A 79 -2.014 3.620 15.298 1.00 12.42 C ATOM 571 CD2 TYR A 79 -0.057 4.216 14.065 1.00 10.83 C ATOM 572 CE1 TYR A 79 -1.315 2.588 15.920 1.00 9.80 C ATOM 573 CE2 TYR A 79 0.648 3.192 14.676 1.00 11.28 C ATOM 574 CZ TYR A 79 0.011 2.387 15.604 1.00 9.98 C ATOM 575 OH TYR A 79 0.698 1.368 16.229 1.00 9.21 O ATOM 0 H TYR A 79 -2.970 6.385 15.880 1.00 13.78 H new ATOM 0 HA TYR A 79 -0.895 7.057 14.349 1.00 15.90 H new ATOM 0 HB2 TYR A 79 -3.106 5.403 13.733 1.00 15.59 H new ATOM 0 HB3 TYR A 79 -1.913 5.619 12.752 1.00 15.59 H new ATOM 0 HD1 TYR A 79 -2.907 3.762 15.514 1.00 12.42 H new ATOM 0 HD2 TYR A 79 0.374 4.762 13.448 1.00 10.83 H new ATOM 0 HE1 TYR A 79 -1.739 2.041 16.541 1.00 9.80 H new ATOM 0 HE2 TYR A 79 1.542 3.047 14.464 1.00 11.28 H new ATOM 0 HH TYR A 79 1.516 1.430 16.049 1.00 9.21 H new ATOM 576 N GLY A 80 -1.831 8.436 12.444 1.00 18.46 N ATOM 577 CA GLY A 80 -2.278 9.557 11.637 1.00 21.27 C ATOM 578 C GLY A 80 -3.702 9.403 11.133 1.00 22.70 C ATOM 579 O GLY A 80 -4.381 10.397 10.873 1.00 32.47 O ATOM 0 H GLY A 80 -1.140 8.027 12.135 1.00 18.46 H new ATOM 0 HA2 GLY A 80 -2.213 10.371 12.161 1.00 21.27 H new ATOM 0 HA3 GLY A 80 -1.682 9.659 10.878 1.00 21.27 H new ATOM 580 N ASP A 81 -4.162 8.162 11.000 1.00 21.83 N ATOM 581 CA ASP A 81 -5.493 7.892 10.460 1.00 23.09 C ATOM 582 C ASP A 81 -6.593 7.883 11.522 1.00 26.71 C ATOM 583 O ASP A 81 -7.740 7.544 11.233 1.00 28.60 O ATOM 584 CB ASP A 81 -5.510 6.580 9.676 1.00 24.73 C ATOM 585 CG ASP A 81 -5.268 5.367 10.555 1.00 25.21 C ATOM 586 OD1 ASP A 81 -5.229 5.511 11.798 1.00 21.81 O ATOM 587 OD2 ASP A 81 -5.127 4.260 9.998 1.00 31.76 O ATOM 0 H ASP A 81 -3.717 7.459 11.218 1.00 21.83 H new ATOM 0 HA ASP A 81 -5.689 8.630 9.862 1.00 23.09 H new ATOM 0 HB2 ASP A 81 -6.366 6.486 9.230 1.00 24.73 H new ATOM 0 HB3 ASP A 81 -4.832 6.613 8.983 1.00 24.73 H new ATOM 588 N GLY A 82 -6.242 8.241 12.751 1.00 21.26 N ATOM 589 CA GLY A 82 -7.238 8.381 13.797 1.00 20.84 C ATOM 590 C GLY A 82 -7.405 7.185 14.716 1.00 17.13 C ATOM 591 O GLY A 82 -8.107 7.272 15.722 1.00 19.76 O ATOM 0 H GLY A 82 -5.435 8.406 12.997 1.00 21.26 H new ATOM 0 HA2 GLY A 82 -7.008 9.153 14.338 1.00 20.84 H new ATOM 0 HA3 GLY A 82 -8.094 8.570 13.382 1.00 20.84 H new ATOM 592 N SER A 83 -6.764 6.068 14.381 1.00 14.66 N ATOM 593 CA SER A 83 -6.840 4.879 15.224 1.00 14.23 C ATOM 594 C SER A 83 -5.840 4.980 16.374 1.00 10.27 C ATOM 595 O SER A 83 -4.938 5.816 16.355 1.00 12.44 O ATOM 596 CB SER A 83 -6.608 3.603 14.406 1.00 13.51 C ATOM 597 OG SER A 83 -5.294 3.567 13.876 1.00 15.21 O ATOM 0 H SER A 83 -6.283 5.978 13.674 1.00 14.66 H new ATOM 0 HA SER A 83 -7.734 4.828 15.597 1.00 14.23 H new ATOM 0 HB2 SER A 83 -6.755 2.825 14.966 1.00 13.51 H new ATOM 0 HB3 SER A 83 -7.253 3.557 13.683 1.00 13.51 H new ATOM 0 HG SER A 83 -5.223 4.137 13.263 1.00 15.21 H new ATOM 598 N SER A 84 -6.002 4.123 17.372 1.00 11.17 N ATOM 599 CA SER A 84 -5.177 4.214 18.565 1.00 11.22 C ATOM 600 C SER A 84 -5.197 2.923 19.355 1.00 9.65 C ATOM 601 O SER A 84 -6.076 2.079 19.182 1.00 10.29 O ATOM 602 CB SER A 84 -5.661 5.356 19.451 1.00 13.48 C ATOM 603 OG SER A 84 -6.977 5.099 19.904 1.00 13.96 O ATOM 0 H SER A 84 -6.580 3.486 17.378 1.00 11.17 H new ATOM 0 HA SER A 84 -4.266 4.383 18.279 1.00 11.22 H new ATOM 0 HB2 SER A 84 -5.065 5.461 20.209 1.00 13.48 H new ATOM 0 HB3 SER A 84 -5.639 6.190 18.956 1.00 13.48 H new ATOM 0 HG SER A 84 -7.527 5.489 19.403 1.00 13.96 H new ATOM 604 N SER A 85 -4.207 2.792 20.233 1.00 9.08 N ATOM 605 CA SER A 85 -4.114 1.665 21.154 1.00 9.04 C ATOM 606 C SER A 85 -3.191 2.037 22.309 1.00 9.09 C ATOM 607 O SER A 85 -2.425 2.994 22.218 1.00 8.43 O ATOM 608 CB SER A 85 -3.611 0.415 20.430 1.00 9.80 C ATOM 609 OG SER A 85 -2.405 0.692 19.741 1.00 10.63 O ATOM 0 H SER A 85 -3.566 3.360 20.311 1.00 9.08 H new ATOM 0 HA SER A 85 -4.995 1.463 21.506 1.00 9.04 H new ATOM 0 HB2 SER A 85 -3.467 -0.300 21.070 1.00 9.80 H new ATOM 0 HB3 SER A 85 -4.284 0.105 19.804 1.00 9.80 H new ATOM 0 HG SER A 85 -2.220 0.051 19.231 1.00 10.63 H new ATOM 610 N SER A 86 -3.283 1.301 23.407 1.00 9.00 N ATOM 611 CA SER A 86 -2.457 1.602 24.569 1.00 8.41 C ATOM 612 C SER A 86 -2.416 0.410 25.514 1.00 7.97 C ATOM 613 O SER A 86 -3.248 -0.495 25.428 1.00 9.54 O ATOM 614 CB SER A 86 -3.009 2.832 25.301 1.00 8.67 C ATOM 615 OG SER A 86 -4.313 2.572 25.807 1.00 11.53 O ATOM 0 H SER A 86 -3.811 0.629 23.501 1.00 9.00 H new ATOM 0 HA SER A 86 -1.555 1.791 24.267 1.00 8.41 H new ATOM 0 HB2 SER A 86 -2.416 3.073 26.030 1.00 8.67 H new ATOM 0 HB3 SER A 86 -3.037 3.589 24.695 1.00 8.67 H new ATOM 0 HG SER A 86 -4.883 2.949 25.319 1.00 11.53 H new ATOM 616 N GLY A 87 -1.450 0.404 26.430 1.00 8.61 N ATOM 617 CA GLY A 87 -1.384 -0.664 27.409 1.00 8.32 C ATOM 618 C GLY A 87 -0.119 -0.660 28.243 1.00 7.27 C ATOM 619 O GLY A 87 0.445 0.410 28.520 1.00 8.60 O ATOM 0 H GLY A 87 -0.835 1.001 26.498 1.00 8.61 H new ATOM 0 HA2 GLY A 87 -2.150 -0.596 28.000 1.00 8.32 H new ATOM 0 HA3 GLY A 87 -1.455 -1.516 26.950 1.00 8.32 H new ATOM 620 N ASP A 88 0.321 -1.852 28.641 1.00 8.24 N ATOM 621 CA ASP A 88 1.553 -2.016 29.417 1.00 8.45 C ATOM 622 C ASP A 88 2.613 -2.749 28.593 1.00 8.32 C ATOM 623 O ASP A 88 2.416 -2.976 27.393 1.00 8.38 O ATOM 624 CB ASP A 88 1.299 -2.676 30.785 1.00 11.61 C ATOM 625 CG ASP A 88 0.518 -3.961 30.692 1.00 15.42 C ATOM 626 OD1 ASP A 88 0.454 -4.561 29.607 1.00 13.90 O ATOM 627 OD2 ASP A 88 -0.043 -4.379 31.728 1.00 21.38 O ATOM 0 H ASP A 88 -0.086 -2.590 28.469 1.00 8.24 H new ATOM 0 HA ASP A 88 1.900 -1.133 29.617 1.00 8.45 H new ATOM 0 HB2 ASP A 88 2.151 -2.853 31.215 1.00 11.61 H new ATOM 0 HB3 ASP A 88 0.819 -2.053 31.353 1.00 11.61 H new ATOM 628 N VAL A 89 3.733 -3.109 29.208 1.00 7.92 N ATOM 629 CA VAL A 89 4.882 -3.548 28.433 1.00 8.18 C ATOM 630 C VAL A 89 5.558 -4.741 29.089 1.00 7.80 C ATOM 631 O VAL A 89 5.776 -4.743 30.302 1.00 7.90 O ATOM 632 CB VAL A 89 5.927 -2.407 28.263 1.00 6.77 C ATOM 633 CG1 VAL A 89 7.040 -2.842 27.314 1.00 7.69 C ATOM 634 CG2 VAL A 89 5.274 -1.115 27.772 1.00 8.82 C ATOM 0 H VAL A 89 3.847 -3.106 30.060 1.00 7.92 H new ATOM 0 HA VAL A 89 4.549 -3.804 27.559 1.00 8.18 H new ATOM 0 HB VAL A 89 6.313 -2.226 29.134 1.00 6.77 H new ATOM 0 HG11 VAL A 89 7.683 -2.122 27.218 1.00 7.69 H new ATOM 0 HG12 VAL A 89 7.484 -3.626 27.674 1.00 7.69 H new ATOM 0 HG13 VAL A 89 6.661 -3.055 26.447 1.00 7.69 H new ATOM 0 HG21 VAL A 89 5.950 -0.426 27.677 1.00 8.82 H new ATOM 0 HG22 VAL A 89 4.850 -1.272 26.914 1.00 8.82 H new ATOM 0 HG23 VAL A 89 4.606 -0.826 28.413 1.00 8.82 H new ATOM 635 N TYR A 90 5.887 -5.742 28.279 1.00 8.17 N ATOM 636 CA TYR A 90 6.719 -6.864 28.686 1.00 7.90 C ATOM 637 C TYR A 90 8.001 -6.836 27.877 1.00 8.14 C ATOM 638 O TYR A 90 8.057 -6.182 26.835 1.00 10.30 O ATOM 639 CB TYR A 90 5.982 -8.189 28.441 1.00 8.81 C ATOM 640 CG TYR A 90 4.789 -8.360 29.345 1.00 9.66 C ATOM 641 CD1 TYR A 90 4.892 -9.083 30.521 1.00 10.93 C ATOM 642 CD2 TYR A 90 3.581 -7.753 29.051 1.00 10.43 C ATOM 643 CE1 TYR A 90 3.825 -9.215 31.375 1.00 11.27 C ATOM 644 CE2 TYR A 90 2.499 -7.876 29.899 1.00 9.90 C ATOM 645 CZ TYR A 90 2.635 -8.609 31.061 1.00 12.57 C ATOM 646 OH TYR A 90 1.564 -8.745 31.910 1.00 14.18 O ATOM 0 H TYR A 90 5.626 -5.787 27.461 1.00 8.17 H new ATOM 0 HA TYR A 90 6.920 -6.793 29.632 1.00 7.90 H new ATOM 0 HB2 TYR A 90 5.692 -8.228 27.516 1.00 8.81 H new ATOM 0 HB3 TYR A 90 6.596 -8.927 28.577 1.00 8.81 H new ATOM 0 HD1 TYR A 90 5.701 -9.488 30.737 1.00 10.93 H new ATOM 0 HD2 TYR A 90 3.497 -7.255 28.270 1.00 10.43 H new ATOM 0 HE1 TYR A 90 3.908 -9.710 32.158 1.00 11.27 H new ATOM 0 HE2 TYR A 90 1.689 -7.470 29.690 1.00 9.90 H new ATOM 0 HH TYR A 90 0.894 -8.361 31.580 1.00 14.18 H new ATOM 647 N THR A 91 9.046 -7.500 28.354 1.00 7.95 N ATOM 648 CA THR A 91 10.140 -7.872 27.468 1.00 8.23 C ATOM 649 C THR A 91 10.047 -9.374 27.254 1.00 8.26 C ATOM 650 O THR A 91 9.657 -10.113 28.158 1.00 8.60 O ATOM 651 CB THR A 91 11.529 -7.482 28.016 1.00 9.70 C ATOM 652 OG1 THR A 91 11.721 -8.045 29.320 1.00 11.39 O ATOM 653 CG2 THR A 91 11.664 -5.967 28.091 1.00 11.21 C ATOM 0 H THR A 91 9.141 -7.742 29.174 1.00 7.95 H new ATOM 0 HA THR A 91 10.051 -7.385 26.634 1.00 8.23 H new ATOM 0 HB THR A 91 12.205 -7.830 27.414 1.00 9.70 H new ATOM 0 HG1 THR A 91 11.482 -7.490 29.903 1.00 11.39 H new ATOM 0 HG21 THR A 91 12.541 -5.737 28.437 1.00 11.21 H new ATOM 0 HG22 THR A 91 11.557 -5.588 27.205 1.00 11.21 H new ATOM 0 HG23 THR A 91 10.981 -5.610 28.680 1.00 11.21 H new ATOM 654 N ASP A 92 10.369 -9.825 26.047 1.00 7.37 N ATOM 655 CA ASP A 92 10.297 -11.245 25.740 1.00 6.68 C ATOM 656 C ASP A 92 11.127 -11.503 24.500 1.00 6.13 C ATOM 657 O ASP A 92 11.634 -10.567 23.866 1.00 7.85 O ATOM 658 CB ASP A 92 8.843 -11.667 25.512 1.00 7.83 C ATOM 659 CG ASP A 92 8.577 -13.127 25.862 1.00 7.03 C ATOM 660 OD1 ASP A 92 7.392 -13.458 26.083 1.00 7.63 O ATOM 661 OD2 ASP A 92 9.534 -13.930 25.908 1.00 7.90 O ATOM 0 H ASP A 92 10.630 -9.327 25.396 1.00 7.37 H new ATOM 0 HA ASP A 92 10.642 -11.765 26.482 1.00 6.68 H new ATOM 0 HB2 ASP A 92 8.262 -11.102 26.045 1.00 7.83 H new ATOM 0 HB3 ASP A 92 8.611 -11.516 24.582 1.00 7.83 H new ATOM 662 N THR A 93 11.269 -12.775 24.162 1.00 7.15 N ATOM 663 CA THR A 93 12.008 -13.178 22.977 1.00 6.54 C ATOM 664 C THR A 93 11.110 -13.072 21.765 1.00 6.19 C ATOM 665 O THR A 93 9.990 -13.591 21.766 1.00 8.23 O ATOM 666 CB THR A 93 12.497 -14.609 23.143 1.00 8.92 C ATOM 667 OG1 THR A 93 13.307 -14.661 24.324 1.00 11.01 O ATOM 668 CG2 THR A 93 13.322 -15.045 21.951 1.00 9.21 C ATOM 0 H THR A 93 10.940 -13.429 24.613 1.00 7.15 H new ATOM 0 HA THR A 93 12.774 -12.596 22.856 1.00 6.54 H new ATOM 0 HB THR A 93 11.735 -15.205 23.213 1.00 8.92 H new ATOM 0 HG1 THR A 93 13.771 -15.361 24.315 1.00 11.01 H new ATOM 0 HG21 THR A 93 13.621 -15.959 22.081 1.00 9.21 H new ATOM 0 HG22 THR A 93 12.782 -14.993 21.147 1.00 9.21 H new ATOM 0 HG23 THR A 93 14.093 -14.463 21.860 1.00 9.21 H new ATOM 669 N VAL A 94 11.593 -12.396 20.733 1.00 6.20 N ATOM 670 CA VAL A 94 10.833 -12.205 19.505 1.00 6.86 C ATOM 671 C VAL A 94 11.666 -12.665 18.318 1.00 6.69 C ATOM 672 O VAL A 94 12.836 -12.288 18.194 1.00 7.01 O ATOM 673 CB VAL A 94 10.452 -10.724 19.329 1.00 6.67 C ATOM 674 CG1 VAL A 94 9.843 -10.477 17.946 1.00 8.14 C ATOM 675 CG2 VAL A 94 9.501 -10.290 20.443 1.00 7.97 C ATOM 0 H VAL A 94 12.373 -12.034 20.724 1.00 6.20 H new ATOM 0 HA VAL A 94 10.018 -12.729 19.556 1.00 6.86 H new ATOM 0 HB VAL A 94 11.257 -10.186 19.391 1.00 6.67 H new ATOM 0 HG11 VAL A 94 9.611 -9.539 17.857 1.00 8.14 H new ATOM 0 HG12 VAL A 94 10.487 -10.717 17.261 1.00 8.14 H new ATOM 0 HG13 VAL A 94 9.045 -11.018 17.842 1.00 8.14 H new ATOM 0 HG21 VAL A 94 9.267 -9.356 20.323 1.00 7.97 H new ATOM 0 HG22 VAL A 94 8.697 -10.831 20.411 1.00 7.97 H new ATOM 0 HG23 VAL A 94 9.935 -10.407 21.303 1.00 7.97 H new ATOM 676 N SER A 95 11.068 -13.474 17.446 1.00 6.22 N ATOM 677 CA SER A 95 11.755 -13.983 16.262 1.00 6.10 C ATOM 678 C SER A 95 10.952 -13.688 15.003 1.00 6.30 C ATOM 679 O SER A 95 9.734 -13.854 14.981 1.00 7.10 O ATOM 680 CB SER A 95 11.992 -15.491 16.378 1.00 7.58 C ATOM 681 OG SER A 95 12.881 -15.781 17.447 1.00 10.13 O ATOM 0 H SER A 95 10.255 -13.742 17.524 1.00 6.22 H new ATOM 0 HA SER A 95 12.612 -13.533 16.202 1.00 6.10 H new ATOM 0 HB2 SER A 95 11.147 -15.945 16.522 1.00 7.58 H new ATOM 0 HB3 SER A 95 12.358 -15.830 15.546 1.00 7.58 H new ATOM 0 HG SER A 95 12.477 -16.224 18.035 1.00 10.13 H new ATOM 682 N VAL A 96 11.649 -13.242 13.969 1.00 5.65 N ATOM 683 CA VAL A 96 11.061 -12.991 12.665 1.00 6.37 C ATOM 684 C VAL A 96 11.873 -13.746 11.637 1.00 6.76 C ATOM 685 O VAL A 96 13.052 -13.461 11.413 1.00 7.88 O ATOM 686 CB VAL A 96 11.093 -11.497 12.303 1.00 6.44 C ATOM 687 CG1 VAL A 96 10.555 -11.283 10.889 1.00 8.85 C ATOM 688 CG2 VAL A 96 10.298 -10.677 13.306 1.00 7.92 C ATOM 0 H VAL A 96 12.492 -13.074 14.007 1.00 5.65 H new ATOM 0 HA VAL A 96 10.135 -13.279 12.682 1.00 6.37 H new ATOM 0 HB VAL A 96 12.015 -11.196 12.334 1.00 6.44 H new ATOM 0 HG11 VAL A 96 10.580 -10.338 10.673 1.00 8.85 H new ATOM 0 HG12 VAL A 96 11.103 -11.774 10.256 1.00 8.85 H new ATOM 0 HG13 VAL A 96 9.640 -11.601 10.839 1.00 8.85 H new ATOM 0 HG21 VAL A 96 10.332 -9.740 13.058 1.00 7.92 H new ATOM 0 HG22 VAL A 96 9.375 -10.976 13.310 1.00 7.92 H new ATOM 0 HG23 VAL A 96 10.678 -10.791 14.191 1.00 7.92 H new ATOM 689 N GLY A 97 11.242 -14.733 11.019 1.00 8.11 N ATOM 690 CA GLY A 97 11.863 -15.452 9.929 1.00 10.08 C ATOM 691 C GLY A 97 13.225 -16.000 10.283 1.00 9.60 C ATOM 692 O GLY A 97 14.125 -15.964 9.450 1.00 10.10 O ATOM 0 H GLY A 97 10.450 -15.000 11.219 1.00 8.11 H new ATOM 0 HA2 GLY A 97 11.286 -16.184 9.660 1.00 10.08 H new ATOM 0 HA3 GLY A 97 11.947 -14.861 9.164 1.00 10.08 H new ATOM 693 N GLY A 98 13.391 -16.493 11.510 1.00 8.97 N ATOM 694 CA GLY A 98 14.663 -17.080 11.919 1.00 11.33 C ATOM 695 C GLY A 98 15.632 -16.166 12.662 1.00 11.64 C ATOM 696 O GLY A 98 16.632 -16.628 13.214 1.00 13.53 O ATOM 0 H GLY A 98 12.782 -16.497 12.117 1.00 8.97 H new ATOM 0 HA2 GLY A 98 14.475 -17.846 12.484 1.00 11.33 H new ATOM 0 HA3 GLY A 98 15.110 -17.415 11.126 1.00 11.33 H new ATOM 697 N LEU A 99 15.345 -14.870 12.674 1.00 8.93 N ATOM 698 CA LEU A 99 16.168 -13.885 13.375 1.00 7.14 C ATOM 699 C LEU A 99 15.573 -13.624 14.750 1.00 7.00 C ATOM 700 O LEU A 99 14.400 -13.258 14.853 1.00 7.60 O ATOM 701 CB LEU A 99 16.172 -12.585 12.575 1.00 8.03 C ATOM 702 CG LEU A 99 16.777 -11.355 13.243 1.00 7.56 C ATOM 703 CD1 LEU A 99 18.272 -11.552 13.468 1.00 9.49 C ATOM 704 CD2 LEU A 99 16.521 -10.116 12.387 1.00 8.16 C ATOM 0 H LEU A 99 14.663 -14.532 12.274 1.00 8.93 H new ATOM 0 HA LEU A 99 17.074 -14.218 13.470 1.00 7.14 H new ATOM 0 HB2 LEU A 99 16.652 -12.744 11.747 1.00 8.03 H new ATOM 0 HB3 LEU A 99 15.255 -12.377 12.336 1.00 8.03 H new ATOM 0 HG LEU A 99 16.354 -11.228 14.107 1.00 7.56 H new ATOM 0 HD11 LEU A 99 18.642 -10.763 13.893 1.00 9.49 H new ATOM 0 HD12 LEU A 99 18.415 -12.323 14.039 1.00 9.49 H new ATOM 0 HD13 LEU A 99 18.712 -11.696 12.615 1.00 9.49 H new ATOM 0 HD21 LEU A 99 16.909 -9.339 12.819 1.00 8.16 H new ATOM 0 HD22 LEU A 99 16.926 -10.236 11.514 1.00 8.16 H new ATOM 0 HD23 LEU A 99 15.565 -9.985 12.284 1.00 8.16 H new ATOM 705 N THR A 100 16.365 -13.808 15.800 1.00 7.12 N ATOM 706 CA THR A 100 15.884 -13.720 17.175 1.00 9.17 C ATOM 707 C THR A 100 16.467 -12.546 17.952 1.00 7.96 C ATOM 708 O THR A 100 17.681 -12.318 17.942 1.00 10.15 O ATOM 709 CB THR A 100 16.183 -15.029 17.931 1.00 8.27 C ATOM 710 OG1 THR A 100 15.544 -16.119 17.256 1.00 10.12 O ATOM 711 CG2 THR A 100 15.684 -14.953 19.370 1.00 11.10 C ATOM 0 H THR A 100 17.203 -13.989 15.735 1.00 7.12 H new ATOM 0 HA THR A 100 14.927 -13.573 17.113 1.00 9.17 H new ATOM 0 HB THR A 100 17.143 -15.166 17.949 1.00 8.27 H new ATOM 0 HG1 THR A 100 14.710 -16.023 17.295 1.00 10.12 H new ATOM 0 HG21 THR A 100 15.882 -15.786 19.826 1.00 11.10 H new ATOM 0 HG22 THR A 100 16.126 -14.221 19.828 1.00 11.10 H new ATOM 0 HG23 THR A 100 14.726 -14.804 19.373 1.00 11.10 H new ATOM 712 N VAL A 101 15.589 -11.803 18.619 1.00 7.34 N ATOM 713 CA VAL A 101 15.985 -10.774 19.572 1.00 8.65 C ATOM 714 C VAL A 101 15.486 -11.160 20.960 1.00 9.58 C ATOM 715 O VAL A 101 14.293 -11.403 21.149 1.00 9.50 O ATOM 716 CB VAL A 101 15.394 -9.402 19.195 1.00 8.47 C ATOM 717 CG1 VAL A 101 15.586 -8.401 20.321 1.00 11.30 C ATOM 718 CG2 VAL A 101 16.026 -8.898 17.912 1.00 9.36 C ATOM 0 H VAL A 101 14.738 -11.884 18.529 1.00 7.34 H new ATOM 0 HA VAL A 101 16.953 -10.706 19.560 1.00 8.65 H new ATOM 0 HB VAL A 101 14.440 -9.506 19.051 1.00 8.47 H new ATOM 0 HG11 VAL A 101 15.207 -7.546 20.062 1.00 11.30 H new ATOM 0 HG12 VAL A 101 15.140 -8.723 21.120 1.00 11.30 H new ATOM 0 HG13 VAL A 101 16.533 -8.293 20.501 1.00 11.30 H new ATOM 0 HG21 VAL A 101 15.648 -8.035 17.682 1.00 9.36 H new ATOM 0 HG22 VAL A 101 16.984 -8.809 18.036 1.00 9.36 H new ATOM 0 HG23 VAL A 101 15.851 -9.528 17.195 1.00 9.36 H new ATOM 719 N THR A 102 16.390 -11.238 21.930 1.00 9.89 N ATOM 720 CA THR A 102 15.975 -11.447 23.313 1.00 10.54 C ATOM 721 C THR A 102 15.794 -10.089 23.981 1.00 8.83 C ATOM 722 O THR A 102 16.468 -9.123 23.624 1.00 10.80 O ATOM 723 CB THR A 102 16.984 -12.310 24.099 1.00 11.82 C ATOM 724 OG1 THR A 102 18.272 -11.689 24.068 1.00 14.44 O ATOM 725 CG2 THR A 102 17.079 -13.698 23.484 1.00 14.07 C ATOM 0 H THR A 102 17.239 -11.173 21.812 1.00 9.89 H new ATOM 0 HA THR A 102 15.136 -11.933 23.313 1.00 10.54 H new ATOM 0 HB THR A 102 16.681 -12.390 25.017 1.00 11.82 H new ATOM 0 HG1 THR A 102 18.373 -11.218 24.756 1.00 14.44 H new ATOM 0 HG21 THR A 102 17.715 -14.231 23.985 1.00 14.07 H new ATOM 0 HG22 THR A 102 16.208 -14.124 23.511 1.00 14.07 H new ATOM 0 HG23 THR A 102 17.374 -13.625 22.563 1.00 14.07 H new ATOM 726 N GLY A 103 14.863 -10.010 24.924 1.00 9.38 N ATOM 727 CA GLY A 103 14.633 -8.772 25.645 1.00 11.11 C ATOM 728 C GLY A 103 13.944 -7.687 24.829 1.00 9.77 C ATOM 729 O GLY A 103 14.040 -6.502 25.153 1.00 10.46 O ATOM 0 H GLY A 103 14.355 -10.663 25.159 1.00 9.38 H new ATOM 0 HA2 GLY A 103 14.095 -8.962 26.429 1.00 11.11 H new ATOM 0 HA3 GLY A 103 15.485 -8.432 25.961 1.00 11.11 H new ATOM 730 N GLN A 104 13.248 -8.075 23.769 1.00 7.88 N ATOM 731 CA GLN A 104 12.487 -7.111 22.980 1.00 6.56 C ATOM 732 C GLN A 104 11.290 -6.579 23.770 1.00 6.63 C ATOM 733 O GLN A 104 10.562 -7.353 24.393 1.00 7.59 O ATOM 734 CB GLN A 104 11.998 -7.773 21.688 1.00 7.37 C ATOM 735 CG GLN A 104 11.037 -6.909 20.865 1.00 8.03 C ATOM 736 CD GLN A 104 11.701 -5.664 20.300 1.00 7.27 C ATOM 737 OE1 GLN A 104 12.824 -5.719 19.788 1.00 8.67 O ATOM 738 NE2 GLN A 104 11.013 -4.538 20.398 1.00 8.02 N ATOM 0 H GLN A 104 13.202 -8.887 23.489 1.00 7.88 H new ATOM 0 HA GLN A 104 13.069 -6.365 22.766 1.00 6.56 H new ATOM 0 HB2 GLN A 104 12.767 -7.996 21.140 1.00 7.37 H new ATOM 0 HB3 GLN A 104 11.557 -8.607 21.911 1.00 7.37 H new ATOM 0 HG2 GLN A 104 10.677 -7.438 20.136 1.00 8.03 H new ATOM 0 HG3 GLN A 104 10.287 -6.646 21.422 1.00 8.03 H new ATOM 0 HE21 GLN A 104 10.234 -4.541 20.761 1.00 8.02 H new ATOM 0 HE22 GLN A 104 11.345 -3.804 20.098 1.00 8.02 H new ATOM 739 N ALA A 105 11.073 -5.265 23.734 1.00 7.03 N ATOM 740 CA ALA A 105 9.862 -4.697 24.314 1.00 6.59 C ATOM 741 C ALA A 105 8.655 -5.103 23.465 1.00 6.79 C ATOM 742 O ALA A 105 8.571 -4.777 22.267 1.00 7.24 O ATOM 743 CB ALA A 105 9.955 -3.179 24.418 1.00 8.92 C ATOM 0 H ALA A 105 11.609 -4.692 23.382 1.00 7.03 H new ATOM 0 HA ALA A 105 9.757 -5.044 25.214 1.00 6.59 H new ATOM 0 HB1 ALA A 105 9.137 -2.830 24.806 1.00 8.92 H new ATOM 0 HB2 ALA A 105 10.708 -2.939 24.981 1.00 8.92 H new ATOM 0 HB3 ALA A 105 10.079 -2.801 23.533 1.00 8.92 H new ATOM 744 N VAL A 106 7.740 -5.829 24.096 1.00 6.37 N ATOM 745 CA VAL A 106 6.485 -6.251 23.496 1.00 7.22 C ATOM 746 C VAL A 106 5.389 -5.510 24.243 1.00 6.25 C ATOM 747 O VAL A 106 5.158 -5.723 25.435 1.00 6.97 O ATOM 748 CB VAL A 106 6.285 -7.777 23.613 1.00 6.73 C ATOM 749 CG1 VAL A 106 4.922 -8.181 23.065 1.00 7.70 C ATOM 750 CG2 VAL A 106 7.392 -8.504 22.860 1.00 7.75 C ATOM 0 H VAL A 106 7.836 -6.096 24.908 1.00 6.37 H new ATOM 0 HA VAL A 106 6.473 -6.047 22.548 1.00 7.22 H new ATOM 0 HB VAL A 106 6.324 -8.025 24.550 1.00 6.73 H new ATOM 0 HG11 VAL A 106 4.812 -9.141 23.146 1.00 7.70 H new ATOM 0 HG12 VAL A 106 4.225 -7.733 23.569 1.00 7.70 H new ATOM 0 HG13 VAL A 106 4.860 -7.926 22.131 1.00 7.70 H new ATOM 0 HG21 VAL A 106 7.261 -9.462 22.937 1.00 7.75 H new ATOM 0 HG22 VAL A 106 7.369 -8.249 21.924 1.00 7.75 H new ATOM 0 HG23 VAL A 106 8.252 -8.264 23.238 1.00 7.75 H new ATOM 751 N GLU A 107 4.742 -4.593 23.549 1.00 6.30 N ATOM 752 CA GLU A 107 3.760 -3.722 24.165 1.00 6.16 C ATOM 753 C GLU A 107 2.397 -4.396 24.106 1.00 6.75 C ATOM 754 O GLU A 107 1.854 -4.645 23.030 1.00 8.94 O ATOM 755 CB GLU A 107 3.779 -2.370 23.457 1.00 6.49 C ATOM 756 CG GLU A 107 5.177 -1.773 23.454 1.00 7.31 C ATOM 757 CD GLU A 107 5.296 -0.537 22.602 1.00 7.66 C ATOM 758 OE1 GLU A 107 6.385 -0.299 22.034 1.00 8.25 O ATOM 759 OE2 GLU A 107 4.300 0.207 22.509 1.00 7.83 O ATOM 0 H GLU A 107 4.859 -4.457 22.708 1.00 6.30 H new ATOM 0 HA GLU A 107 3.967 -3.563 25.099 1.00 6.16 H new ATOM 0 HB2 GLU A 107 3.467 -2.475 22.545 1.00 6.49 H new ATOM 0 HB3 GLU A 107 3.165 -1.762 23.898 1.00 6.49 H new ATOM 0 HG2 GLU A 107 5.431 -1.556 24.365 1.00 7.31 H new ATOM 0 HG3 GLU A 107 5.806 -2.439 23.135 1.00 7.31 H new ATOM 760 N SER A 108 1.855 -4.707 25.272 1.00 8.10 N ATOM 761 CA SER A 108 0.614 -5.457 25.391 1.00 8.31 C ATOM 762 C SER A 108 -0.582 -4.506 25.436 1.00 9.13 C ATOM 763 O SER A 108 -0.649 -3.630 26.302 1.00 9.02 O ATOM 764 CB SER A 108 0.675 -6.293 26.669 1.00 9.71 C ATOM 765 OG SER A 108 -0.587 -6.848 26.963 1.00 13.61 O ATOM 0 H SER A 108 2.201 -4.486 26.028 1.00 8.10 H new ATOM 0 HA SER A 108 0.505 -6.037 24.621 1.00 8.31 H new ATOM 0 HB2 SER A 108 1.329 -7.002 26.566 1.00 9.71 H new ATOM 0 HB3 SER A 108 0.970 -5.740 27.409 1.00 9.71 H new ATOM 0 HG SER A 108 -0.814 -6.631 27.742 1.00 13.61 H new ATOM 766 N ALA A 109 -1.519 -4.650 24.501 1.00 7.33 N ATOM 767 CA ALA A 109 -2.651 -3.741 24.453 1.00 7.27 C ATOM 768 C ALA A 109 -3.665 -4.035 25.551 1.00 9.78 C ATOM 769 O ALA A 109 -4.091 -5.183 25.734 1.00 9.84 O ATOM 770 CB ALA A 109 -3.321 -3.793 23.090 1.00 8.12 C ATOM 0 H ALA A 109 -1.515 -5.260 23.895 1.00 7.33 H new ATOM 0 HA ALA A 109 -2.308 -2.846 24.603 1.00 7.27 H new ATOM 0 HB1 ALA A 109 -4.073 -3.181 23.076 1.00 8.12 H new ATOM 0 HB2 ALA A 109 -2.683 -3.537 22.406 1.00 8.12 H new ATOM 0 HB3 ALA A 109 -3.635 -4.695 22.918 1.00 8.12 H new ATOM 771 N LYS A 110 -4.037 -2.987 26.282 1.00 8.76 N ATOM 772 CA LYS A 110 -5.191 -3.053 27.172 1.00 11.39 C ATOM 773 C LYS A 110 -6.424 -2.489 26.472 1.00 9.89 C ATOM 774 O LYS A 110 -7.544 -2.942 26.711 1.00 11.68 O ATOM 775 CB LYS A 110 -4.910 -2.314 28.483 1.00 11.80 C ATOM 776 CG LYS A 110 -3.799 -2.963 29.293 1.00 14.04 C ATOM 777 CD LYS A 110 -3.532 -2.213 30.583 1.00 23.19 C ATOM 778 CE LYS A 110 -4.144 -2.932 31.771 1.00 29.38 C ATOM 779 NZ LYS A 110 -3.576 -2.426 33.050 1.00 32.05 N ATOM 0 H LYS A 110 -3.633 -2.228 26.276 1.00 8.76 H new ATOM 0 HA LYS A 110 -5.363 -3.982 27.392 1.00 11.39 H new ATOM 0 HB2 LYS A 110 -4.669 -1.395 28.287 1.00 11.80 H new ATOM 0 HB3 LYS A 110 -5.720 -2.287 29.015 1.00 11.80 H new ATOM 0 HG2 LYS A 110 -4.040 -3.880 29.496 1.00 14.04 H new ATOM 0 HG3 LYS A 110 -2.987 -2.994 28.763 1.00 14.04 H new ATOM 0 HD2 LYS A 110 -2.575 -2.121 30.715 1.00 23.19 H new ATOM 0 HD3 LYS A 110 -3.897 -1.317 30.521 1.00 23.19 H new ATOM 0 HE2 LYS A 110 -5.106 -2.807 31.769 1.00 29.38 H new ATOM 0 HE3 LYS A 110 -3.981 -3.885 31.695 1.00 29.38 H new ATOM 0 HZ1 LYS A 110 -3.144 -3.085 33.464 1.00 32.05 H new ATOM 0 HZ2 LYS A 110 -3.010 -1.760 32.881 1.00 32.05 H new ATOM 0 HZ3 LYS A 110 -4.234 -2.130 33.571 1.00 32.05 H new ATOM 780 N LYS A 111 -6.198 -1.525 25.583 1.00 9.58 N ATOM 781 CA LYS A 111 -7.264 -0.875 24.823 1.00 11.03 C ATOM 782 C LYS A 111 -6.846 -0.751 23.367 1.00 9.91 C ATOM 783 O LYS A 111 -5.687 -0.439 23.083 1.00 9.59 O ATOM 784 CB LYS A 111 -7.538 0.533 25.358 1.00 13.80 C ATOM 785 CG LYS A 111 -8.007 0.605 26.796 1.00 18.20 C ATOM 786 CD LYS A 111 -8.240 2.059 27.193 1.00 24.81 C ATOM 787 CE LYS A 111 -8.690 2.186 28.638 1.00 30.21 C ATOM 788 NZ LYS A 111 -8.899 3.612 29.021 1.00 38.97 N ATOM 0 H LYS A 111 -5.412 -1.226 25.402 1.00 9.58 H new ATOM 0 HA LYS A 111 -8.065 -1.415 24.909 1.00 11.03 H new ATOM 0 HB2 LYS A 111 -6.727 1.058 25.272 1.00 13.80 H new ATOM 0 HB3 LYS A 111 -8.208 0.951 24.795 1.00 13.80 H new ATOM 0 HG2 LYS A 111 -8.826 0.097 26.903 1.00 18.20 H new ATOM 0 HG3 LYS A 111 -7.345 0.204 27.381 1.00 18.20 H new ATOM 0 HD2 LYS A 111 -7.422 2.564 27.064 1.00 24.81 H new ATOM 0 HD3 LYS A 111 -8.910 2.450 26.610 1.00 24.81 H new ATOM 0 HE2 LYS A 111 -9.514 1.691 28.766 1.00 30.21 H new ATOM 0 HE3 LYS A 111 -8.026 1.787 29.221 1.00 30.21 H new ATOM 0 HZ1 LYS A 111 -9.162 3.656 29.870 1.00 38.97 H new ATOM 0 HZ2 LYS A 111 -8.137 4.061 28.923 1.00 38.97 H new ATOM 0 HZ3 LYS A 111 -9.524 3.971 28.499 1.00 38.97 H new ATOM 789 N VAL A 112 -7.785 -0.992 22.451 1.00 9.64 N ATOM 790 CA VAL A 112 -7.577 -0.696 21.033 1.00 9.91 C ATOM 791 C VAL A 112 -8.812 0.005 20.489 1.00 10.90 C ATOM 792 O VAL A 112 -9.922 -0.203 20.989 1.00 11.03 O ATOM 793 CB VAL A 112 -7.267 -1.963 20.174 1.00 8.35 C ATOM 794 CG1 VAL A 112 -6.071 -2.728 20.741 1.00 9.92 C ATOM 795 CG2 VAL A 112 -8.488 -2.870 20.043 1.00 10.73 C ATOM 0 H VAL A 112 -8.555 -1.329 22.633 1.00 9.64 H new ATOM 0 HA VAL A 112 -6.796 -0.125 20.970 1.00 9.91 H new ATOM 0 HB VAL A 112 -7.036 -1.660 19.282 1.00 8.35 H new ATOM 0 HG11 VAL A 112 -5.897 -3.509 20.193 1.00 9.92 H new ATOM 0 HG12 VAL A 112 -5.290 -2.153 20.741 1.00 9.92 H new ATOM 0 HG13 VAL A 112 -6.266 -3.008 21.649 1.00 9.92 H new ATOM 0 HG21 VAL A 112 -8.260 -3.644 19.505 1.00 10.73 H new ATOM 0 HG22 VAL A 112 -8.771 -3.161 20.924 1.00 10.73 H new ATOM 0 HG23 VAL A 112 -9.210 -2.382 19.617 1.00 10.73 H new ATOM 796 N SER A 113 -8.625 0.841 19.477 1.00 9.83 N ATOM 797 CA SER A 113 -9.759 1.545 18.888 1.00 9.86 C ATOM 798 C SER A 113 -10.537 0.639 17.931 1.00 10.91 C ATOM 799 O SER A 113 -10.077 -0.445 17.554 1.00 11.12 O ATOM 800 CB SER A 113 -9.309 2.836 18.200 1.00 12.01 C ATOM 801 OG SER A 113 -8.552 2.571 17.036 1.00 11.74 O ATOM 0 H SER A 113 -7.862 1.014 19.120 1.00 9.83 H new ATOM 0 HA SER A 113 -10.362 1.792 19.607 1.00 9.86 H new ATOM 0 HB2 SER A 113 -10.087 3.367 17.967 1.00 12.01 H new ATOM 0 HB3 SER A 113 -8.780 3.365 18.817 1.00 12.01 H new ATOM 0 HG SER A 113 -9.043 2.648 16.359 1.00 11.74 H new ATOM 802 N SER A 114 -11.728 1.087 17.551 1.00 12.19 N ATOM 803 CA SER A 114 -12.653 0.242 16.806 1.00 11.64 C ATOM 804 C SER A 114 -12.080 -0.349 15.518 1.00 11.19 C ATOM 805 O SER A 114 -12.384 -1.493 15.185 1.00 10.51 O ATOM 806 CB SER A 114 -13.950 1.004 16.505 1.00 14.45 C ATOM 807 OG SER A 114 -13.710 2.144 15.698 1.00 17.86 O ATOM 0 H SER A 114 -12.020 1.879 17.715 1.00 12.19 H new ATOM 0 HA SER A 114 -12.833 -0.515 17.385 1.00 11.64 H new ATOM 0 HB2 SER A 114 -14.576 0.414 16.056 1.00 14.45 H new ATOM 0 HB3 SER A 114 -14.366 1.278 17.337 1.00 14.45 H new ATOM 0 HG SER A 114 -13.825 1.945 14.890 1.00 17.86 H new ATOM 808 N SER A 115 -11.260 0.408 14.794 1.00 9.90 N ATOM 809 CA ASER A 115 -10.729 -0.087 13.524 0.60 11.44 C ATOM 810 CA BSER A 115 -10.733 -0.090 13.527 0.40 11.46 C ATOM 811 C SER A 115 -9.854 -1.319 13.728 1.00 11.33 C ATOM 812 O SER A 115 -9.838 -2.216 12.888 1.00 12.85 O ATOM 813 CB ASER A 115 -9.952 0.998 12.780 0.60 12.92 C ATOM 814 CB BSER A 115 -9.978 1.003 12.770 0.40 12.94 C ATOM 815 OG ASER A 115 -8.857 1.456 13.548 0.60 17.16 O ATOM 816 OG BSER A 115 -10.882 1.975 12.273 0.40 17.73 O ATOM 0 H ASER A 115 -11.001 1.198 15.014 0.60 9.90 H new ATOM 0 H BSER A 115 -11.000 1.198 15.013 0.40 9.90 H new ATOM 0 HA ASER A 115 -11.490 -0.341 12.979 0.60 11.46 H new ATOM 0 HA BSER A 115 -11.493 -0.357 12.987 0.40 11.46 H new ATOM 0 HB2ASER A 115 -9.633 0.649 11.933 0.60 12.94 H new ATOM 0 HB2BSER A 115 -9.332 1.425 13.358 0.40 12.94 H new ATOM 0 HB3ASER A 115 -10.542 1.741 12.577 0.60 12.94 H new ATOM 0 HB3BSER A 115 -9.480 0.611 12.036 0.40 12.94 H new ATOM 0 HG ASER A 115 -9.123 2.030 14.101 0.60 17.73 H new ATOM 0 HG BSER A 115 -11.656 1.807 12.552 0.40 17.73 H new ATOM 817 N PHE A 116 -9.127 -1.363 14.842 1.00 9.00 N ATOM 818 CA PHE A 116 -8.318 -2.542 15.146 1.00 8.42 C ATOM 819 C PHE A 116 -9.212 -3.732 15.484 1.00 8.30 C ATOM 820 O PHE A 116 -9.016 -4.831 14.960 1.00 9.05 O ATOM 821 CB PHE A 116 -7.309 -2.256 16.266 1.00 8.93 C ATOM 822 CG PHE A 116 -6.187 -1.349 15.845 1.00 7.45 C ATOM 823 CD1 PHE A 116 -5.276 -1.764 14.888 1.00 9.21 C ATOM 824 CD2 PHE A 116 -6.048 -0.081 16.387 1.00 10.02 C ATOM 825 CE1 PHE A 116 -4.244 -0.942 14.489 1.00 11.20 C ATOM 826 CE2 PHE A 116 -5.010 0.748 15.997 1.00 10.67 C ATOM 827 CZ PHE A 116 -4.111 0.319 15.041 1.00 11.23 C ATOM 0 H PHE A 116 -9.088 -0.733 15.426 1.00 9.00 H new ATOM 0 HA PHE A 116 -7.805 -2.769 14.354 1.00 8.42 H new ATOM 0 HB2 PHE A 116 -7.775 -1.855 17.017 1.00 8.93 H new ATOM 0 HB3 PHE A 116 -6.937 -3.096 16.578 1.00 8.93 H new ATOM 0 HD1 PHE A 116 -5.362 -2.609 14.509 1.00 9.21 H new ATOM 0 HD2 PHE A 116 -6.660 0.217 17.021 1.00 10.02 H new ATOM 0 HE1 PHE A 116 -3.637 -1.235 13.848 1.00 11.20 H new ATOM 0 HE2 PHE A 116 -4.919 1.591 16.378 1.00 10.67 H new ATOM 0 HZ PHE A 116 -3.418 0.876 14.769 1.00 11.23 H new ATOM 828 N THR A 117 -10.205 -3.515 16.342 1.00 8.28 N ATOM 829 CA THR A 117 -11.139 -4.573 16.696 1.00 10.48 C ATOM 830 C THR A 117 -11.797 -5.171 15.458 1.00 10.47 C ATOM 831 O THR A 117 -11.941 -6.393 15.338 1.00 10.24 O ATOM 832 CB THR A 117 -12.227 -4.037 17.641 1.00 10.37 C ATOM 833 OG1 THR A 117 -11.606 -3.552 18.835 1.00 10.79 O ATOM 834 CG2 THR A 117 -13.217 -5.122 17.994 1.00 12.04 C ATOM 0 H THR A 117 -10.353 -2.761 16.729 1.00 8.28 H new ATOM 0 HA THR A 117 -10.633 -5.268 17.145 1.00 10.48 H new ATOM 0 HB THR A 117 -12.705 -3.321 17.195 1.00 10.37 H new ATOM 0 HG1 THR A 117 -11.346 -4.202 19.300 1.00 10.79 H new ATOM 0 HG21 THR A 117 -13.893 -4.762 18.590 1.00 12.04 H new ATOM 0 HG22 THR A 117 -13.641 -5.449 17.185 1.00 12.04 H new ATOM 0 HG23 THR A 117 -12.754 -5.852 18.434 1.00 12.04 H new ATOM 835 N GLU A 118 -12.182 -4.297 14.537 1.00 9.57 N ATOM 836 CA GLU A 118 -12.937 -4.689 13.353 1.00 11.56 C ATOM 837 C GLU A 118 -12.094 -5.421 12.317 1.00 11.99 C ATOM 838 O GLU A 118 -12.638 -6.011 11.375 1.00 14.71 O ATOM 839 CB GLU A 118 -13.622 -3.459 12.744 1.00 14.29 C ATOM 840 CG GLU A 118 -14.745 -2.930 13.630 1.00 14.50 C ATOM 841 CD GLU A 118 -15.095 -1.480 13.369 1.00 15.02 C ATOM 842 OE1 GLU A 118 -15.960 -0.959 14.102 1.00 18.95 O ATOM 843 OE2 GLU A 118 -14.510 -0.862 12.454 1.00 19.59 O ATOM 0 H GLU A 118 -12.012 -3.455 14.581 1.00 9.57 H new ATOM 0 HA GLU A 118 -13.611 -5.325 13.639 1.00 11.56 H new ATOM 0 HB2 GLU A 118 -12.964 -2.760 12.605 1.00 14.29 H new ATOM 0 HB3 GLU A 118 -13.980 -3.688 11.872 1.00 14.29 H new ATOM 0 HG2 GLU A 118 -15.536 -3.475 13.495 1.00 14.50 H new ATOM 0 HG3 GLU A 118 -14.487 -3.030 14.560 1.00 14.50 H new ATOM 844 N ASP A 119 -10.774 -5.387 12.476 1.00 10.77 N ATOM 845 CA ASP A 119 -9.895 -6.107 11.560 1.00 11.28 C ATOM 846 C ASP A 119 -9.318 -7.365 12.212 1.00 10.38 C ATOM 847 O ASP A 119 -8.306 -7.314 12.916 1.00 9.75 O ATOM 848 CB ASP A 119 -8.779 -5.207 11.059 1.00 12.25 C ATOM 849 CG ASP A 119 -7.866 -5.918 10.109 1.00 13.65 C ATOM 850 OD1 ASP A 119 -8.219 -7.047 9.694 1.00 15.40 O ATOM 851 OD2 ASP A 119 -6.804 -5.355 9.777 1.00 18.65 O ATOM 0 H ASP A 119 -10.370 -4.957 13.102 1.00 10.77 H new ATOM 0 HA ASP A 119 -10.430 -6.384 10.800 1.00 11.28 H new ATOM 0 HB2 ASP A 119 -9.163 -4.433 10.619 1.00 12.25 H new ATOM 0 HB3 ASP A 119 -8.266 -4.879 11.814 1.00 12.25 H new ATOM 852 N SER A 120 -9.967 -8.496 11.966 1.00 10.20 N ATOM 853 CA SER A 120 -9.601 -9.743 12.627 1.00 9.07 C ATOM 854 C SER A 120 -8.268 -10.301 12.164 1.00 8.33 C ATOM 855 O SER A 120 -7.726 -11.181 12.812 1.00 9.61 O ATOM 856 CB SER A 120 -10.684 -10.804 12.420 1.00 13.36 C ATOM 857 OG SER A 120 -10.796 -11.131 11.046 1.00 17.38 O ATOM 0 H SER A 120 -10.626 -8.563 11.417 1.00 10.20 H new ATOM 0 HA SER A 120 -9.516 -9.526 13.569 1.00 9.07 H new ATOM 0 HB2 SER A 120 -10.468 -11.599 12.932 1.00 13.36 H new ATOM 0 HB3 SER A 120 -11.535 -10.476 12.751 1.00 13.36 H new ATOM 0 HG SER A 120 -11.245 -10.540 10.653 1.00 17.38 H new ATOM 858 N THR A 121 -7.741 -9.783 11.061 1.00 7.58 N ATOM 859 CA THR A 121 -6.549 -10.362 10.437 1.00 7.57 C ATOM 860 C THR A 121 -5.230 -9.811 10.974 1.00 6.96 C ATOM 861 O THR A 121 -4.176 -10.377 10.704 1.00 7.62 O ATOM 862 CB THR A 121 -6.553 -10.150 8.908 1.00 9.45 C ATOM 863 OG1 THR A 121 -6.407 -8.755 8.612 1.00 13.26 O ATOM 864 CG2 THR A 121 -7.853 -10.664 8.298 1.00 14.95 C ATOM 0 H THR A 121 -8.057 -9.094 10.654 1.00 7.58 H new ATOM 0 HA THR A 121 -6.599 -11.304 10.661 1.00 7.57 H new ATOM 0 HB THR A 121 -5.811 -10.645 8.527 1.00 9.45 H new ATOM 0 HG1 THR A 121 -7.017 -8.322 8.994 1.00 13.26 H new ATOM 0 HG21 THR A 121 -7.838 -10.523 7.338 1.00 14.95 H new ATOM 0 HG22 THR A 121 -7.945 -11.612 8.484 1.00 14.95 H new ATOM 0 HG23 THR A 121 -8.603 -10.185 8.683 1.00 14.95 H new ATOM 865 N ILE A 122 -5.282 -8.712 11.721 1.00 6.09 N ATOM 866 CA ILE A 122 -4.067 -8.051 12.200 1.00 6.03 C ATOM 867 C ILE A 122 -4.006 -8.187 13.717 1.00 7.14 C ATOM 868 O ILE A 122 -4.877 -7.673 14.433 1.00 6.97 O ATOM 869 CB ILE A 122 -4.014 -6.569 11.721 1.00 6.18 C ATOM 870 CG1 ILE A 122 -3.734 -6.532 10.211 1.00 8.60 C ATOM 871 CG2 ILE A 122 -2.954 -5.784 12.480 1.00 8.30 C ATOM 872 CD1 ILE A 122 -3.733 -5.143 9.578 1.00 9.53 C ATOM 0 H ILE A 122 -6.013 -8.330 11.963 1.00 6.09 H new ATOM 0 HA ILE A 122 -3.281 -8.478 11.825 1.00 6.03 H new ATOM 0 HB ILE A 122 -4.871 -6.152 11.900 1.00 6.18 H new ATOM 0 HG12 ILE A 122 -2.872 -6.946 10.047 1.00 8.60 H new ATOM 0 HG13 ILE A 122 -4.400 -7.075 9.761 1.00 8.60 H new ATOM 0 HG21 ILE A 122 -2.942 -4.867 12.164 1.00 8.30 H new ATOM 0 HG22 ILE A 122 -3.159 -5.796 13.428 1.00 8.30 H new ATOM 0 HG23 ILE A 122 -2.085 -6.188 12.333 1.00 8.30 H new ATOM 0 HD11 ILE A 122 -3.548 -5.220 8.629 1.00 9.53 H new ATOM 0 HD12 ILE A 122 -4.601 -4.728 9.706 1.00 9.53 H new ATOM 0 HD13 ILE A 122 -3.049 -4.597 9.997 1.00 9.53 H new ATOM 873 N ASP A 123 -2.993 -8.906 14.198 1.00 5.64 N ATOM 874 CA ASP A 123 -2.859 -9.200 15.623 1.00 5.96 C ATOM 875 C ASP A 123 -2.026 -8.153 16.356 1.00 5.89 C ATOM 876 O ASP A 123 -1.813 -8.260 17.569 1.00 5.96 O ATOM 877 CB ASP A 123 -2.229 -10.579 15.827 1.00 6.90 C ATOM 878 CG ASP A 123 -3.020 -11.697 15.173 1.00 7.26 C ATOM 879 OD1 ASP A 123 -4.267 -11.628 15.174 1.00 7.05 O ATOM 880 OD2 ASP A 123 -2.390 -12.665 14.684 1.00 7.34 O ATOM 0 H ASP A 123 -2.367 -9.236 13.709 1.00 5.64 H new ATOM 0 HA ASP A 123 -3.754 -9.186 15.996 1.00 5.96 H new ATOM 0 HB2 ASP A 123 -1.328 -10.574 15.467 1.00 6.90 H new ATOM 0 HB3 ASP A 123 -2.153 -10.757 16.778 1.00 6.90 H new ATOM 881 N GLY A 124 -1.546 -7.155 15.620 1.00 6.42 N ATOM 882 CA GLY A 124 -0.717 -6.110 16.188 1.00 6.52 C ATOM 883 C GLY A 124 0.204 -5.508 15.143 1.00 5.70 C ATOM 884 O GLY A 124 0.085 -5.810 13.952 1.00 5.56 O ATOM 0 H GLY A 124 -1.694 -7.069 14.777 1.00 6.42 H new ATOM 0 HA2 GLY A 124 -1.280 -5.416 16.564 1.00 6.52 H new ATOM 0 HA3 GLY A 124 -0.189 -6.473 16.917 1.00 6.52 H new ATOM 885 N LEU A 125 1.109 -4.639 15.595 1.00 5.81 N ATOM 886 CA LEU A 125 2.020 -3.899 14.727 1.00 6.16 C ATOM 887 C LEU A 125 3.459 -4.193 15.109 1.00 5.86 C ATOM 888 O LEU A 125 3.762 -4.404 16.292 1.00 6.02 O ATOM 889 CB LEU A 125 1.780 -2.398 14.897 1.00 9.37 C ATOM 890 CG LEU A 125 0.690 -1.733 14.062 1.00 13.51 C ATOM 891 CD1 LEU A 125 1.207 -1.543 12.672 1.00 15.67 C ATOM 892 CD2 LEU A 125 -0.614 -2.517 14.034 1.00 11.58 C ATOM 0 H LEU A 125 1.211 -4.461 16.430 1.00 5.81 H new ATOM 0 HA LEU A 125 1.860 -4.168 13.809 1.00 6.16 H new ATOM 0 HB2 LEU A 125 1.575 -2.237 15.831 1.00 9.37 H new ATOM 0 HB3 LEU A 125 2.615 -1.943 14.707 1.00 9.37 H new ATOM 0 HG LEU A 125 0.480 -0.881 14.476 1.00 13.51 H new ATOM 0 HD11 LEU A 125 0.524 -1.120 12.128 1.00 15.67 H new ATOM 0 HD12 LEU A 125 1.997 -0.980 12.694 1.00 15.67 H new ATOM 0 HD13 LEU A 125 1.436 -2.405 12.291 1.00 15.67 H new ATOM 0 HD21 LEU A 125 -1.264 -2.045 13.490 1.00 11.58 H new ATOM 0 HD22 LEU A 125 -0.455 -3.397 13.657 1.00 11.58 H new ATOM 0 HD23 LEU A 125 -0.956 -2.610 14.937 1.00 11.58 H new ATOM 893 N LEU A 126 4.349 -4.208 14.120 1.00 5.89 N ATOM 894 CA LEU A 126 5.781 -4.237 14.396 1.00 5.47 C ATOM 895 C LEU A 126 6.401 -3.019 13.723 1.00 5.19 C ATOM 896 O LEU A 126 6.527 -2.955 12.498 1.00 5.49 O ATOM 897 CB LEU A 126 6.420 -5.551 13.925 1.00 6.54 C ATOM 898 CG LEU A 126 7.872 -5.773 14.368 1.00 5.92 C ATOM 899 CD1 LEU A 126 8.164 -7.259 14.582 1.00 7.04 C ATOM 900 CD2 LEU A 126 8.853 -5.163 13.372 1.00 7.80 C ATOM 0 H LEU A 126 4.144 -4.202 13.285 1.00 5.89 H new ATOM 0 HA LEU A 126 5.943 -4.200 15.352 1.00 5.47 H new ATOM 0 HB2 LEU A 126 5.882 -6.289 14.251 1.00 6.54 H new ATOM 0 HB3 LEU A 126 6.385 -5.581 12.956 1.00 6.54 H new ATOM 0 HG LEU A 126 7.991 -5.321 15.218 1.00 5.92 H new ATOM 0 HD11 LEU A 126 9.086 -7.371 14.861 1.00 7.04 H new ATOM 0 HD12 LEU A 126 7.574 -7.609 15.268 1.00 7.04 H new ATOM 0 HD13 LEU A 126 8.017 -7.741 13.753 1.00 7.04 H new ATOM 0 HD21 LEU A 126 9.761 -5.318 13.676 1.00 7.80 H new ATOM 0 HD22 LEU A 126 8.729 -5.574 12.502 1.00 7.80 H new ATOM 0 HD23 LEU A 126 8.693 -4.209 13.304 1.00 7.80 H new ATOM 901 N GLY A 127 6.753 -2.025 14.533 1.00 5.74 N ATOM 902 CA GLY A 127 7.248 -0.757 14.018 1.00 6.31 C ATOM 903 C GLY A 127 8.683 -0.837 13.538 1.00 5.29 C ATOM 904 O GLY A 127 9.530 -1.444 14.191 1.00 6.61 O ATOM 0 H GLY A 127 6.711 -2.068 15.391 1.00 5.74 H new ATOM 0 HA2 GLY A 127 6.682 -0.467 13.285 1.00 6.31 H new ATOM 0 HA3 GLY A 127 7.181 -0.083 14.712 1.00 6.31 H new ATOM 905 N LEU A 128 8.952 -0.213 12.393 1.00 5.04 N ATOM 906 CA LEU A 128 10.272 -0.237 11.780 1.00 5.76 C ATOM 907 C LEU A 128 10.773 1.161 11.406 1.00 6.26 C ATOM 908 O LEU A 128 11.728 1.288 10.640 1.00 6.76 O ATOM 909 CB LEU A 128 10.274 -1.157 10.554 1.00 7.70 C ATOM 910 CG LEU A 128 10.069 -2.641 10.873 1.00 5.95 C ATOM 911 CD1 LEU A 128 9.724 -3.405 9.613 1.00 9.33 C ATOM 912 CD2 LEU A 128 11.317 -3.224 11.560 1.00 8.58 C ATOM 0 H LEU A 128 8.369 0.238 11.950 1.00 5.04 H new ATOM 0 HA LEU A 128 10.887 -0.587 12.443 1.00 5.76 H new ATOM 0 HB2 LEU A 128 9.575 -0.869 9.946 1.00 7.70 H new ATOM 0 HB3 LEU A 128 11.117 -1.052 10.086 1.00 7.70 H new ATOM 0 HG LEU A 128 9.326 -2.729 11.490 1.00 5.95 H new ATOM 0 HD11 LEU A 128 9.597 -4.342 9.827 1.00 9.33 H new ATOM 0 HD12 LEU A 128 8.907 -3.047 9.231 1.00 9.33 H new ATOM 0 HD13 LEU A 128 10.447 -3.316 8.972 1.00 9.33 H new ATOM 0 HD21 LEU A 128 11.171 -4.163 11.755 1.00 8.58 H new ATOM 0 HD22 LEU A 128 12.083 -3.132 10.972 1.00 8.58 H new ATOM 0 HD23 LEU A 128 11.485 -2.745 12.387 1.00 8.58 H new ATOM 913 N ALA A 129 10.125 2.196 11.937 1.00 5.83 N ATOM 914 CA ALA A 129 10.672 3.553 11.867 1.00 5.43 C ATOM 915 C ALA A 129 11.743 3.696 12.944 1.00 7.28 C ATOM 916 O ALA A 129 12.152 2.709 13.547 1.00 8.08 O ATOM 917 CB ALA A 129 9.570 4.587 12.051 1.00 5.65 C ATOM 0 H ALA A 129 9.369 2.136 12.342 1.00 5.83 H new ATOM 0 HA ALA A 129 11.067 3.706 10.994 1.00 5.43 H new ATOM 0 HB1 ALA A 129 9.950 5.478 12.002 1.00 5.65 H new ATOM 0 HB2 ALA A 129 8.906 4.480 11.352 1.00 5.65 H new ATOM 0 HB3 ALA A 129 9.150 4.463 12.917 1.00 5.65 H new ATOM 918 N PHE A 130 12.212 4.914 13.187 1.00 7.28 N ATOM 919 CA PHE A 130 13.323 5.096 14.114 1.00 6.87 C ATOM 920 C PHE A 130 12.846 5.086 15.562 1.00 7.39 C ATOM 921 O PHE A 130 11.734 5.522 15.866 1.00 7.01 O ATOM 922 CB PHE A 130 14.117 6.354 13.742 1.00 9.94 C ATOM 923 CG PHE A 130 14.789 6.232 12.408 1.00 8.04 C ATOM 924 CD1 PHE A 130 14.127 6.592 11.252 1.00 10.03 C ATOM 925 CD2 PHE A 130 16.046 5.671 12.300 1.00 12.69 C ATOM 926 CE1 PHE A 130 14.724 6.435 10.016 1.00 11.14 C ATOM 927 CE2 PHE A 130 16.646 5.509 11.069 1.00 11.65 C ATOM 928 CZ PHE A 130 15.979 5.889 9.926 1.00 10.09 C ATOM 0 H PHE A 130 11.908 5.637 12.833 1.00 7.28 H new ATOM 0 HA PHE A 130 13.931 4.344 14.036 1.00 6.87 H new ATOM 0 HB2 PHE A 130 13.520 7.119 13.732 1.00 9.94 H new ATOM 0 HB3 PHE A 130 14.786 6.525 14.424 1.00 9.94 H new ATOM 0 HD1 PHE A 130 13.268 6.945 11.306 1.00 10.03 H new ATOM 0 HD2 PHE A 130 16.494 5.399 13.068 1.00 12.69 H new ATOM 0 HE1 PHE A 130 14.275 6.699 9.246 1.00 11.14 H new ATOM 0 HE2 PHE A 130 17.499 5.144 11.011 1.00 11.65 H new ATOM 0 HZ PHE A 130 16.379 5.776 9.094 1.00 10.09 H new ATOM 929 N SER A 131 13.680 4.554 16.448 1.00 7.89 N ATOM 930 CA SER A 131 13.266 4.352 17.835 1.00 8.28 C ATOM 931 C SER A 131 12.895 5.641 18.573 1.00 7.55 C ATOM 932 O SER A 131 12.223 5.593 19.604 1.00 8.49 O ATOM 933 CB SER A 131 14.325 3.567 18.612 1.00 9.99 C ATOM 934 OG SER A 131 14.451 2.249 18.092 1.00 9.50 O ATOM 0 H SER A 131 14.484 4.304 16.271 1.00 7.89 H new ATOM 0 HA SER A 131 12.449 3.831 17.790 1.00 8.28 H new ATOM 0 HB2 SER A 131 15.179 4.025 18.558 1.00 9.99 H new ATOM 0 HB3 SER A 131 14.083 3.528 19.550 1.00 9.99 H new ATOM 0 HG SER A 131 15.250 2.109 17.874 1.00 9.50 H new ATOM 935 N THR A 132 13.320 6.787 18.047 1.00 9.26 N ATOM 936 CA THR A 132 12.945 8.068 18.634 1.00 9.82 C ATOM 937 C THR A 132 11.428 8.287 18.655 1.00 9.30 C ATOM 938 O THR A 132 10.938 9.117 19.416 1.00 11.34 O ATOM 939 CB THR A 132 13.612 9.240 17.895 1.00 10.10 C ATOM 940 OG1 THR A 132 13.327 9.123 16.497 1.00 12.57 O ATOM 941 CG2 THR A 132 15.120 9.242 18.113 1.00 13.23 C ATOM 0 H THR A 132 13.824 6.844 17.353 1.00 9.26 H new ATOM 0 HA THR A 132 13.260 8.040 19.551 1.00 9.82 H new ATOM 0 HB THR A 132 13.259 10.073 18.244 1.00 10.10 H new ATOM 0 HG1 THR A 132 13.979 9.412 16.053 1.00 12.57 H new ATOM 0 HG21 THR A 132 15.515 9.989 17.637 1.00 13.23 H new ATOM 0 HG22 THR A 132 15.310 9.326 19.061 1.00 13.23 H new ATOM 0 HG23 THR A 132 15.496 8.412 17.780 1.00 13.23 H new ATOM 942 N LEU A 133 10.686 7.547 17.828 1.00 7.85 N ATOM 943 CA LEU A 133 9.224 7.641 17.802 1.00 8.48 C ATOM 944 C LEU A 133 8.527 6.688 18.765 1.00 6.52 C ATOM 945 O LEU A 133 7.312 6.737 18.907 1.00 9.08 O ATOM 946 CB LEU A 133 8.675 7.389 16.392 1.00 10.49 C ATOM 947 CG LEU A 133 8.916 8.446 15.322 1.00 11.43 C ATOM 948 CD1 LEU A 133 8.269 8.003 14.023 1.00 13.83 C ATOM 949 CD2 LEU A 133 8.364 9.790 15.775 1.00 18.67 C ATOM 0 H LEU A 133 11.013 6.980 17.270 1.00 7.85 H new ATOM 0 HA LEU A 133 9.030 8.547 18.088 1.00 8.48 H new ATOM 0 HB2 LEU A 133 9.052 6.554 16.073 1.00 10.49 H new ATOM 0 HB3 LEU A 133 7.717 7.257 16.467 1.00 10.49 H new ATOM 0 HG LEU A 133 9.870 8.549 15.177 1.00 11.43 H new ATOM 0 HD11 LEU A 133 8.421 8.675 13.340 1.00 13.83 H new ATOM 0 HD12 LEU A 133 8.656 7.160 13.739 1.00 13.83 H new ATOM 0 HD13 LEU A 133 7.315 7.890 14.158 1.00 13.83 H new ATOM 0 HD21 LEU A 133 8.523 10.454 15.086 1.00 18.67 H new ATOM 0 HD22 LEU A 133 7.410 9.711 15.934 1.00 18.67 H new ATOM 0 HD23 LEU A 133 8.806 10.062 16.594 1.00 18.67 H new ATOM 950 N ASN A 134 9.284 5.815 19.424 1.00 7.04 N ATOM 951 CA ASN A 134 8.656 4.819 20.291 1.00 8.06 C ATOM 952 C ASN A 134 7.918 5.491 21.453 1.00 7.15 C ATOM 953 O ASN A 134 8.452 6.430 22.060 1.00 8.24 O ATOM 954 CB ASN A 134 9.692 3.821 20.806 1.00 7.50 C ATOM 955 CG ASN A 134 9.093 2.822 21.764 1.00 7.76 C ATOM 956 OD1 ASN A 134 9.111 3.024 22.983 1.00 7.24 O ATOM 957 ND2 ASN A 134 8.525 1.749 21.224 1.00 7.11 N ATOM 0 H ASN A 134 10.142 5.781 19.386 1.00 7.04 H new ATOM 0 HA ASN A 134 8.002 4.331 19.766 1.00 8.06 H new ATOM 0 HB2 ASN A 134 10.087 3.350 20.055 1.00 7.50 H new ATOM 0 HB3 ASN A 134 10.409 4.301 21.248 1.00 7.50 H new ATOM 0 HD21 ASN A 134 8.150 1.161 21.728 1.00 7.11 H new ATOM 0 HD22 ASN A 134 8.532 1.642 20.371 1.00 7.11 H new ATOM 958 N THR A 135 6.716 5.024 21.780 1.00 7.17 N ATOM 959 CA THR A 135 5.875 5.733 22.750 1.00 8.67 C ATOM 960 C THR A 135 5.980 5.239 24.188 1.00 9.17 C ATOM 961 O THR A 135 5.289 5.761 25.055 1.00 11.14 O ATOM 962 CB THR A 135 4.371 5.722 22.358 1.00 8.83 C ATOM 963 OG1 THR A 135 3.789 4.438 22.638 1.00 8.17 O ATOM 964 CG2 THR A 135 4.180 6.095 20.881 1.00 9.29 C ATOM 0 H THR A 135 6.369 4.306 21.457 1.00 7.17 H new ATOM 0 HA THR A 135 6.235 6.633 22.717 1.00 8.67 H new ATOM 0 HB THR A 135 3.915 6.391 22.893 1.00 8.83 H new ATOM 0 HG1 THR A 135 4.139 3.857 22.142 1.00 8.17 H new ATOM 0 HG21 THR A 135 3.235 6.081 20.663 1.00 9.29 H new ATOM 0 HG22 THR A 135 4.534 6.984 20.723 1.00 9.29 H new ATOM 0 HG23 THR A 135 4.650 5.456 20.322 1.00 9.29 H new ATOM 965 N VAL A 136 6.815 4.244 24.459 1.00 7.47 N ATOM 966 CA VAL A 136 6.882 3.714 25.821 1.00 7.76 C ATOM 967 C VAL A 136 7.413 4.771 26.792 1.00 8.13 C ATOM 968 O VAL A 136 8.398 5.451 26.512 1.00 8.64 O ATOM 969 CB VAL A 136 7.738 2.431 25.909 1.00 6.40 C ATOM 970 CG1 VAL A 136 7.840 1.937 27.360 1.00 8.83 C ATOM 971 CG2 VAL A 136 7.148 1.346 25.007 1.00 8.33 C ATOM 0 H VAL A 136 7.339 3.868 23.889 1.00 7.47 H new ATOM 0 HA VAL A 136 5.976 3.478 26.075 1.00 7.76 H new ATOM 0 HB VAL A 136 8.635 2.637 25.603 1.00 6.40 H new ATOM 0 HG11 VAL A 136 8.381 1.132 27.391 1.00 8.83 H new ATOM 0 HG12 VAL A 136 8.251 2.624 27.908 1.00 8.83 H new ATOM 0 HG13 VAL A 136 6.952 1.743 27.699 1.00 8.83 H new ATOM 0 HG21 VAL A 136 7.691 0.544 25.068 1.00 8.33 H new ATOM 0 HG22 VAL A 136 6.243 1.146 25.291 1.00 8.33 H new ATOM 0 HG23 VAL A 136 7.136 1.659 24.089 1.00 8.33 H new ATOM 972 N SER A 137 6.740 4.873 27.934 1.00 8.24 N ATOM 973 CA SER A 137 7.064 5.843 28.976 1.00 7.43 C ATOM 974 C SER A 137 7.138 5.094 30.296 1.00 8.55 C ATOM 975 O SER A 137 6.340 4.188 30.534 1.00 8.47 O ATOM 976 CB SER A 137 5.959 6.900 29.048 1.00 11.43 C ATOM 977 OG SER A 137 6.221 7.872 30.053 1.00 13.78 O ATOM 0 H SER A 137 6.069 4.371 28.129 1.00 8.24 H new ATOM 0 HA SER A 137 7.907 6.283 28.786 1.00 7.43 H new ATOM 0 HB2 SER A 137 5.875 7.339 28.187 1.00 11.43 H new ATOM 0 HB3 SER A 137 5.110 6.468 29.230 1.00 11.43 H new ATOM 0 HG SER A 137 5.848 7.642 30.770 1.00 13.78 H new ATOM 978 N PRO A 138 8.056 5.494 31.191 1.00 8.19 N ATOM 979 CA PRO A 138 8.952 6.655 31.132 1.00 8.15 C ATOM 980 C PRO A 138 10.294 6.371 30.461 1.00 9.20 C ATOM 981 O PRO A 138 11.124 7.276 30.337 1.00 11.54 O ATOM 982 CB PRO A 138 9.166 6.983 32.612 1.00 9.97 C ATOM 983 CG PRO A 138 9.101 5.657 33.284 1.00 9.41 C ATOM 984 CD PRO A 138 8.066 4.858 32.520 1.00 9.49 C ATOM 0 HA PRO A 138 8.569 7.370 30.600 1.00 8.15 H new ATOM 0 HB2 PRO A 138 10.021 7.415 32.760 1.00 9.97 H new ATOM 0 HB3 PRO A 138 8.482 7.585 32.946 1.00 9.97 H new ATOM 0 HG2 PRO A 138 9.964 5.215 33.266 1.00 9.41 H new ATOM 0 HG3 PRO A 138 8.850 5.751 34.216 1.00 9.41 H new ATOM 0 HD2 PRO A 138 8.307 3.920 32.466 1.00 9.49 H new ATOM 0 HD3 PRO A 138 7.195 4.903 32.944 1.00 9.49 H new ATOM 985 N THR A 139 10.499 5.133 30.025 1.00 8.72 N ATOM 986 CA THR A 139 11.756 4.729 29.402 1.00 8.63 C ATOM 987 C THR A 139 11.471 4.245 27.988 1.00 9.23 C ATOM 988 O THR A 139 10.915 3.168 27.789 1.00 8.43 O ATOM 989 CB THR A 139 12.433 3.600 30.196 1.00 7.86 C ATOM 990 OG1 THR A 139 12.559 3.986 31.575 1.00 8.73 O ATOM 991 CG2 THR A 139 13.819 3.292 29.628 1.00 9.96 C ATOM 0 H THR A 139 9.915 4.504 30.081 1.00 8.72 H new ATOM 0 HA THR A 139 12.354 5.492 29.388 1.00 8.63 H new ATOM 0 HB THR A 139 11.883 2.804 30.125 1.00 7.86 H new ATOM 0 HG1 THR A 139 13.193 4.531 31.657 1.00 8.73 H new ATOM 0 HG21 THR A 139 14.228 2.578 30.142 1.00 9.96 H new ATOM 0 HG22 THR A 139 13.735 3.016 28.702 1.00 9.96 H new ATOM 0 HG23 THR A 139 14.374 4.086 29.679 1.00 9.96 H new ATOM 992 N GLN A 140 11.838 5.057 27.007 1.00 8.64 N ATOM 993 CA GLN A 140 11.599 4.730 25.610 1.00 9.01 C ATOM 994 C GLN A 140 12.310 3.431 25.239 1.00 8.71 C ATOM 995 O GLN A 140 13.420 3.159 25.712 1.00 8.91 O ATOM 996 CB GLN A 140 12.110 5.868 24.736 1.00 10.02 C ATOM 997 CG GLN A 140 11.699 5.781 23.282 1.00 12.52 C ATOM 998 CD GLN A 140 12.055 7.036 22.524 1.00 14.17 C ATOM 999 OE1 GLN A 140 13.230 7.390 22.411 1.00 16.19 O ATOM 1000 NE2 GLN A 140 11.045 7.726 22.010 1.00 9.52 N ATOM 0 H GLN A 140 12.232 5.811 27.132 1.00 8.64 H new ATOM 0 HA GLN A 140 10.647 4.611 25.468 1.00 9.01 H new ATOM 0 HB2 GLN A 140 11.790 6.708 25.100 1.00 10.02 H new ATOM 0 HB3 GLN A 140 13.079 5.888 24.785 1.00 10.02 H new ATOM 0 HG2 GLN A 140 12.133 5.019 22.868 1.00 12.52 H new ATOM 0 HG3 GLN A 140 10.743 5.628 23.225 1.00 12.52 H new ATOM 0 HE21 GLN A 140 10.238 7.446 22.110 1.00 9.52 H new ATOM 0 HE22 GLN A 140 11.197 8.453 21.577 1.00 9.52 H new ATOM 1001 N GLN A 141 11.664 2.638 24.386 1.00 7.54 N ATOM 1002 CA GLN A 141 12.188 1.328 23.991 1.00 7.33 C ATOM 1003 C GLN A 141 12.643 1.293 22.531 1.00 7.57 C ATOM 1004 O GLN A 141 12.238 2.124 21.719 1.00 9.79 O ATOM 1005 CB GLN A 141 11.139 0.241 24.245 1.00 7.46 C ATOM 1006 CG GLN A 141 10.710 0.141 25.705 1.00 7.96 C ATOM 1007 CD GLN A 141 11.838 -0.300 26.622 1.00 8.91 C ATOM 1008 OE1 GLN A 141 12.439 -1.361 26.435 1.00 9.20 O ATOM 1009 NE2 GLN A 141 12.125 0.510 27.627 1.00 9.97 N ATOM 0 H GLN A 141 10.913 2.842 24.021 1.00 7.54 H new ATOM 0 HA GLN A 141 12.972 1.158 24.537 1.00 7.33 H new ATOM 0 HB2 GLN A 141 10.359 0.420 23.697 1.00 7.46 H new ATOM 0 HB3 GLN A 141 11.495 -0.615 23.960 1.00 7.46 H new ATOM 0 HG2 GLN A 141 10.378 1.003 26.000 1.00 7.96 H new ATOM 0 HG3 GLN A 141 9.974 -0.487 25.779 1.00 7.96 H new ATOM 0 HE21 GLN A 141 11.686 1.242 27.728 1.00 9.97 H new ATOM 0 HE22 GLN A 141 12.751 0.304 28.180 1.00 9.97 H new ATOM 1010 N LYS A 142 13.491 0.324 22.206 1.00 8.79 N ATOM 1011 CA LYS A 142 14.015 0.182 20.849 1.00 7.75 C ATOM 1012 C LYS A 142 13.150 -0.719 19.971 1.00 7.60 C ATOM 1013 O LYS A 142 12.519 -1.665 20.450 1.00 8.05 O ATOM 1014 CB LYS A 142 15.440 -0.376 20.893 1.00 10.09 C ATOM 1015 CG LYS A 142 16.447 0.560 21.539 1.00 14.17 C ATOM 1016 CD LYS A 142 17.861 0.054 21.346 1.00 17.18 C ATOM 1017 CE LYS A 142 18.874 1.080 21.831 1.00 31.09 C ATOM 1018 NZ LYS A 142 20.261 0.727 21.417 1.00 49.74 N ATOM 0 H LYS A 142 13.779 -0.267 22.761 1.00 8.79 H new ATOM 0 HA LYS A 142 14.009 1.068 20.454 1.00 7.75 H new ATOM 0 HB2 LYS A 142 15.434 -1.216 21.378 1.00 10.09 H new ATOM 0 HB3 LYS A 142 15.729 -0.573 19.988 1.00 10.09 H new ATOM 0 HG2 LYS A 142 16.362 1.447 21.155 1.00 14.17 H new ATOM 0 HG3 LYS A 142 16.256 0.642 22.486 1.00 14.17 H new ATOM 0 HD2 LYS A 142 17.980 -0.778 21.830 1.00 17.18 H new ATOM 0 HD3 LYS A 142 18.014 -0.139 20.408 1.00 17.18 H new ATOM 0 HE2 LYS A 142 18.644 1.954 21.478 1.00 31.09 H new ATOM 0 HE3 LYS A 142 18.832 1.144 22.798 1.00 31.09 H new ATOM 0 HZ1 LYS A 142 20.827 1.346 21.716 1.00 49.74 H new ATOM 0 HZ2 LYS A 142 20.480 -0.065 21.759 1.00 49.74 H new ATOM 0 HZ3 LYS A 142 20.305 0.689 20.529 1.00 49.74 H new ATOM 1019 N THR A 143 13.147 -0.439 18.672 1.00 7.76 N ATOM 1020 CA THR A 143 12.470 -1.313 17.721 1.00 6.69 C ATOM 1021 C THR A 143 13.190 -2.645 17.577 1.00 7.78 C ATOM 1022 O THR A 143 14.368 -2.797 17.941 1.00 7.46 O ATOM 1023 CB THR A 143 12.381 -0.687 16.321 1.00 7.67 C ATOM 1024 OG1 THR A 143 13.699 -0.611 15.762 1.00 9.70 O ATOM 1025 CG2 THR A 143 11.756 0.701 16.378 1.00 8.71 C ATOM 0 H THR A 143 13.529 0.248 18.322 1.00 7.76 H new ATOM 0 HA THR A 143 11.579 -1.446 18.080 1.00 6.69 H new ATOM 0 HB THR A 143 11.815 -1.243 15.763 1.00 7.67 H new ATOM 0 HG1 THR A 143 13.680 -0.146 15.062 1.00 9.70 H new ATOM 0 HG21 THR A 143 11.712 1.073 15.483 1.00 8.71 H new ATOM 0 HG22 THR A 143 10.861 0.638 16.746 1.00 8.71 H new ATOM 0 HG23 THR A 143 12.297 1.277 16.941 1.00 8.71 H new ATOM 1026 N PHE A 144 12.471 -3.610 17.025 1.00 7.49 N ATOM 1027 CA PHE A 144 13.043 -4.909 16.704 1.00 6.36 C ATOM 1028 C PHE A 144 14.298 -4.764 15.846 1.00 7.17 C ATOM 1029 O PHE A 144 15.316 -5.396 16.118 1.00 6.99 O ATOM 1030 CB PHE A 144 11.989 -5.776 15.999 1.00 6.20 C ATOM 1031 CG PHE A 144 12.504 -7.105 15.538 1.00 6.67 C ATOM 1032 CD1 PHE A 144 12.607 -8.170 16.420 1.00 6.89 C ATOM 1033 CD2 PHE A 144 12.878 -7.294 14.215 1.00 7.00 C ATOM 1034 CE1 PHE A 144 13.080 -9.406 15.993 1.00 7.82 C ATOM 1035 CE2 PHE A 144 13.356 -8.524 13.777 1.00 8.00 C ATOM 1036 CZ PHE A 144 13.462 -9.582 14.673 1.00 7.39 C ATOM 0 H PHE A 144 11.638 -3.532 16.826 1.00 7.49 H new ATOM 0 HA PHE A 144 13.308 -5.345 17.529 1.00 6.36 H new ATOM 0 HB2 PHE A 144 11.245 -5.920 16.604 1.00 6.20 H new ATOM 0 HB3 PHE A 144 11.643 -5.290 15.234 1.00 6.20 H new ATOM 0 HD1 PHE A 144 12.357 -8.056 17.308 1.00 6.89 H new ATOM 0 HD2 PHE A 144 12.808 -6.588 13.613 1.00 7.00 H new ATOM 0 HE1 PHE A 144 13.140 -10.114 16.593 1.00 7.82 H new ATOM 0 HE2 PHE A 144 13.604 -8.639 12.888 1.00 8.00 H new ATOM 0 HZ PHE A 144 13.788 -10.405 14.387 1.00 7.39 H new ATOM 1037 N PHE A 145 14.231 -3.923 14.816 1.00 7.23 N ATOM 1038 CA PHE A 145 15.376 -3.728 13.930 1.00 8.13 C ATOM 1039 C PHE A 145 16.553 -3.097 14.670 1.00 7.70 C ATOM 1040 O PHE A 145 17.697 -3.521 14.502 1.00 7.77 O ATOM 1041 CB PHE A 145 14.967 -2.894 12.709 1.00 9.46 C ATOM 1042 CG PHE A 145 16.096 -2.580 11.757 1.00 9.78 C ATOM 1043 CD1 PHE A 145 16.371 -1.262 11.421 1.00 11.76 C ATOM 1044 CD2 PHE A 145 16.858 -3.586 11.178 1.00 9.73 C ATOM 1045 CE1 PHE A 145 17.393 -0.951 10.544 1.00 13.41 C ATOM 1046 CE2 PHE A 145 17.898 -3.274 10.301 1.00 9.75 C ATOM 1047 CZ PHE A 145 18.151 -1.961 9.981 1.00 12.16 C ATOM 0 H PHE A 145 13.536 -3.458 14.614 1.00 7.23 H new ATOM 0 HA PHE A 145 15.671 -4.598 13.618 1.00 8.13 H new ATOM 0 HB2 PHE A 145 14.274 -3.369 12.225 1.00 9.46 H new ATOM 0 HB3 PHE A 145 14.578 -2.061 13.017 1.00 9.46 H new ATOM 0 HD1 PHE A 145 15.860 -0.578 11.791 1.00 11.76 H new ATOM 0 HD2 PHE A 145 16.674 -4.476 11.376 1.00 9.73 H new ATOM 0 HE1 PHE A 145 17.571 -0.063 10.333 1.00 13.41 H new ATOM 0 HE2 PHE A 145 18.418 -3.952 9.934 1.00 9.75 H new ATOM 0 HZ PHE A 145 18.833 -1.752 9.385 1.00 12.16 H new ATOM 1048 N ASP A 146 16.281 -2.097 15.500 1.00 8.77 N ATOM 1049 CA AASP A 146 17.345 -1.450 16.258 0.54 9.61 C ATOM 1050 CA BASP A 146 17.326 -1.436 16.274 0.46 9.63 C ATOM 1051 C ASP A 146 18.031 -2.446 17.185 1.00 9.49 C ATOM 1052 O ASP A 146 19.255 -2.446 17.308 1.00 10.85 O ATOM 1053 CB AASP A 146 16.804 -0.259 17.048 0.54 11.55 C ATOM 1054 CB BASP A 146 16.706 -0.307 17.101 0.46 11.72 C ATOM 1055 CG AASP A 146 17.237 1.063 16.468 0.54 15.61 C ATOM 1056 CG BASP A 146 17.683 0.805 17.404 0.46 13.96 C ATOM 1057 OD1AASP A 146 17.762 1.071 15.333 0.54 15.14 O ATOM 1058 OD1BASP A 146 18.907 0.575 17.316 0.46 18.66 O ATOM 1059 OD2AASP A 146 17.049 2.092 17.148 0.54 19.78 O ATOM 1060 OD2BASP A 146 17.215 1.914 17.740 0.46 16.27 O ATOM 0 H AASP A 146 15.494 -1.780 15.638 0.54 8.77 H new ATOM 0 H BASP A 146 15.491 -1.783 15.631 0.46 8.77 H new ATOM 0 HA AASP A 146 18.004 -1.119 15.628 0.54 9.63 H new ATOM 0 HA BASP A 146 17.987 -1.062 15.670 0.46 9.63 H new ATOM 0 HB2AASP A 146 15.835 -0.299 17.065 0.54 11.72 H new ATOM 0 HB2BASP A 146 15.946 0.058 16.622 0.46 11.72 H new ATOM 0 HB3AASP A 146 17.107 -0.320 17.967 0.54 11.72 H new ATOM 0 HB3BASP A 146 16.368 -0.671 17.934 0.46 11.72 H new ATOM 1061 N ASN A 147 17.251 -3.313 17.824 1.00 9.20 N ATOM 1062 CA ASN A 147 17.823 -4.331 18.698 1.00 7.86 C ATOM 1063 C ASN A 147 18.644 -5.362 17.931 1.00 10.43 C ATOM 1064 O ASN A 147 19.663 -5.841 18.433 1.00 12.56 O ATOM 1065 CB ASN A 147 16.740 -5.057 19.507 1.00 9.99 C ATOM 1066 CG ASN A 147 16.248 -4.252 20.690 1.00 9.22 C ATOM 1067 OD1 ASN A 147 17.021 -3.550 21.350 1.00 11.16 O ATOM 1068 ND2 ASN A 147 14.957 -4.352 20.972 1.00 10.12 N ATOM 0 H ASN A 147 16.393 -3.329 17.765 1.00 9.20 H new ATOM 0 HA ASN A 147 18.413 -3.855 19.304 1.00 7.86 H new ATOM 0 HB2 ASN A 147 15.990 -5.260 18.926 1.00 9.99 H new ATOM 0 HB3 ASN A 147 17.092 -5.904 19.822 1.00 9.99 H new ATOM 0 HD21 ASN A 147 14.627 -3.918 21.637 1.00 10.12 H new ATOM 0 HD22 ASN A 147 14.449 -4.851 20.490 1.00 10.12 H new ATOM 1069 N ALA A 148 18.202 -5.722 16.729 1.00 8.04 N ATOM 1070 CA ALA A 148 18.859 -6.775 15.959 1.00 8.00 C ATOM 1071 C ALA A 148 20.075 -6.279 15.195 1.00 7.91 C ATOM 1072 O ALA A 148 20.941 -7.075 14.833 1.00 9.92 O ATOM 1073 CB ALA A 148 17.879 -7.408 14.989 1.00 9.75 C ATOM 0 H ALA A 148 17.521 -5.368 16.340 1.00 8.04 H new ATOM 0 HA ALA A 148 19.167 -7.433 16.601 1.00 8.00 H new ATOM 0 HB1 ALA A 148 18.327 -8.105 14.484 1.00 9.75 H new ATOM 0 HB2 ALA A 148 17.138 -7.793 15.482 1.00 9.75 H new ATOM 0 HB3 ALA A 148 17.545 -6.732 14.379 1.00 9.75 H new ATOM 1074 N LYS A 149 20.129 -4.972 14.945 1.00 9.13 N ATOM 1075 CA LYS A 149 21.037 -4.410 13.944 1.00 10.60 C ATOM 1076 C LYS A 149 22.493 -4.838 14.085 1.00 12.91 C ATOM 1077 O LYS A 149 23.129 -5.214 13.099 1.00 12.73 O ATOM 1078 CB LYS A 149 20.934 -2.882 13.913 1.00 12.44 C ATOM 0 H LYS A 149 19.643 -4.388 15.348 1.00 9.13 H new ATOM 0 HA LYS A 149 20.738 -4.782 13.099 1.00 10.60 H new ATOM 1079 N ALA A 150 23.022 -4.766 15.298 1.00 12.15 N ATOM 1080 CA ALA A 150 24.434 -5.067 15.531 1.00 15.97 C ATOM 1081 C ALA A 150 24.772 -6.511 15.182 1.00 15.42 C ATOM 1082 O ALA A 150 25.901 -6.815 14.784 1.00 16.52 O ATOM 1083 CB ALA A 150 24.804 -4.768 16.973 1.00 18.02 C ATOM 0 H ALA A 150 22.583 -4.545 16.003 1.00 12.15 H new ATOM 0 HA ALA A 150 24.956 -4.498 14.945 1.00 15.97 H new ATOM 0 HB1 ALA A 150 25.742 -4.971 17.115 1.00 18.02 H new ATOM 0 HB2 ALA A 150 24.645 -3.830 17.160 1.00 18.02 H new ATOM 0 HB3 ALA A 150 24.262 -5.312 17.566 1.00 18.02 H new ATOM 1084 N SER A 151 23.796 -7.400 15.333 1.00 11.66 N ATOM 1085 CA SER A 151 23.999 -8.818 15.063 1.00 10.93 C ATOM 1086 C SER A 151 23.874 -9.181 13.585 1.00 8.41 C ATOM 1087 O SER A 151 24.320 -10.242 13.169 1.00 11.10 O ATOM 1088 CB SER A 151 23.027 -9.669 15.878 1.00 12.05 C ATOM 1089 OG SER A 151 23.174 -9.401 17.261 1.00 21.09 O ATOM 0 H SER A 151 23.001 -7.199 15.594 1.00 11.66 H new ATOM 0 HA SER A 151 24.913 -9.008 15.328 1.00 10.93 H new ATOM 0 HB2 SER A 151 22.116 -9.483 15.602 1.00 12.05 H new ATOM 0 HB3 SER A 151 23.189 -10.610 15.706 1.00 12.05 H new ATOM 0 HG SER A 151 22.780 -8.684 17.451 1.00 21.09 H new ATOM 1090 N LEU A 152 23.248 -8.309 12.799 1.00 9.38 N ATOM 1091 CA LEU A 152 22.979 -8.603 11.393 1.00 9.54 C ATOM 1092 C LEU A 152 24.240 -8.623 10.537 1.00 8.68 C ATOM 1093 O LEU A 152 25.207 -7.905 10.812 1.00 9.66 O ATOM 1094 CB LEU A 152 22.004 -7.576 10.811 1.00 9.37 C ATOM 1095 CG LEU A 152 20.607 -7.561 11.429 1.00 8.58 C ATOM 1096 CD1 LEU A 152 19.777 -6.455 10.803 1.00 9.84 C ATOM 1097 CD2 LEU A 152 19.939 -8.908 11.246 1.00 9.03 C ATOM 0 H LEU A 152 22.970 -7.539 13.061 1.00 9.38 H new ATOM 0 HA LEU A 152 22.591 -9.492 11.372 1.00 9.54 H new ATOM 0 HB2 LEU A 152 22.393 -6.693 10.911 1.00 9.37 H new ATOM 0 HB3 LEU A 152 21.916 -7.741 9.859 1.00 9.37 H new ATOM 0 HG LEU A 152 20.681 -7.388 12.381 1.00 8.58 H new ATOM 0 HD11 LEU A 152 18.892 -6.451 11.199 1.00 9.84 H new ATOM 0 HD12 LEU A 152 20.206 -5.599 10.961 1.00 9.84 H new ATOM 0 HD13 LEU A 152 19.702 -6.607 9.848 1.00 9.84 H new ATOM 0 HD21 LEU A 152 19.054 -8.887 11.642 1.00 9.03 H new ATOM 0 HD22 LEU A 152 19.865 -9.107 10.299 1.00 9.03 H new ATOM 0 HD23 LEU A 152 20.470 -9.594 11.679 1.00 9.03 H new ATOM 1098 N ASP A 153 24.224 -9.425 9.483 1.00 8.02 N ATOM 1099 CA ASP A 153 25.348 -9.447 8.554 1.00 9.49 C ATOM 1100 C ASP A 153 25.593 -8.057 7.954 1.00 10.20 C ATOM 1101 O ASP A 153 26.737 -7.653 7.754 1.00 11.73 O ATOM 1102 CB ASP A 153 25.115 -10.475 7.444 1.00 9.90 C ATOM 1103 CG ASP A 153 25.204 -11.909 7.940 1.00 10.32 C ATOM 1104 OD1 ASP A 153 24.986 -12.819 7.116 1.00 14.39 O ATOM 1105 OD2 ASP A 153 25.490 -12.117 9.137 1.00 13.59 O ATOM 0 H ASP A 153 23.580 -9.960 9.287 1.00 8.02 H new ATOM 0 HA ASP A 153 26.140 -9.706 9.051 1.00 9.49 H new ATOM 0 HB2 ASP A 153 24.241 -10.327 7.050 1.00 9.90 H new ATOM 0 HB3 ASP A 153 25.769 -10.339 6.741 1.00 9.90 H new ATOM 1106 N SER A 154 24.510 -7.335 7.680 1.00 8.23 N ATOM 1107 CA SER A 154 24.542 -5.968 7.157 1.00 7.88 C ATOM 1108 C SER A 154 23.376 -5.253 7.833 1.00 8.38 C ATOM 1109 O SER A 154 22.326 -5.866 8.043 1.00 8.52 O ATOM 1110 CB SER A 154 24.351 -5.994 5.641 1.00 10.01 C ATOM 1111 OG SER A 154 24.455 -4.702 5.056 1.00 11.77 O ATOM 0 H SER A 154 23.712 -7.634 7.796 1.00 8.23 H new ATOM 0 HA SER A 154 25.385 -5.522 7.334 1.00 7.88 H new ATOM 0 HB2 SER A 154 25.015 -6.580 5.244 1.00 10.01 H new ATOM 0 HB3 SER A 154 23.481 -6.370 5.434 1.00 10.01 H new ATOM 0 HG SER A 154 25.256 -4.449 5.076 1.00 11.77 H new ATOM 1112 N PRO A 155 23.545 -3.974 8.207 1.00 8.02 N ATOM 1113 CA PRO A 155 22.525 -3.293 9.018 1.00 7.44 C ATOM 1114 C PRO A 155 21.356 -2.768 8.183 1.00 8.04 C ATOM 1115 O PRO A 155 21.126 -1.557 8.120 1.00 8.04 O ATOM 1116 CB PRO A 155 23.305 -2.134 9.646 1.00 10.41 C ATOM 1117 CG PRO A 155 24.346 -1.819 8.622 1.00 11.80 C ATOM 1118 CD PRO A 155 24.747 -3.142 8.015 1.00 9.16 C ATOM 0 HA PRO A 155 22.114 -3.890 9.663 1.00 7.44 H new ATOM 0 HB2 PRO A 155 22.732 -1.371 9.820 1.00 10.41 H new ATOM 0 HB3 PRO A 155 23.703 -2.389 10.493 1.00 10.41 H new ATOM 0 HG2 PRO A 155 23.997 -1.218 7.945 1.00 11.80 H new ATOM 0 HG3 PRO A 155 25.109 -1.377 9.027 1.00 11.80 H new ATOM 0 HD2 PRO A 155 24.975 -3.052 7.077 1.00 9.16 H new ATOM 0 HD3 PRO A 155 25.521 -3.521 8.460 1.00 9.16 H new ATOM 1119 N VAL A 156 20.607 -3.686 7.583 1.00 6.65 N ATOM 1120 CA VAL A 156 19.565 -3.338 6.626 1.00 7.09 C ATOM 1121 C VAL A 156 18.369 -4.251 6.794 1.00 6.61 C ATOM 1122 O VAL A 156 18.488 -5.369 7.301 1.00 6.90 O ATOM 1123 CB VAL A 156 20.070 -3.478 5.169 1.00 7.85 C ATOM 1124 CG1 VAL A 156 21.304 -2.616 4.937 1.00 9.87 C ATOM 1125 CG2 VAL A 156 20.360 -4.943 4.826 1.00 10.46 C ATOM 0 H VAL A 156 20.689 -4.531 7.720 1.00 6.65 H new ATOM 0 HA VAL A 156 19.316 -2.416 6.797 1.00 7.09 H new ATOM 0 HB VAL A 156 19.367 -3.165 4.579 1.00 7.85 H new ATOM 0 HG11 VAL A 156 21.603 -2.719 4.020 1.00 9.87 H new ATOM 0 HG12 VAL A 156 21.085 -1.686 5.103 1.00 9.87 H new ATOM 0 HG13 VAL A 156 22.011 -2.894 5.540 1.00 9.87 H new ATOM 0 HG21 VAL A 156 20.674 -5.005 3.910 1.00 10.46 H new ATOM 0 HG22 VAL A 156 21.041 -5.287 5.425 1.00 10.46 H new ATOM 0 HG23 VAL A 156 19.549 -5.465 4.925 1.00 10.46 H new ATOM 1126 N PHE A 157 17.207 -3.775 6.369 1.00 6.61 N ATOM 1127 CA PHE A 157 16.100 -4.679 6.074 1.00 5.75 C ATOM 1128 C PHE A 157 15.503 -4.273 4.739 1.00 5.17 C ATOM 1129 O PHE A 157 15.716 -3.139 4.295 1.00 6.25 O ATOM 1130 CB PHE A 157 15.053 -4.750 7.203 1.00 6.36 C ATOM 1131 CG PHE A 157 14.267 -3.483 7.415 1.00 5.81 C ATOM 1132 CD1 PHE A 157 13.074 -3.268 6.732 1.00 6.07 C ATOM 1133 CD2 PHE A 157 14.689 -2.529 8.329 1.00 6.33 C ATOM 1134 CE1 PHE A 157 12.337 -2.107 6.940 1.00 6.56 C ATOM 1135 CE2 PHE A 157 13.952 -1.367 8.537 1.00 7.48 C ATOM 1136 CZ PHE A 157 12.775 -1.158 7.841 1.00 7.21 C ATOM 0 H PHE A 157 17.037 -2.941 6.245 1.00 6.61 H new ATOM 0 HA PHE A 157 16.439 -5.586 6.015 1.00 5.75 H new ATOM 0 HB2 PHE A 157 14.434 -5.471 7.008 1.00 6.36 H new ATOM 0 HB3 PHE A 157 15.504 -4.979 8.031 1.00 6.36 H new ATOM 0 HD1 PHE A 157 12.766 -3.907 6.130 1.00 6.07 H new ATOM 0 HD2 PHE A 157 15.474 -2.667 8.809 1.00 6.33 H new ATOM 0 HE1 PHE A 157 11.546 -1.970 6.470 1.00 6.56 H new ATOM 0 HE2 PHE A 157 14.251 -0.730 9.145 1.00 7.48 H new ATOM 0 HZ PHE A 157 12.281 -0.382 7.980 1.00 7.21 H new ATOM 1137 N THR A 158 14.828 -5.203 4.071 1.00 4.67 N ATOM 1138 CA THR A 158 14.247 -4.924 2.768 1.00 4.33 C ATOM 1139 C THR A 158 12.774 -5.295 2.760 1.00 5.13 C ATOM 1140 O THR A 158 12.350 -6.266 3.407 1.00 5.56 O ATOM 1141 CB THR A 158 14.983 -5.665 1.622 1.00 5.37 C ATOM 1142 OG1 THR A 158 14.822 -7.079 1.762 1.00 5.71 O ATOM 1143 CG2 THR A 158 16.464 -5.349 1.647 1.00 6.72 C ATOM 0 H THR A 158 14.696 -6.003 4.358 1.00 4.67 H new ATOM 0 HA THR A 158 14.346 -3.972 2.610 1.00 4.33 H new ATOM 0 HB THR A 158 14.599 -5.368 0.782 1.00 5.37 H new ATOM 0 HG1 THR A 158 14.158 -7.331 1.313 1.00 5.71 H new ATOM 0 HG21 THR A 158 16.908 -5.820 0.925 1.00 6.72 H new ATOM 0 HG22 THR A 158 16.593 -4.394 1.537 1.00 6.72 H new ATOM 0 HG23 THR A 158 16.841 -5.630 2.495 1.00 6.72 H new ATOM 1144 N ALA A 159 12.006 -4.500 2.023 1.00 4.97 N ATOM 1145 CA ALA A 159 10.584 -4.730 1.821 1.00 5.27 C ATOM 1146 C ALA A 159 10.340 -5.037 0.357 1.00 4.63 C ATOM 1147 O ALA A 159 10.687 -4.240 -0.522 1.00 6.15 O ATOM 1148 CB ALA A 159 9.780 -3.502 2.245 1.00 6.83 C ATOM 0 H ALA A 159 12.303 -3.801 1.620 1.00 4.97 H new ATOM 0 HA ALA A 159 10.297 -5.481 2.364 1.00 5.27 H new ATOM 0 HB1 ALA A 159 8.835 -3.670 2.105 1.00 6.83 H new ATOM 0 HB2 ALA A 159 9.940 -3.319 3.184 1.00 6.83 H new ATOM 0 HB3 ALA A 159 10.054 -2.737 1.716 1.00 6.83 H new ATOM 1149 N ASP A 160 9.719 -6.186 0.103 1.00 4.85 N ATOM 1150 CA ASP A 160 9.403 -6.645 -1.244 1.00 5.57 C ATOM 1151 C ASP A 160 7.932 -7.055 -1.230 1.00 5.76 C ATOM 1152 O ASP A 160 7.602 -8.241 -1.154 1.00 6.15 O ATOM 1153 CB ASP A 160 10.327 -7.822 -1.587 1.00 6.55 C ATOM 1154 CG ASP A 160 10.129 -8.355 -2.979 1.00 8.34 C ATOM 1155 OD1 ASP A 160 10.760 -9.400 -3.274 1.00 10.07 O ATOM 1156 OD2 ASP A 160 9.351 -7.769 -3.764 1.00 8.76 O ATOM 0 H ASP A 160 9.466 -6.729 0.720 1.00 4.85 H new ATOM 0 HA ASP A 160 9.540 -5.961 -1.918 1.00 5.57 H new ATOM 0 HB2 ASP A 160 11.249 -7.540 -1.485 1.00 6.55 H new ATOM 0 HB3 ASP A 160 10.177 -8.538 -0.950 1.00 6.55 H new ATOM 1157 N LEU A 161 7.048 -6.063 -1.262 1.00 5.51 N ATOM 1158 CA LEU A 161 5.609 -6.320 -1.145 1.00 5.87 C ATOM 1159 C LEU A 161 5.034 -6.758 -2.479 1.00 6.20 C ATOM 1160 O LEU A 161 5.408 -6.235 -3.532 1.00 7.19 O ATOM 1161 CB LEU A 161 4.876 -5.063 -0.677 1.00 6.53 C ATOM 1162 CG LEU A 161 5.352 -4.430 0.627 1.00 6.75 C ATOM 1163 CD1 LEU A 161 4.526 -3.183 0.896 1.00 8.84 C ATOM 1164 CD2 LEU A 161 5.266 -5.414 1.792 1.00 10.04 C ATOM 0 H LEU A 161 7.257 -5.233 -1.351 1.00 5.51 H new ATOM 0 HA LEU A 161 5.486 -7.028 -0.493 1.00 5.87 H new ATOM 0 HB2 LEU A 161 4.943 -4.396 -1.378 1.00 6.53 H new ATOM 0 HB3 LEU A 161 3.936 -5.280 -0.581 1.00 6.53 H new ATOM 0 HG LEU A 161 6.287 -4.185 0.540 1.00 6.75 H new ATOM 0 HD11 LEU A 161 4.820 -2.772 1.724 1.00 8.84 H new ATOM 0 HD12 LEU A 161 4.640 -2.555 0.165 1.00 8.84 H new ATOM 0 HD13 LEU A 161 3.590 -3.425 0.971 1.00 8.84 H new ATOM 0 HD21 LEU A 161 5.575 -4.982 2.604 1.00 10.04 H new ATOM 0 HD22 LEU A 161 4.346 -5.699 1.908 1.00 10.04 H new ATOM 0 HD23 LEU A 161 5.822 -6.186 1.605 1.00 10.04 H new ATOM 1165 N GLY A 162 4.128 -7.727 -2.441 1.00 6.69 N ATOM 1166 CA GLY A 162 3.494 -8.212 -3.654 1.00 7.02 C ATOM 1167 C GLY A 162 2.221 -7.475 -4.031 1.00 6.88 C ATOM 1168 O GLY A 162 1.556 -6.896 -3.185 1.00 9.00 O ATOM 0 H GLY A 162 3.867 -8.117 -1.720 1.00 6.69 H new ATOM 0 HA2 GLY A 162 4.125 -8.141 -4.387 1.00 7.02 H new ATOM 0 HA3 GLY A 162 3.290 -9.154 -3.545 1.00 7.02 H new ATOM 1169 N TYR A 163 1.889 -7.481 -5.317 1.00 8.72 N ATOM 1170 CA TYR A 163 0.594 -6.996 -5.785 1.00 8.16 C ATOM 1171 C TYR A 163 -0.347 -8.182 -5.851 1.00 6.93 C ATOM 1172 O TYR A 163 -0.136 -9.117 -6.632 1.00 9.15 O ATOM 1173 CB TYR A 163 0.726 -6.331 -7.160 1.00 8.75 C ATOM 1174 CG TYR A 163 -0.598 -6.120 -7.860 1.00 9.43 C ATOM 1175 CD1 TYR A 163 -1.526 -5.208 -7.376 1.00 10.26 C ATOM 1176 CD2 TYR A 163 -0.913 -6.829 -9.018 1.00 10.12 C ATOM 1177 CE1 TYR A 163 -2.741 -5.016 -8.017 1.00 10.69 C ATOM 1178 CE2 TYR A 163 -2.123 -6.641 -9.660 1.00 11.97 C ATOM 1179 CZ TYR A 163 -3.029 -5.736 -9.150 1.00 11.85 C ATOM 1180 OH TYR A 163 -4.239 -5.539 -9.778 1.00 14.93 O ATOM 0 H TYR A 163 2.406 -7.765 -5.942 1.00 8.72 H new ATOM 0 HA TYR A 163 0.248 -6.326 -5.175 1.00 8.16 H new ATOM 0 HB2 TYR A 163 1.168 -5.474 -7.055 1.00 8.75 H new ATOM 0 HB3 TYR A 163 1.297 -6.878 -7.722 1.00 8.75 H new ATOM 0 HD1 TYR A 163 -1.330 -4.718 -6.610 1.00 10.26 H new ATOM 0 HD2 TYR A 163 -0.300 -7.437 -9.364 1.00 10.12 H new ATOM 0 HE1 TYR A 163 -3.356 -4.404 -7.682 1.00 10.69 H new ATOM 0 HE2 TYR A 163 -2.324 -7.122 -10.430 1.00 11.97 H new ATOM 0 HH TYR A 163 -4.825 -6.019 -9.415 1.00 14.93 H new ATOM 1181 N HIS A 164 -1.371 -8.155 -5.009 1.00 7.45 N ATOM 1182 CA HIS A 164 -2.337 -9.244 -4.920 1.00 9.07 C ATOM 1183 C HIS A 164 -1.626 -10.597 -4.775 1.00 10.90 C ATOM 1184 O HIS A 164 -2.068 -11.604 -5.326 1.00 13.16 O ATOM 1185 CB HIS A 164 -3.266 -9.263 -6.148 1.00 14.03 C ATOM 1186 CG HIS A 164 -4.170 -8.068 -6.266 1.00 11.87 C ATOM 1187 ND1 HIS A 164 -4.250 -7.076 -5.313 1.00 17.83 N ATOM 1188 CD2 HIS A 164 -5.046 -7.718 -7.242 1.00 16.87 C ATOM 1189 CE1 HIS A 164 -5.125 -6.161 -5.701 1.00 16.69 C ATOM 1190 NE2 HIS A 164 -5.626 -6.533 -6.864 1.00 19.66 N ATOM 0 H HIS A 164 -1.527 -7.503 -4.471 1.00 7.45 H new ATOM 0 HA HIS A 164 -2.878 -9.092 -4.129 1.00 9.07 H new ATOM 0 HB2 HIS A 164 -2.723 -9.323 -6.949 1.00 14.03 H new ATOM 0 HB3 HIS A 164 -3.811 -10.064 -6.114 1.00 14.03 H new ATOM 0 HD1 HIS A 164 -3.801 -7.054 -4.580 1.00 17.83 H new ATOM 0 HD2 HIS A 164 -5.221 -8.193 -8.022 1.00 16.87 H new ATOM 0 HE1 HIS A 164 -5.348 -5.388 -5.234 1.00 16.69 H new ATOM 1191 N ALA A 165 -0.523 -10.617 -4.025 1.00 8.47 N ATOM 1192 CA ALA A 165 0.298 -11.815 -3.877 1.00 8.26 C ATOM 1193 C ALA A 165 1.231 -11.638 -2.690 1.00 8.97 C ATOM 1194 O ALA A 165 1.506 -10.517 -2.285 1.00 7.68 O ATOM 1195 CB ALA A 165 1.109 -12.055 -5.138 1.00 10.85 C ATOM 0 H ALA A 165 -0.232 -9.936 -3.589 1.00 8.47 H new ATOM 0 HA ALA A 165 -0.278 -12.581 -3.728 1.00 8.26 H new ATOM 0 HB1 ALA A 165 1.650 -12.853 -5.028 1.00 10.85 H new ATOM 0 HB2 ALA A 165 0.509 -12.173 -5.891 1.00 10.85 H new ATOM 0 HB3 ALA A 165 1.687 -11.293 -5.301 1.00 10.85 H new ATOM 1196 N PRO A 166 1.741 -12.740 -2.132 1.00 7.58 N ATOM 1197 CA PRO A 166 2.706 -12.600 -1.036 1.00 7.87 C ATOM 1198 C PRO A 166 4.030 -11.992 -1.487 1.00 8.38 C ATOM 1199 O PRO A 166 4.369 -11.942 -2.674 1.00 9.57 O ATOM 1200 CB PRO A 166 2.914 -14.045 -0.554 1.00 9.65 C ATOM 1201 CG PRO A 166 1.705 -14.800 -1.057 1.00 11.61 C ATOM 1202 CD PRO A 166 1.349 -14.141 -2.358 1.00 9.39 C ATOM 0 HA PRO A 166 2.380 -11.999 -0.348 1.00 7.87 H new ATOM 0 HB2 PRO A 166 3.735 -14.419 -0.909 1.00 9.65 H new ATOM 0 HB3 PRO A 166 2.978 -14.087 0.413 1.00 9.65 H new ATOM 0 HG2 PRO A 166 1.906 -15.741 -1.183 1.00 11.61 H new ATOM 0 HG3 PRO A 166 0.971 -14.749 -0.425 1.00 11.61 H new ATOM 0 HD2 PRO A 166 1.830 -14.533 -3.104 1.00 9.39 H new ATOM 0 HD3 PRO A 166 0.403 -14.223 -2.556 1.00 9.39 H new ATOM 1203 N GLY A 167 4.772 -11.505 -0.500 1.00 7.60 N ATOM 1204 CA GLY A 167 6.066 -10.898 -0.716 1.00 7.22 C ATOM 1205 C GLY A 167 6.956 -11.264 0.448 1.00 5.13 C ATOM 1206 O GLY A 167 6.697 -12.241 1.164 1.00 5.76 O ATOM 0 H GLY A 167 4.529 -11.521 0.325 1.00 7.60 H new ATOM 0 HA2 GLY A 167 6.452 -11.211 -1.549 1.00 7.22 H new ATOM 0 HA3 GLY A 167 5.981 -9.934 -0.787 1.00 7.22 H new ATOM 1207 N THR A 168 8.007 -10.479 0.660 1.00 5.94 N ATOM 1208 CA THR A 168 9.040 -10.844 1.621 1.00 5.63 C ATOM 1209 C THR A 168 9.625 -9.648 2.368 1.00 5.45 C ATOM 1210 O THR A 168 9.882 -8.600 1.761 1.00 5.19 O ATOM 1211 CB THR A 168 10.208 -11.527 0.881 1.00 6.19 C ATOM 1212 OG1 THR A 168 9.705 -12.626 0.113 1.00 8.57 O ATOM 1213 CG2 THR A 168 11.253 -12.040 1.861 1.00 7.85 C ATOM 0 H THR A 168 8.140 -9.731 0.257 1.00 5.94 H new ATOM 0 HA THR A 168 8.612 -11.430 2.265 1.00 5.63 H new ATOM 0 HB THR A 168 10.625 -10.872 0.300 1.00 6.19 H new ATOM 0 HG1 THR A 168 9.537 -12.368 -0.669 1.00 8.57 H new ATOM 0 HG21 THR A 168 11.975 -12.464 1.372 1.00 7.85 H new ATOM 0 HG22 THR A 168 11.605 -11.298 2.377 1.00 7.85 H new ATOM 0 HG23 THR A 168 10.846 -12.685 2.460 1.00 7.85 H new ATOM 1214 N TYR A 169 9.838 -9.818 3.673 1.00 5.49 N ATOM 1215 CA TYR A 169 10.704 -8.939 4.459 1.00 5.09 C ATOM 1216 C TYR A 169 11.974 -9.697 4.808 1.00 6.12 C ATOM 1217 O TYR A 169 11.912 -10.760 5.436 1.00 6.38 O ATOM 1218 CB TYR A 169 10.036 -8.487 5.766 1.00 6.23 C ATOM 1219 CG TYR A 169 9.042 -7.358 5.596 1.00 6.18 C ATOM 1220 CD1 TYR A 169 9.474 -6.047 5.469 1.00 7.00 C ATOM 1221 CD2 TYR A 169 7.671 -7.599 5.571 1.00 6.43 C ATOM 1222 CE1 TYR A 169 8.567 -5.004 5.317 1.00 7.66 C ATOM 1223 CE2 TYR A 169 6.752 -6.555 5.415 1.00 6.81 C ATOM 1224 CZ TYR A 169 7.210 -5.266 5.286 1.00 6.10 C ATOM 1225 OH TYR A 169 6.322 -4.215 5.127 1.00 7.98 O ATOM 0 H TYR A 169 9.481 -10.452 4.131 1.00 5.49 H new ATOM 0 HA TYR A 169 10.891 -8.150 3.927 1.00 5.09 H new ATOM 0 HB2 TYR A 169 9.583 -9.246 6.165 1.00 6.23 H new ATOM 0 HB3 TYR A 169 10.724 -8.207 6.390 1.00 6.23 H new ATOM 0 HD1 TYR A 169 10.385 -5.862 5.486 1.00 7.00 H new ATOM 0 HD2 TYR A 169 7.360 -8.471 5.660 1.00 6.43 H new ATOM 0 HE1 TYR A 169 8.873 -4.130 5.236 1.00 7.66 H new ATOM 0 HE2 TYR A 169 5.839 -6.732 5.399 1.00 6.81 H new ATOM 0 HH TYR A 169 6.591 -3.552 5.566 1.00 7.98 H new ATOM 1226 N ASN A 170 13.122 -9.150 4.417 1.00 5.07 N ATOM 1227 CA ASN A 170 14.421 -9.709 4.781 1.00 5.06 C ATOM 1228 C ASN A 170 15.156 -8.785 5.725 1.00 5.45 C ATOM 1229 O ASN A 170 15.072 -7.560 5.609 1.00 6.78 O ATOM 1230 CB ASN A 170 15.288 -9.939 3.544 1.00 5.99 C ATOM 1231 CG ASN A 170 14.777 -11.067 2.689 1.00 6.40 C ATOM 1232 OD1 ASN A 170 14.159 -12.006 3.196 1.00 7.50 O ATOM 1233 ND2 ASN A 170 15.023 -10.992 1.390 1.00 6.91 N ATOM 0 H ASN A 170 13.169 -8.442 3.931 1.00 5.07 H new ATOM 0 HA ASN A 170 14.256 -10.559 5.219 1.00 5.06 H new ATOM 0 HB2 ASN A 170 15.318 -9.125 3.017 1.00 5.99 H new ATOM 0 HB3 ASN A 170 16.197 -10.132 3.821 1.00 5.99 H new ATOM 0 HD21 ASN A 170 14.748 -11.614 0.864 1.00 6.91 H new ATOM 0 HD22 ASN A 170 15.458 -10.321 1.073 1.00 6.91 H new ATOM 1234 N PHE A 171 15.885 -9.375 6.662 1.00 5.77 N ATOM 1235 CA PHE A 171 16.709 -8.629 7.603 1.00 5.57 C ATOM 1236 C PHE A 171 18.147 -9.079 7.478 1.00 5.92 C ATOM 1237 O PHE A 171 18.443 -10.280 7.553 1.00 6.60 O ATOM 1238 CB PHE A 171 16.234 -8.870 9.037 1.00 7.21 C ATOM 1239 CG PHE A 171 14.896 -8.276 9.322 1.00 6.97 C ATOM 1240 CD1 PHE A 171 13.736 -8.943 8.954 1.00 8.88 C ATOM 1241 CD2 PHE A 171 14.791 -7.032 9.921 1.00 8.45 C ATOM 1242 CE1 PHE A 171 12.494 -8.381 9.193 1.00 10.92 C ATOM 1243 CE2 PHE A 171 13.545 -6.466 10.165 1.00 10.27 C ATOM 1244 CZ PHE A 171 12.403 -7.142 9.802 1.00 10.26 C ATOM 0 H PHE A 171 15.916 -10.227 6.771 1.00 5.77 H new ATOM 0 HA PHE A 171 16.636 -7.683 7.399 1.00 5.57 H new ATOM 0 HB2 PHE A 171 16.199 -9.825 9.203 1.00 7.21 H new ATOM 0 HB3 PHE A 171 16.884 -8.498 9.653 1.00 7.21 H new ATOM 0 HD1 PHE A 171 13.794 -9.775 8.543 1.00 8.88 H new ATOM 0 HD2 PHE A 171 15.562 -6.571 10.162 1.00 8.45 H new ATOM 0 HE1 PHE A 171 11.722 -8.836 8.945 1.00 10.92 H new ATOM 0 HE2 PHE A 171 13.483 -5.632 10.573 1.00 10.27 H new ATOM 0 HZ PHE A 171 11.569 -6.766 9.966 1.00 10.26 H new ATOM 1245 N GLY A 172 19.043 -8.123 7.275 1.00 5.59 N ATOM 1246 CA GLY A 172 20.463 -8.397 7.341 1.00 7.39 C ATOM 1247 C GLY A 172 21.131 -8.722 6.025 1.00 7.39 C ATOM 1248 O GLY A 172 22.341 -8.925 6.004 1.00 8.64 O ATOM 0 H GLY A 172 18.844 -7.305 7.097 1.00 5.59 H new ATOM 0 HA2 GLY A 172 20.907 -7.626 7.728 1.00 7.39 H new ATOM 0 HA3 GLY A 172 20.604 -9.140 7.948 1.00 7.39 H new ATOM 1249 N PHE A 173 20.380 -8.784 4.931 1.00 6.96 N ATOM 1250 CA PHE A 173 20.983 -9.064 3.634 1.00 6.91 C ATOM 1251 C PHE A 173 20.095 -8.552 2.518 1.00 6.95 C ATOM 1252 O PHE A 173 18.876 -8.397 2.701 1.00 7.26 O ATOM 1253 CB PHE A 173 21.243 -10.567 3.447 1.00 8.57 C ATOM 1254 CG PHE A 173 19.993 -11.386 3.226 1.00 6.55 C ATOM 1255 CD1 PHE A 173 19.667 -11.862 1.960 1.00 8.29 C ATOM 1256 CD2 PHE A 173 19.150 -11.694 4.284 1.00 7.94 C ATOM 1257 CE1 PHE A 173 18.516 -12.633 1.762 1.00 8.62 C ATOM 1258 CE2 PHE A 173 17.999 -12.466 4.088 1.00 7.50 C ATOM 1259 CZ PHE A 173 17.682 -12.925 2.828 1.00 7.99 C ATOM 0 H PHE A 173 19.528 -8.668 4.917 1.00 6.96 H new ATOM 0 HA PHE A 173 21.836 -8.604 3.601 1.00 6.91 H new ATOM 0 HB2 PHE A 173 21.837 -10.691 2.690 1.00 8.57 H new ATOM 0 HB3 PHE A 173 21.706 -10.905 4.230 1.00 8.57 H new ATOM 0 HD1 PHE A 173 20.220 -11.666 1.238 1.00 8.29 H new ATOM 0 HD2 PHE A 173 19.353 -11.383 5.137 1.00 7.94 H new ATOM 0 HE1 PHE A 173 18.311 -12.950 0.912 1.00 8.62 H new ATOM 0 HE2 PHE A 173 17.448 -12.669 4.809 1.00 7.50 H new ATOM 0 HZ PHE A 173 16.912 -13.428 2.694 1.00 7.99 H new ATOM 1260 N ILE A 174 20.711 -8.319 1.366 1.00 8.49 N ATOM 1261 CA ILE A 174 20.008 -7.933 0.158 1.00 9.45 C ATOM 1262 C ILE A 174 19.989 -9.121 -0.801 1.00 9.11 C ATOM 1263 O ILE A 174 21.041 -9.645 -1.192 1.00 11.85 O ATOM 1264 CB ILE A 174 20.660 -6.688 -0.457 1.00 11.70 C ATOM 1265 CG1 ILE A 174 20.312 -5.462 0.403 1.00 12.59 C ATOM 1266 CG2 ILE A 174 20.211 -6.488 -1.896 1.00 10.53 C ATOM 1267 CD1 ILE A 174 21.133 -4.235 0.085 1.00 19.51 C ATOM 0 H ILE A 174 21.563 -8.383 1.266 1.00 8.49 H new ATOM 0 HA ILE A 174 19.089 -7.695 0.359 1.00 9.45 H new ATOM 0 HB ILE A 174 21.623 -6.807 -0.471 1.00 11.70 H new ATOM 0 HG12 ILE A 174 19.373 -5.251 0.284 1.00 12.59 H new ATOM 0 HG13 ILE A 174 20.435 -5.689 1.338 1.00 12.59 H new ATOM 0 HG21 ILE A 174 20.636 -5.696 -2.261 1.00 10.53 H new ATOM 0 HG22 ILE A 174 20.462 -7.262 -2.424 1.00 10.53 H new ATOM 0 HG23 ILE A 174 19.248 -6.378 -1.922 1.00 10.53 H new ATOM 0 HD11 ILE A 174 20.861 -3.505 0.663 1.00 19.51 H new ATOM 0 HD12 ILE A 174 22.073 -4.428 0.229 1.00 19.51 H new ATOM 0 HD13 ILE A 174 20.994 -3.983 -0.841 1.00 19.51 H new ATOM 1268 N ASP A 175 18.791 -9.587 -1.134 1.00 7.15 N ATOM 1269 CA ASP A 175 18.623 -10.700 -2.056 1.00 8.46 C ATOM 1270 C ASP A 175 18.742 -10.175 -3.480 1.00 9.38 C ATOM 1271 O ASP A 175 17.804 -9.580 -4.014 1.00 9.45 O ATOM 1272 CB ASP A 175 17.257 -11.359 -1.837 1.00 9.62 C ATOM 1273 CG ASP A 175 16.999 -12.514 -2.777 1.00 10.89 C ATOM 1274 OD1 ASP A 175 15.902 -13.098 -2.691 1.00 12.83 O ATOM 1275 OD2 ASP A 175 17.876 -12.822 -3.617 1.00 11.29 O ATOM 0 H ASP A 175 18.053 -9.266 -0.831 1.00 7.15 H new ATOM 0 HA ASP A 175 19.309 -11.368 -1.900 1.00 8.46 H new ATOM 0 HB2 ASP A 175 17.199 -11.675 -0.922 1.00 9.62 H new ATOM 0 HB3 ASP A 175 16.561 -10.694 -1.952 1.00 9.62 H new ATOM 1276 N THR A 176 19.904 -10.387 -4.088 1.00 11.44 N ATOM 1277 CA THR A 176 20.186 -9.828 -5.404 1.00 10.84 C ATOM 1278 C THR A 176 19.387 -10.502 -6.521 1.00 11.80 C ATOM 1279 O THR A 176 19.439 -10.060 -7.669 1.00 15.39 O ATOM 1280 CB THR A 176 21.688 -9.895 -5.739 1.00 15.31 C ATOM 1281 OG1 THR A 176 22.112 -11.263 -5.732 1.00 18.58 O ATOM 1282 CG2 THR A 176 22.498 -9.106 -4.724 1.00 18.65 C ATOM 0 H THR A 176 20.544 -10.854 -3.754 1.00 11.44 H new ATOM 0 HA THR A 176 19.909 -8.900 -5.356 1.00 10.84 H new ATOM 0 HB THR A 176 21.832 -9.508 -6.617 1.00 15.31 H new ATOM 0 HG1 THR A 176 22.086 -11.568 -6.514 1.00 18.58 H new ATOM 0 HG21 THR A 176 23.440 -9.159 -4.950 1.00 18.65 H new ATOM 0 HG22 THR A 176 22.215 -8.178 -4.735 1.00 18.65 H new ATOM 0 HG23 THR A 176 22.357 -9.476 -3.839 1.00 18.65 H new ATOM 1283 N THR A 177 18.655 -11.565 -6.204 1.00 10.04 N ATOM 1284 CA THR A 177 17.780 -12.198 -7.191 1.00 11.53 C ATOM 1285 C THR A 177 16.360 -11.636 -7.162 1.00 11.56 C ATOM 1286 O THR A 177 15.515 -12.019 -7.977 1.00 12.88 O ATOM 1287 CB THR A 177 17.681 -13.733 -7.006 1.00 15.19 C ATOM 1288 OG1 THR A 177 16.883 -14.039 -5.855 1.00 14.33 O ATOM 1289 CG2 THR A 177 19.063 -14.370 -6.873 1.00 16.91 C ATOM 0 H THR A 177 18.649 -11.935 -5.428 1.00 10.04 H new ATOM 0 HA THR A 177 18.195 -11.998 -8.045 1.00 11.53 H new ATOM 0 HB THR A 177 17.258 -14.103 -7.797 1.00 15.19 H new ATOM 0 HG1 THR A 177 17.198 -13.646 -5.183 1.00 14.33 H new ATOM 0 HG21 THR A 177 18.968 -15.329 -6.759 1.00 16.91 H new ATOM 0 HG22 THR A 177 19.581 -14.190 -7.673 1.00 16.91 H new ATOM 0 HG23 THR A 177 19.519 -13.997 -6.102 1.00 16.91 H new ATOM 1290 N ALA A 178 16.092 -10.724 -6.227 1.00 10.30 N ATOM 1291 CA ALA A 178 14.728 -10.254 -5.989 1.00 9.47 C ATOM 1292 C ALA A 178 14.372 -8.969 -6.740 1.00 9.44 C ATOM 1293 O ALA A 178 13.252 -8.468 -6.616 1.00 10.74 O ATOM 1294 CB ALA A 178 14.487 -10.076 -4.485 1.00 8.91 C ATOM 0 H ALA A 178 16.687 -10.365 -5.720 1.00 10.30 H new ATOM 0 HA ALA A 178 14.141 -10.940 -6.343 1.00 9.47 H new ATOM 0 HB1 ALA A 178 13.580 -9.764 -4.337 1.00 8.91 H new ATOM 0 HB2 ALA A 178 14.614 -10.925 -4.034 1.00 8.91 H new ATOM 0 HB3 ALA A 178 15.114 -9.426 -4.131 1.00 8.91 H new ATOM 1295 N TYR A 179 15.306 -8.434 -7.518 1.00 9.00 N ATOM 1296 CA TYR A 179 15.042 -7.205 -8.253 1.00 7.78 C ATOM 1297 C TYR A 179 15.749 -7.226 -9.597 1.00 7.87 C ATOM 1298 O TYR A 179 16.613 -8.073 -9.832 1.00 10.23 O ATOM 1299 CB TYR A 179 15.468 -5.981 -7.436 1.00 7.62 C ATOM 1300 CG TYR A 179 16.922 -5.983 -7.038 1.00 7.80 C ATOM 1301 CD1 TYR A 179 17.321 -6.508 -5.816 1.00 8.75 C ATOM 1302 CD2 TYR A 179 17.902 -5.462 -7.878 1.00 7.35 C ATOM 1303 CE1 TYR A 179 18.649 -6.519 -5.439 1.00 8.95 C ATOM 1304 CE2 TYR A 179 19.242 -5.479 -7.507 1.00 7.83 C ATOM 1305 CZ TYR A 179 19.605 -6.004 -6.281 1.00 9.04 C ATOM 1306 OH TYR A 179 20.930 -6.029 -5.885 1.00 11.36 O ATOM 0 H TYR A 179 16.092 -8.764 -7.633 1.00 9.00 H new ATOM 0 HA TYR A 179 14.087 -7.144 -8.411 1.00 7.78 H new ATOM 0 HB2 TYR A 179 15.285 -5.180 -7.952 1.00 7.62 H new ATOM 0 HB3 TYR A 179 14.923 -5.933 -6.635 1.00 7.62 H new ATOM 0 HD1 TYR A 179 16.681 -6.859 -5.240 1.00 8.75 H new ATOM 0 HD2 TYR A 179 17.657 -5.098 -8.698 1.00 7.35 H new ATOM 0 HE1 TYR A 179 18.896 -6.875 -4.616 1.00 8.95 H new ATOM 0 HE2 TYR A 179 19.890 -5.139 -8.081 1.00 7.83 H new ATOM 0 HH TYR A 179 20.973 -6.184 -5.061 1.00 11.36 H new ATOM 1307 N THR A 180 15.369 -6.315 -10.480 1.00 7.90 N ATOM 1308 CA THR A 180 16.031 -6.172 -11.767 1.00 8.85 C ATOM 1309 C THR A 180 16.882 -4.909 -11.734 1.00 9.49 C ATOM 1310 O THR A 180 16.672 -4.032 -10.903 1.00 9.37 O ATOM 1311 CB THR A 180 15.014 -6.091 -12.914 1.00 11.24 C ATOM 1312 OG1 THR A 180 14.196 -4.925 -12.742 1.00 11.81 O ATOM 1313 CG2 THR A 180 14.132 -7.348 -12.933 1.00 12.99 C ATOM 0 H THR A 180 14.722 -5.763 -10.351 1.00 7.90 H new ATOM 0 HA THR A 180 16.587 -6.951 -11.925 1.00 8.85 H new ATOM 0 HB THR A 180 15.490 -6.033 -13.757 1.00 11.24 H new ATOM 0 HG1 THR A 180 13.453 -5.046 -13.116 1.00 11.81 H new ATOM 0 HG21 THR A 180 13.494 -7.285 -13.661 1.00 12.99 H new ATOM 0 HG22 THR A 180 14.689 -8.132 -13.058 1.00 12.99 H new ATOM 0 HG23 THR A 180 13.655 -7.422 -12.092 1.00 12.99 H new ATOM 1314 N GLY A 181 17.852 -4.820 -12.637 1.00 10.90 N ATOM 1315 CA GLY A 181 18.698 -3.642 -12.709 1.00 11.49 C ATOM 1316 C GLY A 181 19.468 -3.432 -11.420 1.00 8.12 C ATOM 1317 O GLY A 181 19.857 -4.387 -10.749 1.00 10.36 O ATOM 0 H GLY A 181 18.034 -5.430 -13.215 1.00 10.90 H new ATOM 0 HA2 GLY A 181 19.320 -3.733 -13.448 1.00 11.49 H new ATOM 0 HA3 GLY A 181 18.153 -2.861 -12.892 1.00 11.49 H new ATOM 1318 N SER A 182 19.705 -2.171 -11.080 1.00 9.00 N ATOM 1319 CA ASER A 182 20.453 -1.841 -9.875 0.64 9.45 C ATOM 1320 CA BSER A 182 20.451 -1.843 -9.874 0.36 9.47 C ATOM 1321 C SER A 182 19.581 -1.138 -8.843 1.00 7.32 C ATOM 1322 O SER A 182 18.474 -0.673 -9.148 1.00 8.21 O ATOM 1323 CB ASER A 182 21.651 -0.953 -10.209 0.64 12.09 C ATOM 1324 CB BSER A 182 21.666 -0.976 -10.211 0.36 12.05 C ATOM 1325 OG ASER A 182 21.215 0.310 -10.675 0.64 14.07 O ATOM 1326 OG BSER A 182 22.542 -1.658 -11.088 0.36 11.10 O ATOM 0 H ASER A 182 19.441 -1.491 -11.535 0.64 9.00 H new ATOM 0 H BSER A 182 19.442 -1.490 -11.535 0.36 9.00 H new ATOM 0 HA ASER A 182 20.763 -2.679 -9.497 0.64 9.47 H new ATOM 0 HA BSER A 182 20.753 -2.680 -9.488 0.36 9.47 H new ATOM 0 HB2ASER A 182 22.206 -0.840 -9.422 0.64 12.05 H new ATOM 0 HB2BSER A 182 21.373 -0.147 -10.620 0.36 12.05 H new ATOM 0 HB3ASER A 182 22.200 -1.381 -10.884 0.64 12.05 H new ATOM 0 HB3BSER A 182 22.136 -0.740 -9.396 0.36 12.05 H new ATOM 0 HG ASER A 182 21.874 0.747 -10.959 0.64 11.10 H new ATOM 0 HG BSER A 182 23.201 -1.168 -11.263 0.36 11.10 H new ATOM 1327 N ILE A 183 20.079 -1.077 -7.619 1.00 6.64 N ATOM 1328 CA ILE A 183 19.400 -0.357 -6.551 1.00 7.50 C ATOM 1329 C ILE A 183 19.939 1.069 -6.535 1.00 7.81 C ATOM 1330 O ILE A 183 21.159 1.282 -6.510 1.00 8.13 O ATOM 1331 CB ILE A 183 19.651 -1.023 -5.188 1.00 6.03 C ATOM 1332 CG1 ILE A 183 19.245 -2.501 -5.229 1.00 8.19 C ATOM 1333 CG2 ILE A 183 18.878 -0.309 -4.091 1.00 7.54 C ATOM 1334 CD1 ILE A 183 19.541 -3.262 -3.936 1.00 7.01 C ATOM 0 H ILE A 183 20.817 -1.450 -7.382 1.00 6.64 H new ATOM 0 HA ILE A 183 18.443 -0.365 -6.710 1.00 7.50 H new ATOM 0 HB ILE A 183 20.599 -0.961 -4.994 1.00 6.03 H new ATOM 0 HG12 ILE A 183 18.296 -2.561 -5.419 1.00 8.19 H new ATOM 0 HG13 ILE A 183 19.709 -2.934 -5.962 1.00 8.19 H new ATOM 0 HG21 ILE A 183 19.048 -0.742 -3.240 1.00 7.54 H new ATOM 0 HG22 ILE A 183 19.163 0.617 -4.044 1.00 7.54 H new ATOM 0 HG23 ILE A 183 17.929 -0.345 -4.287 1.00 7.54 H new ATOM 0 HD11 ILE A 183 19.260 -4.185 -4.032 1.00 7.01 H new ATOM 0 HD12 ILE A 183 20.493 -3.231 -3.753 1.00 7.01 H new ATOM 0 HD13 ILE A 183 19.058 -2.852 -3.201 1.00 7.01 H new ATOM 1335 N THR A 184 19.040 2.048 -6.597 1.00 7.39 N ATOM 1336 CA THR A 184 19.417 3.451 -6.498 1.00 6.31 C ATOM 1337 C THR A 184 19.155 3.939 -5.087 1.00 6.49 C ATOM 1338 O THR A 184 18.023 3.858 -4.582 1.00 7.29 O ATOM 1339 CB THR A 184 18.645 4.318 -7.501 1.00 7.99 C ATOM 1340 OG1 THR A 184 19.013 3.927 -8.829 1.00 10.73 O ATOM 1341 CG2 THR A 184 18.981 5.795 -7.311 1.00 7.47 C ATOM 0 H THR A 184 18.196 1.916 -6.698 1.00 7.39 H new ATOM 0 HA THR A 184 20.361 3.528 -6.709 1.00 6.31 H new ATOM 0 HB THR A 184 17.694 4.192 -7.357 1.00 7.99 H new ATOM 0 HG1 THR A 184 18.427 3.414 -9.143 1.00 10.73 H new ATOM 0 HG21 THR A 184 18.484 6.325 -7.953 1.00 7.47 H new ATOM 0 HG22 THR A 184 18.741 6.069 -6.412 1.00 7.47 H new ATOM 0 HG23 THR A 184 19.932 5.931 -7.447 1.00 7.47 H new ATOM 1342 N TYR A 185 20.201 4.422 -4.432 1.00 6.63 N ATOM 1343 CA TYR A 185 20.083 4.899 -3.070 1.00 5.90 C ATOM 1344 C TYR A 185 19.878 6.401 -3.033 1.00 7.22 C ATOM 1345 O TYR A 185 20.376 7.142 -3.893 1.00 9.41 O ATOM 1346 CB TYR A 185 21.299 4.489 -2.237 1.00 7.71 C ATOM 1347 CG TYR A 185 21.342 3.004 -1.942 1.00 6.69 C ATOM 1348 CD1 TYR A 185 20.823 2.498 -0.760 1.00 7.23 C ATOM 1349 CD2 TYR A 185 21.899 2.112 -2.847 1.00 6.86 C ATOM 1350 CE1 TYR A 185 20.865 1.144 -0.479 1.00 8.71 C ATOM 1351 CE2 TYR A 185 21.945 0.751 -2.576 1.00 6.76 C ATOM 1352 CZ TYR A 185 21.427 0.275 -1.385 1.00 6.80 C ATOM 1353 OH TYR A 185 21.467 -1.076 -1.104 1.00 7.68 O ATOM 0 H TYR A 185 20.992 4.481 -4.764 1.00 6.63 H new ATOM 0 HA TYR A 185 19.300 4.483 -2.677 1.00 5.90 H new ATOM 0 HB2 TYR A 185 22.108 4.743 -2.708 1.00 7.71 H new ATOM 0 HB3 TYR A 185 21.292 4.980 -1.400 1.00 7.71 H new ATOM 0 HD1 TYR A 185 20.439 3.080 -0.144 1.00 7.23 H new ATOM 0 HD2 TYR A 185 22.247 2.431 -3.648 1.00 6.86 H new ATOM 0 HE1 TYR A 185 20.514 0.822 0.320 1.00 8.71 H new ATOM 0 HE2 TYR A 185 22.321 0.164 -3.191 1.00 6.76 H new ATOM 0 HH TYR A 185 21.834 -1.484 -1.740 1.00 7.68 H new ATOM 1354 N THR A 186 19.163 6.847 -2.018 1.00 7.12 N ATOM 1355 CA THR A 186 18.781 8.239 -1.897 1.00 6.94 C ATOM 1356 C THR A 186 18.814 8.635 -0.426 1.00 6.04 C ATOM 1357 O THR A 186 18.652 7.792 0.460 1.00 7.05 O ATOM 1358 CB THR A 186 17.390 8.446 -2.543 1.00 7.06 C ATOM 1359 OG1 THR A 186 17.142 9.839 -2.763 1.00 8.14 O ATOM 1360 CG2 THR A 186 16.271 7.837 -1.696 1.00 8.23 C ATOM 0 H THR A 186 18.884 6.348 -1.376 1.00 7.12 H new ATOM 0 HA THR A 186 19.403 8.815 -2.368 1.00 6.94 H new ATOM 0 HB THR A 186 17.396 7.985 -3.397 1.00 7.06 H new ATOM 0 HG1 THR A 186 16.822 10.180 -2.065 1.00 8.14 H new ATOM 0 HG21 THR A 186 15.417 7.986 -2.132 1.00 8.23 H new ATOM 0 HG22 THR A 186 16.421 6.884 -1.598 1.00 8.23 H new ATOM 0 HG23 THR A 186 16.264 8.254 -0.820 1.00 8.23 H new ATOM 1361 N ALA A 187 19.061 9.914 -0.160 1.00 6.99 N ATOM 1362 CA ALA A 187 19.280 10.387 1.196 1.00 7.34 C ATOM 1363 C ALA A 187 18.019 10.342 2.049 1.00 8.54 C ATOM 1364 O ALA A 187 16.902 10.485 1.549 1.00 8.13 O ATOM 1365 CB ALA A 187 19.854 11.808 1.178 1.00 9.35 C ATOM 0 H ALA A 187 19.106 10.528 -0.761 1.00 6.99 H new ATOM 0 HA ALA A 187 19.919 9.782 1.603 1.00 7.34 H new ATOM 0 HB1 ALA A 187 19.995 12.112 2.088 1.00 9.35 H new ATOM 0 HB2 ALA A 187 20.699 11.810 0.702 1.00 9.35 H new ATOM 0 HB3 ALA A 187 19.231 12.403 0.732 1.00 9.35 H new ATOM 1366 N VAL A 188 18.220 10.180 3.349 1.00 7.87 N ATOM 1367 CA VAL A 188 17.133 10.111 4.313 1.00 8.57 C ATOM 1368 C VAL A 188 17.330 11.168 5.397 1.00 7.84 C ATOM 1369 O VAL A 188 18.453 11.377 5.882 1.00 9.05 O ATOM 1370 CB VAL A 188 17.065 8.693 4.950 1.00 7.90 C ATOM 1371 CG1 VAL A 188 16.242 8.685 6.227 1.00 9.39 C ATOM 1372 CG2 VAL A 188 16.536 7.674 3.936 1.00 8.80 C ATOM 0 H VAL A 188 19.001 10.106 3.701 1.00 7.87 H new ATOM 0 HA VAL A 188 16.296 10.283 3.854 1.00 8.57 H new ATOM 0 HB VAL A 188 17.967 8.435 5.197 1.00 7.90 H new ATOM 0 HG11 VAL A 188 16.222 7.787 6.594 1.00 9.39 H new ATOM 0 HG12 VAL A 188 16.640 9.289 6.873 1.00 9.39 H new ATOM 0 HG13 VAL A 188 15.337 8.973 6.031 1.00 9.39 H new ATOM 0 HG21 VAL A 188 16.500 6.796 4.348 1.00 8.80 H new ATOM 0 HG22 VAL A 188 15.646 7.934 3.650 1.00 8.80 H new ATOM 0 HG23 VAL A 188 17.127 7.646 3.167 1.00 8.80 H new ATOM 1373 N SER A 189 16.249 11.848 5.762 1.00 7.67 N ATOM 1374 CA SER A 189 16.240 12.656 6.969 1.00 8.20 C ATOM 1375 C SER A 189 15.541 11.878 8.071 1.00 9.81 C ATOM 1376 O SER A 189 14.422 11.398 7.878 1.00 9.74 O ATOM 1377 CB SER A 189 15.500 13.968 6.728 1.00 11.15 C ATOM 1378 OG SER A 189 15.338 14.665 7.952 1.00 13.68 O ATOM 0 H SER A 189 15.510 11.853 5.322 1.00 7.67 H new ATOM 0 HA SER A 189 17.153 12.859 7.225 1.00 8.20 H new ATOM 0 HB2 SER A 189 15.994 14.516 6.098 1.00 11.15 H new ATOM 0 HB3 SER A 189 14.633 13.791 6.331 1.00 11.15 H new ATOM 0 HG SER A 189 14.931 15.387 7.812 1.00 13.68 H new ATOM 1379 N THR A 190 16.198 11.750 9.221 1.00 9.96 N ATOM 1380 CA THR A 190 15.626 11.031 10.356 1.00 11.25 C ATOM 1381 C THR A 190 15.079 11.978 11.414 1.00 11.77 C ATOM 1382 O THR A 190 14.679 11.537 12.489 1.00 12.82 O ATOM 1383 CB THR A 190 16.673 10.135 11.036 1.00 13.66 C ATOM 1384 OG1 THR A 190 17.722 10.954 11.567 1.00 14.52 O ATOM 1385 CG2 THR A 190 17.262 9.145 10.041 1.00 13.33 C ATOM 0 H THR A 190 16.981 12.075 9.365 1.00 9.96 H new ATOM 0 HA THR A 190 14.905 10.494 9.992 1.00 11.25 H new ATOM 0 HB THR A 190 16.242 9.639 11.750 1.00 13.66 H new ATOM 0 HG1 THR A 190 18.432 10.507 11.610 1.00 14.52 H new ATOM 0 HG21 THR A 190 17.920 8.589 10.488 1.00 13.33 H new ATOM 0 HG22 THR A 190 16.555 8.585 9.684 1.00 13.33 H new ATOM 0 HG23 THR A 190 17.687 9.629 9.316 1.00 13.33 H new ATOM 1386 N LYS A 191 15.064 13.275 11.113 1.00 12.28 N ATOM 1387 CA LYS A 191 14.750 14.290 12.121 1.00 15.22 C ATOM 1388 C LYS A 191 13.360 14.139 12.734 1.00 19.51 C ATOM 1389 O LYS A 191 13.162 14.436 13.912 1.00 20.50 O ATOM 1390 CB LYS A 191 14.926 15.689 11.537 1.00 18.45 C ATOM 0 H LYS A 191 15.233 13.590 10.331 1.00 12.28 H new ATOM 0 HA LYS A 191 15.379 14.155 12.847 1.00 15.22 H new ATOM 1391 N GLN A 192 12.398 13.685 11.937 1.00 14.91 N ATOM 1392 CA GLN A 192 11.041 13.491 12.427 1.00 17.15 C ATOM 1393 C GLN A 192 10.788 12.052 12.867 1.00 13.11 C ATOM 1394 O GLN A 192 9.687 11.723 13.305 1.00 15.70 O ATOM 1395 CB GLN A 192 10.021 13.899 11.367 1.00 14.96 C ATOM 1396 CG GLN A 192 10.098 15.367 10.977 1.00 19.54 C ATOM 1397 CD GLN A 192 9.811 16.293 12.141 1.00 33.17 C ATOM 1398 OE1 GLN A 192 9.006 15.978 13.017 1.00 38.50 O ATOM 1399 NE2 GLN A 192 10.479 17.441 12.162 1.00 41.99 N ATOM 0 H GLN A 192 12.512 13.484 11.109 1.00 14.91 H new ATOM 0 HA GLN A 192 10.938 14.060 13.206 1.00 17.15 H new ATOM 0 HB2 GLN A 192 10.154 13.355 10.575 1.00 14.96 H new ATOM 0 HB3 GLN A 192 9.129 13.707 11.697 1.00 14.96 H new ATOM 0 HG2 GLN A 192 10.981 15.559 10.625 1.00 19.54 H new ATOM 0 HG3 GLN A 192 9.464 15.543 10.264 1.00 19.54 H new ATOM 0 HE21 GLN A 192 11.034 17.627 11.532 1.00 41.99 H new ATOM 0 HE22 GLN A 192 10.357 17.998 12.806 1.00 41.99 H new ATOM 1400 N GLY A 193 11.806 11.204 12.749 1.00 10.31 N ATOM 1401 CA GLY A 193 11.704 9.816 13.171 1.00 11.12 C ATOM 1402 C GLY A 193 11.265 8.842 12.091 1.00 8.06 C ATOM 1403 O GLY A 193 11.132 7.646 12.367 1.00 8.77 O ATOM 0 H GLY A 193 12.572 11.419 12.423 1.00 10.31 H new ATOM 0 HA2 GLY A 193 12.567 9.532 13.511 1.00 11.12 H new ATOM 0 HA3 GLY A 193 11.077 9.763 13.909 1.00 11.12 H new ATOM 1404 N PHE A 194 11.060 9.338 10.871 1.00 7.74 N ATOM 1405 CA PHE A 194 10.570 8.525 9.758 1.00 8.21 C ATOM 1406 C PHE A 194 11.652 8.290 8.718 1.00 7.00 C ATOM 1407 O PHE A 194 12.695 8.956 8.713 1.00 7.72 O ATOM 1408 CB PHE A 194 9.397 9.217 9.058 1.00 10.77 C ATOM 1409 CG PHE A 194 8.223 9.490 9.945 1.00 10.66 C ATOM 1410 CD1 PHE A 194 8.006 10.757 10.460 1.00 20.28 C ATOM 1411 CD2 PHE A 194 7.325 8.487 10.254 1.00 11.01 C ATOM 1412 CE1 PHE A 194 6.912 11.012 11.273 1.00 22.90 C ATOM 1413 CE2 PHE A 194 6.232 8.731 11.061 1.00 12.73 C ATOM 1414 CZ PHE A 194 6.024 9.995 11.575 1.00 17.50 C ATOM 0 H PHE A 194 11.202 10.161 10.665 1.00 7.74 H new ATOM 0 HA PHE A 194 10.290 7.677 10.137 1.00 8.21 H new ATOM 0 HB2 PHE A 194 9.707 10.056 8.683 1.00 10.77 H new ATOM 0 HB3 PHE A 194 9.106 8.665 8.315 1.00 10.77 H new ATOM 0 HD1 PHE A 194 8.600 11.444 10.259 1.00 20.28 H new ATOM 0 HD2 PHE A 194 7.459 7.632 9.912 1.00 11.01 H new ATOM 0 HE1 PHE A 194 6.775 11.866 11.615 1.00 22.90 H new ATOM 0 HE2 PHE A 194 5.636 8.044 11.258 1.00 12.73 H new ATOM 0 HZ PHE A 194 5.290 10.162 12.122 1.00 17.50 H new ATOM 1415 N TRP A 195 11.381 7.356 7.809 1.00 7.41 N ATOM 1416 CA TRP A 195 12.209 7.175 6.630 1.00 7.80 C ATOM 1417 C TRP A 195 11.796 8.210 5.586 1.00 6.75 C ATOM 1418 O TRP A 195 11.066 7.917 4.624 1.00 7.24 O ATOM 1419 CB TRP A 195 12.087 5.745 6.093 1.00 7.25 C ATOM 1420 CG TRP A 195 12.648 4.707 7.032 1.00 6.33 C ATOM 1421 CD1 TRP A 195 11.982 4.052 8.023 1.00 7.39 C ATOM 1422 CD2 TRP A 195 13.991 4.209 7.056 1.00 6.04 C ATOM 1423 NE1 TRP A 195 12.823 3.173 8.662 1.00 7.13 N ATOM 1424 CE2 TRP A 195 14.066 3.260 8.093 1.00 6.43 C ATOM 1425 CE3 TRP A 195 15.140 4.472 6.298 1.00 6.76 C ATOM 1426 CZ2 TRP A 195 15.243 2.571 8.390 1.00 7.20 C ATOM 1427 CZ3 TRP A 195 16.302 3.789 6.592 1.00 7.17 C ATOM 1428 CH2 TRP A 195 16.348 2.845 7.626 1.00 7.27 C ATOM 0 H TRP A 195 10.715 6.814 7.861 1.00 7.41 H new ATOM 0 HA TRP A 195 13.143 7.308 6.855 1.00 7.80 H new ATOM 0 HB2 TRP A 195 11.152 5.548 5.924 1.00 7.25 H new ATOM 0 HB3 TRP A 195 12.548 5.685 5.242 1.00 7.25 H new ATOM 0 HD1 TRP A 195 11.086 4.181 8.237 1.00 7.39 H new ATOM 0 HE1 TRP A 195 12.605 2.654 9.312 1.00 7.13 H new ATOM 0 HE3 TRP A 195 15.120 5.096 5.609 1.00 6.76 H new ATOM 0 HZ2 TRP A 195 15.276 1.949 9.081 1.00 7.20 H new ATOM 0 HZ3 TRP A 195 17.069 3.958 6.094 1.00 7.17 H new ATOM 0 HH2 TRP A 195 17.144 2.395 7.798 1.00 7.27 H new ATOM 1429 N GLU A 196 12.263 9.437 5.802 1.00 7.22 N ATOM 1430 CA GLU A 196 11.871 10.584 4.993 1.00 8.15 C ATOM 1431 C GLU A 196 12.903 10.829 3.904 1.00 7.16 C ATOM 1432 O GLU A 196 14.110 10.884 4.168 1.00 8.41 O ATOM 1433 CB GLU A 196 11.721 11.822 5.875 1.00 9.26 C ATOM 1434 CG GLU A 196 11.151 13.024 5.146 1.00 11.78 C ATOM 1435 CD GLU A 196 10.774 14.138 6.097 1.00 23.52 C ATOM 1436 OE1 GLU A 196 10.244 15.165 5.625 1.00 25.24 O ATOM 1437 OE2 GLU A 196 11.007 13.980 7.316 1.00 17.88 O ATOM 0 H GLU A 196 12.821 9.627 6.428 1.00 7.22 H new ATOM 0 HA GLU A 196 11.016 10.398 4.574 1.00 8.15 H new ATOM 0 HB2 GLU A 196 11.146 11.607 6.626 1.00 9.26 H new ATOM 0 HB3 GLU A 196 12.589 12.056 6.240 1.00 9.26 H new ATOM 0 HG2 GLU A 196 11.803 13.352 4.507 1.00 11.78 H new ATOM 0 HG3 GLU A 196 10.369 12.753 4.640 1.00 11.78 H new ATOM 1438 N TRP A 197 12.429 10.978 2.678 1.00 7.34 N ATOM 1439 CA TRP A 197 13.299 11.116 1.521 1.00 6.64 C ATOM 1440 C TRP A 197 12.656 12.059 0.507 1.00 6.05 C ATOM 1441 O TRP A 197 11.559 12.564 0.740 1.00 7.64 O ATOM 1442 CB TRP A 197 13.575 9.740 0.905 1.00 6.34 C ATOM 1443 CG TRP A 197 12.354 9.086 0.310 1.00 5.57 C ATOM 1444 CD1 TRP A 197 11.282 8.568 0.984 1.00 7.61 C ATOM 1445 CD2 TRP A 197 12.103 8.866 -1.081 1.00 5.91 C ATOM 1446 NE1 TRP A 197 10.364 8.052 0.083 1.00 7.13 N ATOM 1447 CE2 TRP A 197 10.848 8.223 -1.188 1.00 6.67 C ATOM 1448 CE3 TRP A 197 12.811 9.165 -2.250 1.00 7.16 C ATOM 1449 CZ2 TRP A 197 10.290 7.872 -2.422 1.00 7.33 C ATOM 1450 CZ3 TRP A 197 12.261 8.817 -3.466 1.00 6.75 C ATOM 1451 CH2 TRP A 197 11.015 8.165 -3.544 1.00 7.33 C ATOM 0 H TRP A 197 11.590 11.002 2.491 1.00 7.34 H new ATOM 0 HA TRP A 197 14.149 11.496 1.795 1.00 6.64 H new ATOM 0 HB2 TRP A 197 14.251 9.833 0.215 1.00 6.34 H new ATOM 0 HB3 TRP A 197 13.944 9.157 1.587 1.00 6.34 H new ATOM 0 HD1 TRP A 197 11.184 8.563 1.909 1.00 7.61 H new ATOM 0 HE1 TRP A 197 9.614 7.685 0.288 1.00 7.13 H new ATOM 0 HE3 TRP A 197 13.637 9.590 -2.208 1.00 7.16 H new ATOM 0 HZ2 TRP A 197 9.460 7.456 -2.477 1.00 7.33 H new ATOM 0 HZ3 TRP A 197 12.721 9.017 -4.249 1.00 6.75 H new ATOM 0 HH2 TRP A 197 10.678 7.928 -4.378 1.00 7.33 H new ATOM 1452 N THR A 198 13.343 12.307 -0.599 1.00 6.93 N ATOM 1453 CA THR A 198 12.845 13.251 -1.597 1.00 7.23 C ATOM 1454 C THR A 198 12.844 12.614 -2.973 1.00 6.98 C ATOM 1455 O THR A 198 13.902 12.332 -3.546 1.00 7.34 O ATOM 1456 CB THR A 198 13.696 14.535 -1.635 1.00 7.30 C ATOM 1457 OG1 THR A 198 13.688 15.139 -0.341 1.00 10.13 O ATOM 1458 CG2 THR A 198 13.139 15.532 -2.666 1.00 10.45 C ATOM 0 H THR A 198 14.097 11.942 -0.793 1.00 6.93 H new ATOM 0 HA THR A 198 11.939 13.487 -1.344 1.00 7.23 H new ATOM 0 HB THR A 198 14.602 14.301 -1.892 1.00 7.30 H new ATOM 0 HG1 THR A 198 13.087 15.725 -0.309 1.00 10.13 H new ATOM 0 HG21 THR A 198 13.689 16.331 -2.673 1.00 10.45 H new ATOM 0 HG22 THR A 198 13.148 15.126 -3.547 1.00 10.45 H new ATOM 0 HG23 THR A 198 12.229 15.768 -2.429 1.00 10.45 H new ATOM 1459 N SER A 199 11.653 12.377 -3.506 1.00 6.91 N ATOM 1460 CA SER A 199 11.531 11.886 -4.863 1.00 6.95 C ATOM 1461 C SER A 199 11.883 13.009 -5.836 1.00 6.13 C ATOM 1462 O SER A 199 11.658 14.192 -5.545 1.00 7.36 O ATOM 1463 CB SER A 199 10.104 11.373 -5.118 1.00 7.16 C ATOM 1464 OG SER A 199 9.879 11.060 -6.486 1.00 6.98 O ATOM 0 H SER A 199 10.906 12.495 -3.097 1.00 6.91 H new ATOM 0 HA SER A 199 12.144 11.146 -4.997 1.00 6.95 H new ATOM 0 HB2 SER A 199 9.945 10.583 -4.577 1.00 7.16 H new ATOM 0 HB3 SER A 199 9.465 12.045 -4.833 1.00 7.16 H new ATOM 0 HG SER A 199 10.498 10.566 -6.766 1.00 6.98 H new ATOM 1465 N THR A 200 12.414 12.639 -6.995 1.00 6.53 N ATOM 1466 CA THR A 200 12.868 13.613 -7.989 1.00 7.12 C ATOM 1467 C THR A 200 11.815 13.974 -9.046 1.00 9.65 C ATOM 1468 O THR A 200 12.082 14.790 -9.931 1.00 9.10 O ATOM 1469 CB THR A 200 14.120 13.094 -8.695 1.00 7.58 C ATOM 1470 OG1 THR A 200 13.866 11.750 -9.121 1.00 7.94 O ATOM 1471 CG2 THR A 200 15.320 13.111 -7.740 1.00 10.28 C ATOM 0 H THR A 200 12.523 11.819 -7.230 1.00 6.53 H new ATOM 0 HA THR A 200 13.054 14.425 -7.492 1.00 7.12 H new ATOM 0 HB THR A 200 14.327 13.661 -9.455 1.00 7.58 H new ATOM 0 HG1 THR A 200 14.570 11.418 -9.435 1.00 7.94 H new ATOM 0 HG21 THR A 200 16.106 12.779 -8.202 1.00 10.28 H new ATOM 0 HG22 THR A 200 15.481 14.019 -7.439 1.00 10.28 H new ATOM 0 HG23 THR A 200 15.133 12.546 -6.974 1.00 10.28 H new ATOM 1472 N GLY A 201 10.633 13.368 -8.979 1.00 7.01 N ATOM 1473 CA GLY A 201 9.543 13.781 -9.855 1.00 6.39 C ATOM 1474 C GLY A 201 8.602 12.663 -10.235 1.00 5.07 C ATOM 1475 O GLY A 201 8.577 11.616 -9.584 1.00 6.64 O ATOM 0 H GLY A 201 10.444 12.724 -8.441 1.00 7.01 H new ATOM 0 HA2 GLY A 201 9.036 14.483 -9.417 1.00 6.39 H new ATOM 0 HA3 GLY A 201 9.918 14.164 -10.663 1.00 6.39 H new ATOM 1476 N TYR A 202 7.809 12.877 -11.279 1.00 6.14 N ATOM 1477 CA TYR A 202 6.799 11.892 -11.628 1.00 5.61 C ATOM 1478 C TYR A 202 6.402 11.969 -13.092 1.00 6.37 C ATOM 1479 O TYR A 202 6.660 12.966 -13.775 1.00 7.16 O ATOM 1480 CB TYR A 202 5.549 12.093 -10.759 1.00 7.14 C ATOM 1481 CG TYR A 202 4.794 13.357 -11.103 1.00 6.43 C ATOM 1482 CD1 TYR A 202 5.187 14.588 -10.577 1.00 7.99 C ATOM 1483 CD2 TYR A 202 3.717 13.329 -11.984 1.00 8.77 C ATOM 1484 CE1 TYR A 202 4.508 15.755 -10.904 1.00 8.92 C ATOM 1485 CE2 TYR A 202 3.034 14.499 -12.315 1.00 8.68 C ATOM 1486 CZ TYR A 202 3.438 15.696 -11.773 1.00 8.31 C ATOM 1487 OH TYR A 202 2.751 16.853 -12.107 1.00 12.70 O ATOM 0 H TYR A 202 7.839 13.570 -11.787 1.00 6.14 H new ATOM 0 HA TYR A 202 7.186 11.017 -11.467 1.00 5.61 H new ATOM 0 HB2 TYR A 202 4.960 11.330 -10.866 1.00 7.14 H new ATOM 0 HB3 TYR A 202 5.810 12.121 -9.825 1.00 7.14 H new ATOM 0 HD1 TYR A 202 5.914 14.628 -9.999 1.00 7.99 H new ATOM 0 HD2 TYR A 202 3.449 12.520 -12.357 1.00 8.77 H new ATOM 0 HE1 TYR A 202 4.772 16.569 -10.540 1.00 8.92 H new ATOM 0 HE2 TYR A 202 2.310 14.470 -12.898 1.00 8.68 H new ATOM 0 HH TYR A 202 2.520 16.819 -12.914 1.00 12.70 H new ATOM 1488 N ALA A 203 5.747 10.916 -13.566 1.00 6.57 N ATOM 1489 CA ALA A 203 5.104 10.923 -14.870 1.00 7.31 C ATOM 1490 C ALA A 203 3.781 10.189 -14.741 1.00 7.72 C ATOM 1491 O ALA A 203 3.612 9.326 -13.875 1.00 8.01 O ATOM 1492 CB ALA A 203 5.979 10.252 -15.926 1.00 8.70 C ATOM 0 H ALA A 203 5.664 10.175 -13.137 1.00 6.57 H new ATOM 0 HA ALA A 203 4.962 11.839 -15.156 1.00 7.31 H new ATOM 0 HB1 ALA A 203 5.525 10.272 -16.783 1.00 8.70 H new ATOM 0 HB2 ALA A 203 6.822 10.726 -15.996 1.00 8.70 H new ATOM 0 HB3 ALA A 203 6.146 9.331 -15.671 1.00 8.70 H new ATOM 1493 N VAL A 204 2.841 10.545 -15.604 1.00 6.63 N ATOM 1494 CA VAL A 204 1.533 9.900 -15.654 1.00 8.54 C ATOM 1495 C VAL A 204 1.433 9.126 -16.958 1.00 8.04 C ATOM 1496 O VAL A 204 1.580 9.706 -18.037 1.00 9.01 O ATOM 1497 CB VAL A 204 0.387 10.938 -15.572 1.00 8.59 C ATOM 1498 CG1 VAL A 204 -0.970 10.256 -15.744 1.00 9.28 C ATOM 1499 CG2 VAL A 204 0.445 11.700 -14.249 1.00 9.66 C ATOM 0 H VAL A 204 2.943 11.173 -16.183 1.00 6.63 H new ATOM 0 HA VAL A 204 1.444 9.305 -14.893 1.00 8.54 H new ATOM 0 HB VAL A 204 0.500 11.575 -16.294 1.00 8.59 H new ATOM 0 HG11 VAL A 204 -1.675 10.920 -15.690 1.00 9.28 H new ATOM 0 HG12 VAL A 204 -1.005 9.818 -16.609 1.00 9.28 H new ATOM 0 HG13 VAL A 204 -1.092 9.597 -15.043 1.00 9.28 H new ATOM 0 HG21 VAL A 204 -0.279 12.345 -14.215 1.00 9.66 H new ATOM 0 HG22 VAL A 204 0.357 11.076 -13.512 1.00 9.66 H new ATOM 0 HG23 VAL A 204 1.294 12.164 -14.179 1.00 9.66 H new ATOM 1500 N GLY A 205 1.211 7.818 -16.876 1.00 7.82 N ATOM 1501 CA GLY A 205 1.151 6.979 -18.055 1.00 9.82 C ATOM 1502 C GLY A 205 2.413 7.122 -18.881 1.00 9.00 C ATOM 1503 O GLY A 205 3.528 7.086 -18.353 1.00 10.26 O ATOM 0 H GLY A 205 1.092 7.398 -16.135 1.00 7.82 H new ATOM 0 HA2 GLY A 205 1.034 6.053 -17.792 1.00 9.82 H new ATOM 0 HA3 GLY A 205 0.379 7.221 -18.591 1.00 9.82 H new ATOM 1504 N SER A 206 2.230 7.302 -20.186 1.00 11.03 N ATOM 1505 CA SER A 206 3.349 7.442 -21.109 1.00 12.06 C ATOM 1506 C SER A 206 3.796 8.890 -21.252 1.00 12.41 C ATOM 1507 O SER A 206 4.565 9.224 -22.155 1.00 16.45 O ATOM 1508 CB SER A 206 2.960 6.889 -22.480 1.00 15.22 C ATOM 1509 OG SER A 206 1.813 7.555 -22.981 1.00 21.07 O ATOM 0 H SER A 206 1.456 7.346 -20.559 1.00 11.03 H new ATOM 0 HA SER A 206 4.093 6.938 -20.744 1.00 12.06 H new ATOM 0 HB2 SER A 206 3.699 6.997 -23.099 1.00 15.22 H new ATOM 0 HB3 SER A 206 2.784 5.938 -22.412 1.00 15.22 H new ATOM 0 HG SER A 206 2.051 8.167 -23.505 1.00 21.07 H new ATOM 1510 N GLY A 207 3.311 9.751 -20.366 1.00 11.43 N ATOM 1511 CA GLY A 207 3.609 11.169 -20.418 1.00 13.72 C ATOM 1512 C GLY A 207 5.050 11.502 -20.088 1.00 14.88 C ATOM 1513 O GLY A 207 5.820 10.652 -19.634 1.00 13.17 O ATOM 0 H GLY A 207 2.797 9.524 -19.715 1.00 11.43 H new ATOM 0 HA2 GLY A 207 3.404 11.502 -21.306 1.00 13.72 H new ATOM 0 HA3 GLY A 207 3.027 11.636 -19.798 1.00 13.72 H new ATOM 1514 N THR A 208 5.419 12.753 -20.326 1.00 17.62 N ATOM 1515 CA THR A 208 6.769 13.199 -20.033 1.00 17.43 C ATOM 1516 C THR A 208 6.995 13.324 -18.528 1.00 14.22 C ATOM 1517 O THR A 208 6.086 13.671 -17.767 1.00 17.13 O ATOM 1518 CB THR A 208 7.083 14.537 -20.719 1.00 22.62 C ATOM 1519 OG1 THR A 208 6.119 15.517 -20.318 1.00 25.72 O ATOM 1520 CG2 THR A 208 7.041 14.379 -22.232 1.00 22.96 C ATOM 0 H THR A 208 4.903 13.357 -20.656 1.00 17.62 H new ATOM 0 HA THR A 208 7.372 12.525 -20.385 1.00 17.43 H new ATOM 0 HB THR A 208 7.972 14.822 -20.456 1.00 22.62 H new ATOM 0 HG1 THR A 208 5.603 15.682 -20.960 1.00 25.72 H new ATOM 0 HG21 THR A 208 7.241 15.230 -22.652 1.00 22.96 H new ATOM 0 HG22 THR A 208 7.698 13.721 -22.507 1.00 22.96 H new ATOM 0 HG23 THR A 208 6.157 14.085 -22.502 1.00 22.96 H new ATOM 1521 N PHE A 209 8.220 13.038 -18.111 1.00 12.99 N ATOM 1522 CA PHE A 209 8.589 13.098 -16.707 1.00 11.70 C ATOM 1523 C PHE A 209 8.732 14.552 -16.267 1.00 11.57 C ATOM 1524 O PHE A 209 9.392 15.356 -16.935 1.00 15.14 O ATOM 1525 CB PHE A 209 9.897 12.334 -16.487 1.00 12.50 C ATOM 1526 CG PHE A 209 10.304 12.223 -15.042 1.00 11.26 C ATOM 1527 CD1 PHE A 209 11.198 13.122 -14.492 1.00 10.95 C ATOM 1528 CD2 PHE A 209 9.790 11.215 -14.235 1.00 11.92 C ATOM 1529 CE1 PHE A 209 11.584 13.020 -13.169 1.00 11.12 C ATOM 1530 CE2 PHE A 209 10.168 11.115 -12.908 1.00 10.40 C ATOM 1531 CZ PHE A 209 11.069 12.012 -12.376 1.00 9.94 C ATOM 0 H PHE A 209 8.861 12.804 -18.635 1.00 12.99 H new ATOM 0 HA PHE A 209 7.893 12.685 -16.172 1.00 11.70 H new ATOM 0 HB2 PHE A 209 9.806 11.442 -16.858 1.00 12.50 H new ATOM 0 HB3 PHE A 209 10.606 12.776 -16.980 1.00 12.50 H new ATOM 0 HD1 PHE A 209 11.545 13.805 -15.019 1.00 10.95 H new ATOM 0 HD2 PHE A 209 9.187 10.603 -14.590 1.00 11.92 H new ATOM 0 HE1 PHE A 209 12.190 13.629 -12.813 1.00 11.12 H new ATOM 0 HE2 PHE A 209 9.813 10.441 -12.374 1.00 10.40 H new ATOM 0 HZ PHE A 209 11.330 11.939 -11.486 1.00 9.94 H new ATOM 1532 N LYS A 210 8.101 14.886 -15.148 1.00 8.78 N ATOM 1533 CA LYS A 210 8.177 16.214 -14.552 1.00 9.63 C ATOM 1534 C LYS A 210 9.193 16.174 -13.429 1.00 9.59 C ATOM 1535 O LYS A 210 9.015 15.451 -12.454 1.00 9.31 O ATOM 1536 CB LYS A 210 6.804 16.606 -14.000 1.00 10.98 C ATOM 1537 CG LYS A 210 6.777 17.914 -13.229 1.00 13.85 C ATOM 1538 CD LYS A 210 6.869 19.091 -14.170 1.00 14.94 C ATOM 1539 CE LYS A 210 6.491 20.383 -13.474 1.00 14.04 C ATOM 1540 NZ LYS A 210 6.562 21.499 -14.438 1.00 13.77 N ATOM 0 H LYS A 210 7.608 14.338 -14.706 1.00 8.78 H new ATOM 0 HA LYS A 210 8.444 16.868 -15.217 1.00 9.63 H new ATOM 0 HB2 LYS A 210 6.178 16.668 -14.739 1.00 10.98 H new ATOM 0 HB3 LYS A 210 6.488 15.896 -13.419 1.00 10.98 H new ATOM 0 HG2 LYS A 210 5.959 17.972 -12.710 1.00 13.85 H new ATOM 0 HG3 LYS A 210 7.515 17.939 -12.600 1.00 13.85 H new ATOM 0 HD2 LYS A 210 7.772 19.160 -14.517 1.00 14.94 H new ATOM 0 HD3 LYS A 210 6.283 18.947 -14.930 1.00 14.94 H new ATOM 0 HE2 LYS A 210 5.595 20.315 -13.108 1.00 14.04 H new ATOM 0 HE3 LYS A 210 7.090 20.548 -12.729 1.00 14.04 H new ATOM 0 HZ1 LYS A 210 7.003 22.180 -14.072 1.00 13.77 H new ATOM 0 HZ2 LYS A 210 6.987 21.231 -15.172 1.00 13.77 H new ATOM 0 HZ3 LYS A 210 5.738 21.760 -14.651 1.00 13.77 H new ATOM 1541 N SER A 211 10.275 16.930 -13.574 1.00 10.22 N ATOM 1542 CA SER A 211 11.295 17.009 -12.542 1.00 10.24 C ATOM 1543 C SER A 211 10.849 17.971 -11.462 1.00 11.58 C ATOM 1544 O SER A 211 10.663 19.163 -11.715 1.00 15.08 O ATOM 1545 CB SER A 211 12.615 17.480 -13.137 1.00 12.64 C ATOM 1546 OG SER A 211 13.184 16.462 -13.939 1.00 20.67 O ATOM 0 H SER A 211 10.436 17.408 -14.270 1.00 10.22 H new ATOM 0 HA SER A 211 11.423 16.127 -12.158 1.00 10.24 H new ATOM 0 HB2 SER A 211 12.470 18.277 -13.670 1.00 12.64 H new ATOM 0 HB3 SER A 211 13.229 17.722 -12.426 1.00 12.64 H new ATOM 0 HG SER A 211 12.819 16.464 -14.695 1.00 20.67 H new ATOM 1547 N THR A 212 10.660 17.455 -10.256 1.00 9.87 N ATOM 1548 CA THR A 212 10.187 18.262 -9.148 1.00 11.08 C ATOM 1549 C THR A 212 10.435 17.502 -7.856 1.00 11.67 C ATOM 1550 O THR A 212 10.247 16.288 -7.801 1.00 10.98 O ATOM 1551 CB THR A 212 8.687 18.619 -9.313 1.00 10.99 C ATOM 1552 OG1 THR A 212 8.271 19.489 -8.252 1.00 16.53 O ATOM 1553 CG2 THR A 212 7.814 17.371 -9.338 1.00 11.60 C ATOM 0 H THR A 212 10.802 16.630 -10.059 1.00 9.87 H new ATOM 0 HA THR A 212 10.672 19.102 -9.128 1.00 11.08 H new ATOM 0 HB THR A 212 8.580 19.073 -10.164 1.00 10.99 H new ATOM 0 HG1 THR A 212 7.975 19.031 -7.613 1.00 16.53 H new ATOM 0 HG21 THR A 212 6.884 17.628 -9.442 1.00 11.60 H new ATOM 0 HG22 THR A 212 8.078 16.806 -10.081 1.00 11.60 H new ATOM 0 HG23 THR A 212 7.923 16.883 -8.507 1.00 11.60 H new ATOM 1554 N SER A 213 10.877 18.208 -6.825 1.00 9.12 N ATOM 1555 CA SER A 213 11.187 17.566 -5.547 1.00 8.58 C ATOM 1556 C SER A 213 9.933 17.287 -4.754 1.00 10.33 C ATOM 1557 O SER A 213 9.154 18.193 -4.476 1.00 12.12 O ATOM 1558 CB SER A 213 12.116 18.442 -4.715 1.00 11.21 C ATOM 1559 OG SER A 213 13.371 18.583 -5.348 1.00 13.58 O ATOM 0 H SER A 213 11.005 19.058 -6.840 1.00 9.12 H new ATOM 0 HA SER A 213 11.626 16.725 -5.748 1.00 8.58 H new ATOM 0 HB2 SER A 213 11.714 19.315 -4.585 1.00 11.21 H new ATOM 0 HB3 SER A 213 12.235 18.051 -3.835 1.00 11.21 H new ATOM 0 HG SER A 213 13.567 17.869 -5.745 1.00 13.58 H new ATOM 1560 N ILE A 214 9.747 16.033 -4.364 1.00 7.18 N ATOM 1561 CA ILE A 214 8.603 15.658 -3.545 1.00 10.41 C ATOM 1562 C ILE A 214 9.094 14.960 -2.281 1.00 6.58 C ATOM 1563 O ILE A 214 9.485 13.791 -2.327 1.00 7.63 O ATOM 1564 CB ILE A 214 7.642 14.735 -4.314 1.00 9.23 C ATOM 1565 CG1 ILE A 214 7.196 15.404 -5.613 1.00 10.68 C ATOM 1566 CG2 ILE A 214 6.426 14.393 -3.465 1.00 9.63 C ATOM 1567 CD1 ILE A 214 6.395 14.492 -6.526 1.00 13.99 C ATOM 0 H ILE A 214 10.273 15.382 -4.563 1.00 7.18 H new ATOM 0 HA ILE A 214 8.117 16.464 -3.310 1.00 10.41 H new ATOM 0 HB ILE A 214 8.113 13.913 -4.524 1.00 9.23 H new ATOM 0 HG12 ILE A 214 6.661 16.184 -5.398 1.00 10.68 H new ATOM 0 HG13 ILE A 214 7.979 15.719 -6.090 1.00 10.68 H new ATOM 0 HG21 ILE A 214 5.834 13.811 -3.967 1.00 9.63 H new ATOM 0 HG22 ILE A 214 6.713 13.941 -2.656 1.00 9.63 H new ATOM 0 HG23 ILE A 214 5.955 15.208 -3.230 1.00 9.63 H new ATOM 0 HD11 ILE A 214 6.144 14.976 -7.328 1.00 13.99 H new ATOM 0 HD12 ILE A 214 6.933 13.722 -6.768 1.00 13.99 H new ATOM 0 HD13 ILE A 214 5.595 14.194 -6.065 1.00 13.99 H new ATOM 1568 N ASP A 215 9.092 15.680 -1.164 1.00 8.03 N ATOM 1569 CA ASP A 215 9.507 15.128 0.127 1.00 7.95 C ATOM 1570 C ASP A 215 8.421 14.202 0.638 1.00 8.10 C ATOM 1571 O ASP A 215 7.257 14.573 0.643 1.00 9.15 O ATOM 1572 CB ASP A 215 9.682 16.247 1.170 1.00 9.13 C ATOM 1573 CG ASP A 215 10.835 17.178 0.872 1.00 16.15 C ATOM 1574 OD1 ASP A 215 10.863 18.269 1.486 1.00 23.26 O ATOM 1575 OD2 ASP A 215 11.704 16.834 0.050 1.00 15.90 O ATOM 0 H ASP A 215 8.850 16.505 -1.131 1.00 8.03 H new ATOM 0 HA ASP A 215 10.348 14.660 0.001 1.00 7.95 H new ATOM 0 HB2 ASP A 215 8.863 16.764 1.219 1.00 9.13 H new ATOM 0 HB3 ASP A 215 9.817 15.847 2.043 1.00 9.13 H new ATOM 1576 N GLY A 216 8.778 13.017 1.106 1.00 6.75 N ATOM 1577 CA GLY A 216 7.760 12.147 1.658 1.00 7.52 C ATOM 1578 C GLY A 216 8.360 11.040 2.483 1.00 7.72 C ATOM 1579 O GLY A 216 9.586 10.928 2.591 1.00 9.55 O ATOM 0 H GLY A 216 9.580 12.706 1.114 1.00 6.75 H new ATOM 0 HA2 GLY A 216 7.153 12.667 2.207 1.00 7.52 H new ATOM 0 HA3 GLY A 216 7.235 11.765 0.937 1.00 7.52 H new ATOM 1580 N ILE A 217 7.502 10.205 3.053 1.00 7.19 N ATOM 1581 CA ILE A 217 7.992 9.097 3.857 1.00 6.94 C ATOM 1582 C ILE A 217 7.694 7.756 3.213 1.00 7.59 C ATOM 1583 O ILE A 217 6.653 7.575 2.571 1.00 9.07 O ATOM 1584 CB ILE A 217 7.444 9.128 5.291 1.00 8.55 C ATOM 1585 CG1 ILE A 217 5.923 8.969 5.313 1.00 10.25 C ATOM 1586 CG2 ILE A 217 7.892 10.407 6.007 1.00 10.02 C ATOM 1587 CD1 ILE A 217 5.349 8.740 6.719 1.00 13.61 C ATOM 0 H ILE A 217 6.646 10.260 2.988 1.00 7.19 H new ATOM 0 HA ILE A 217 8.955 9.207 3.904 1.00 6.94 H new ATOM 0 HB ILE A 217 7.812 8.371 5.773 1.00 8.55 H new ATOM 0 HG12 ILE A 217 5.517 9.763 4.931 1.00 10.25 H new ATOM 0 HG13 ILE A 217 5.675 8.223 4.745 1.00 10.25 H new ATOM 0 HG21 ILE A 217 7.539 10.413 6.910 1.00 10.02 H new ATOM 0 HG22 ILE A 217 8.861 10.438 6.039 1.00 10.02 H new ATOM 0 HG23 ILE A 217 7.560 11.181 5.526 1.00 10.02 H new ATOM 0 HD11 ILE A 217 4.385 8.648 6.664 1.00 13.61 H new ATOM 0 HD12 ILE A 217 5.730 7.932 7.097 1.00 13.61 H new ATOM 0 HD13 ILE A 217 5.569 9.496 7.286 1.00 13.61 H new ATOM 1588 N ALA A 218 8.618 6.818 3.374 1.00 6.27 N ATOM 1589 CA ALA A 218 8.388 5.445 2.946 1.00 7.98 C ATOM 1590 C ALA A 218 7.690 4.709 4.082 1.00 7.21 C ATOM 1591 O ALA A 218 8.291 4.467 5.135 1.00 6.99 O ATOM 1592 CB ALA A 218 9.704 4.775 2.581 1.00 8.90 C ATOM 0 H ALA A 218 9.388 6.957 3.730 1.00 6.27 H new ATOM 0 HA ALA A 218 7.829 5.426 2.154 1.00 7.98 H new ATOM 0 HB1 ALA A 218 9.535 3.863 2.298 1.00 8.90 H new ATOM 0 HB2 ALA A 218 10.127 5.264 1.858 1.00 8.90 H new ATOM 0 HB3 ALA A 218 10.290 4.770 3.354 1.00 8.90 H new ATOM 1593 N ASP A 219 6.417 4.375 3.872 1.00 7.04 N ATOM 1594 CA ASP A 219 5.538 3.915 4.947 1.00 6.49 C ATOM 1595 C ASP A 219 4.772 2.643 4.582 1.00 6.07 C ATOM 1596 O ASP A 219 3.711 2.700 3.948 1.00 6.81 O ATOM 1597 CB ASP A 219 4.558 5.036 5.323 1.00 7.50 C ATOM 1598 CG ASP A 219 3.686 4.686 6.511 1.00 10.12 C ATOM 1599 OD1 ASP A 219 2.821 5.515 6.854 1.00 13.33 O ATOM 1600 OD2 ASP A 219 3.850 3.591 7.087 1.00 10.68 O ATOM 0 H ASP A 219 6.038 4.409 3.101 1.00 7.04 H new ATOM 0 HA ASP A 219 6.099 3.693 5.707 1.00 6.49 H new ATOM 0 HB2 ASP A 219 5.058 5.843 5.522 1.00 7.50 H new ATOM 0 HB3 ASP A 219 3.992 5.234 4.560 1.00 7.50 H new ATOM 1601 N THR A 220 5.306 1.493 4.979 1.00 5.86 N ATOM 1602 CA THR A 220 4.650 0.223 4.662 1.00 6.19 C ATOM 1603 C THR A 220 3.314 0.061 5.389 1.00 6.17 C ATOM 1604 O THR A 220 2.509 -0.788 5.008 1.00 7.11 O ATOM 1605 CB THR A 220 5.536 -0.980 5.009 1.00 5.22 C ATOM 1606 OG1 THR A 220 5.886 -0.916 6.397 1.00 5.59 O ATOM 1607 CG2 THR A 220 6.809 -0.987 4.166 1.00 7.41 C ATOM 0 H THR A 220 6.037 1.423 5.427 1.00 5.86 H new ATOM 0 HA THR A 220 4.491 0.247 3.705 1.00 6.19 H new ATOM 0 HB THR A 220 5.042 -1.794 4.821 1.00 5.22 H new ATOM 0 HG1 THR A 220 5.475 -1.516 6.818 1.00 5.59 H new ATOM 0 HG21 THR A 220 7.351 -1.756 4.404 1.00 7.41 H new ATOM 0 HG22 THR A 220 6.575 -1.036 3.226 1.00 7.41 H new ATOM 0 HG23 THR A 220 7.312 -0.174 4.332 1.00 7.41 H new ATOM 1608 N GLY A 221 3.083 0.865 6.423 1.00 6.57 N ATOM 1609 CA GLY A 221 1.850 0.810 7.195 1.00 7.00 C ATOM 1610 C GLY A 221 0.705 1.643 6.653 1.00 7.18 C ATOM 1611 O GLY A 221 -0.366 1.677 7.246 1.00 8.59 O ATOM 0 H GLY A 221 3.641 1.460 6.696 1.00 6.57 H new ATOM 0 HA2 GLY A 221 1.561 -0.114 7.248 1.00 7.00 H new ATOM 0 HA3 GLY A 221 2.040 1.100 8.101 1.00 7.00 H new ATOM 1612 N THR A 222 0.941 2.333 5.545 1.00 6.54 N ATOM 1613 CA THR A 222 -0.102 3.096 4.871 1.00 6.54 C ATOM 1614 C THR A 222 -0.424 2.411 3.547 1.00 5.78 C ATOM 1615 O THR A 222 0.482 2.032 2.805 1.00 6.65 O ATOM 1616 CB THR A 222 0.349 4.552 4.638 1.00 7.30 C ATOM 1617 OG1 THR A 222 0.391 5.230 5.900 1.00 9.68 O ATOM 1618 CG2 THR A 222 -0.629 5.300 3.720 1.00 7.93 C ATOM 0 H THR A 222 1.710 2.373 5.162 1.00 6.54 H new ATOM 0 HA THR A 222 -0.897 3.124 5.426 1.00 6.54 H new ATOM 0 HB THR A 222 1.223 4.537 4.217 1.00 7.30 H new ATOM 0 HG1 THR A 222 1.168 5.185 6.217 1.00 9.68 H new ATOM 0 HG21 THR A 222 -0.321 6.211 3.592 1.00 7.93 H new ATOM 0 HG22 THR A 222 -0.675 4.851 2.862 1.00 7.93 H new ATOM 0 HG23 THR A 222 -1.510 5.312 4.126 1.00 7.93 H new ATOM 1619 N THR A 223 -1.708 2.255 3.247 1.00 6.66 N ATOM 1620 CA THR A 223 -2.125 1.512 2.063 1.00 5.98 C ATOM 1621 C THR A 223 -1.815 2.247 0.755 1.00 5.00 C ATOM 1622 O THR A 223 -1.324 1.647 -0.207 1.00 6.70 O ATOM 1623 CB THR A 223 -3.642 1.239 2.102 1.00 6.76 C ATOM 1624 OG1 THR A 223 -4.006 0.730 3.389 1.00 9.26 O ATOM 1625 CG2 THR A 223 -4.046 0.235 1.029 1.00 8.44 C ATOM 0 H THR A 223 -2.355 2.572 3.717 1.00 6.66 H new ATOM 0 HA THR A 223 -1.620 0.684 2.080 1.00 5.98 H new ATOM 0 HB THR A 223 -4.105 2.074 1.932 1.00 6.76 H new ATOM 0 HG1 THR A 223 -3.734 -0.061 3.465 1.00 9.26 H new ATOM 0 HG21 THR A 223 -5.003 0.080 1.074 1.00 8.44 H new ATOM 0 HG22 THR A 223 -3.816 0.586 0.154 1.00 8.44 H new ATOM 0 HG23 THR A 223 -3.577 -0.601 1.175 1.00 8.44 H new ATOM 1626 N LEU A 224 -2.138 3.538 0.716 1.00 5.29 N ATOM 1627 CA LEU A 224 -2.176 4.292 -0.528 1.00 5.68 C ATOM 1628 C LEU A 224 -0.976 5.226 -0.712 1.00 5.94 C ATOM 1629 O LEU A 224 -0.093 5.344 0.154 1.00 6.08 O ATOM 1630 CB LEU A 224 -3.494 5.074 -0.620 1.00 6.74 C ATOM 1631 CG LEU A 224 -4.777 4.250 -0.437 1.00 6.87 C ATOM 1632 CD1 LEU A 224 -6.009 5.120 -0.679 1.00 8.92 C ATOM 1633 CD2 LEU A 224 -4.786 3.039 -1.360 1.00 9.36 C ATOM 0 H LEU A 224 -2.341 3.999 1.413 1.00 5.29 H new ATOM 0 HA LEU A 224 -2.124 3.648 -1.251 1.00 5.68 H new ATOM 0 HB2 LEU A 224 -3.482 5.775 0.051 1.00 6.74 H new ATOM 0 HB3 LEU A 224 -3.531 5.510 -1.485 1.00 6.74 H new ATOM 0 HG LEU A 224 -4.801 3.928 0.478 1.00 6.87 H new ATOM 0 HD11 LEU A 224 -6.810 4.587 -0.560 1.00 8.92 H new ATOM 0 HD12 LEU A 224 -6.014 5.856 -0.048 1.00 8.92 H new ATOM 0 HD13 LEU A 224 -5.986 5.470 -1.583 1.00 8.92 H new ATOM 0 HD21 LEU A 224 -5.604 2.536 -1.226 1.00 9.36 H new ATOM 0 HD22 LEU A 224 -4.736 3.335 -2.283 1.00 9.36 H new ATOM 0 HD23 LEU A 224 -4.023 2.474 -1.160 1.00 9.36 H new ATOM 1634 N LEU A 225 -0.951 5.869 -1.873 1.00 4.95 N ATOM 1635 CA LEU A 225 0.082 6.832 -2.231 1.00 4.99 C ATOM 1636 C LEU A 225 -0.529 8.223 -2.114 1.00 4.99 C ATOM 1637 O LEU A 225 -1.472 8.551 -2.849 1.00 5.78 O ATOM 1638 CB LEU A 225 0.564 6.553 -3.660 1.00 5.18 C ATOM 1639 CG LEU A 225 1.535 7.539 -4.316 1.00 5.27 C ATOM 1640 CD1 LEU A 225 2.755 7.822 -3.444 1.00 6.48 C ATOM 1641 CD2 LEU A 225 1.957 6.984 -5.668 1.00 6.37 C ATOM 0 H LEU A 225 -1.544 5.756 -2.485 1.00 4.95 H new ATOM 0 HA LEU A 225 0.850 6.764 -1.643 1.00 4.99 H new ATOM 0 HB2 LEU A 225 0.986 5.680 -3.663 1.00 5.18 H new ATOM 0 HB3 LEU A 225 -0.220 6.491 -4.228 1.00 5.18 H new ATOM 0 HG LEU A 225 1.079 8.387 -4.430 1.00 5.27 H new ATOM 0 HD11 LEU A 225 3.339 8.449 -3.898 1.00 6.48 H new ATOM 0 HD12 LEU A 225 2.468 8.202 -2.599 1.00 6.48 H new ATOM 0 HD13 LEU A 225 3.234 6.995 -3.280 1.00 6.48 H new ATOM 0 HD21 LEU A 225 2.573 7.601 -6.093 1.00 6.37 H new ATOM 0 HD22 LEU A 225 2.393 6.126 -5.544 1.00 6.37 H new ATOM 0 HD23 LEU A 225 1.175 6.870 -6.230 1.00 6.37 H new ATOM 1642 N TYR A 226 -0.025 9.023 -1.170 1.00 4.75 N ATOM 1643 CA TYR A 226 -0.524 10.377 -0.914 1.00 5.41 C ATOM 1644 C TYR A 226 0.496 11.402 -1.374 1.00 6.29 C ATOM 1645 O TYR A 226 1.628 11.443 -0.871 1.00 6.54 O ATOM 1646 CB TYR A 226 -0.837 10.584 0.567 1.00 5.83 C ATOM 1647 CG TYR A 226 -1.959 9.710 1.059 1.00 5.64 C ATOM 1648 CD1 TYR A 226 -3.275 10.154 1.033 1.00 6.83 C ATOM 1649 CD2 TYR A 226 -1.705 8.426 1.533 1.00 6.90 C ATOM 1650 CE1 TYR A 226 -4.315 9.346 1.473 1.00 6.66 C ATOM 1651 CE2 TYR A 226 -2.730 7.609 1.972 1.00 7.29 C ATOM 1652 CZ TYR A 226 -4.030 8.069 1.943 1.00 6.80 C ATOM 1653 OH TYR A 226 -5.039 7.237 2.376 1.00 9.53 O ATOM 0 H TYR A 226 0.624 8.791 -0.655 1.00 4.75 H new ATOM 0 HA TYR A 226 -1.347 10.492 -1.415 1.00 5.41 H new ATOM 0 HB2 TYR A 226 -0.040 10.403 1.089 1.00 5.83 H new ATOM 0 HB3 TYR A 226 -1.069 11.514 0.716 1.00 5.83 H new ATOM 0 HD1 TYR A 226 -3.463 11.008 0.715 1.00 6.83 H new ATOM 0 HD2 TYR A 226 -0.830 8.112 1.555 1.00 6.90 H new ATOM 0 HE1 TYR A 226 -5.192 9.655 1.454 1.00 6.66 H new ATOM 0 HE2 TYR A 226 -2.544 6.753 2.285 1.00 7.29 H new ATOM 0 HH TYR A 226 -5.783 7.575 2.183 1.00 9.53 H new ATOM 1654 N LEU A 227 0.092 12.224 -2.335 1.00 5.83 N ATOM 1655 CA LEU A 227 0.997 13.154 -3.004 1.00 5.92 C ATOM 1656 C LEU A 227 0.357 14.536 -3.116 1.00 5.73 C ATOM 1657 O LEU A 227 -0.841 14.694 -2.882 1.00 6.01 O ATOM 1658 CB LEU A 227 1.340 12.621 -4.396 1.00 5.49 C ATOM 1659 CG LEU A 227 2.210 11.365 -4.441 1.00 5.97 C ATOM 1660 CD1 LEU A 227 2.317 10.857 -5.870 1.00 9.52 C ATOM 1661 CD2 LEU A 227 3.595 11.643 -3.852 1.00 9.20 C ATOM 0 H LEU A 227 -0.719 12.259 -2.620 1.00 5.83 H new ATOM 0 HA LEU A 227 1.809 13.234 -2.480 1.00 5.92 H new ATOM 0 HB2 LEU A 227 0.511 12.435 -4.864 1.00 5.49 H new ATOM 0 HB3 LEU A 227 1.793 13.323 -4.889 1.00 5.49 H new ATOM 0 HG LEU A 227 1.792 10.677 -3.900 1.00 5.97 H new ATOM 0 HD11 LEU A 227 2.870 10.060 -5.890 1.00 9.52 H new ATOM 0 HD12 LEU A 227 1.432 10.644 -6.205 1.00 9.52 H new ATOM 0 HD13 LEU A 227 2.717 11.542 -6.428 1.00 9.52 H new ATOM 0 HD21 LEU A 227 4.131 10.835 -3.890 1.00 9.20 H new ATOM 0 HD22 LEU A 227 4.030 12.343 -4.364 1.00 9.20 H new ATOM 0 HD23 LEU A 227 3.503 11.927 -2.929 1.00 9.20 H new ATOM 1662 N PRO A 228 1.146 15.553 -3.496 1.00 5.57 N ATOM 1663 CA PRO A 228 0.565 16.901 -3.548 1.00 6.55 C ATOM 1664 C PRO A 228 -0.624 16.981 -4.504 1.00 5.01 C ATOM 1665 O PRO A 228 -0.699 16.256 -5.499 1.00 5.57 O ATOM 1666 CB PRO A 228 1.731 17.772 -4.030 1.00 6.38 C ATOM 1667 CG PRO A 228 2.968 17.009 -3.593 1.00 7.40 C ATOM 1668 CD PRO A 228 2.595 15.557 -3.779 1.00 7.92 C ATOM 0 HA PRO A 228 0.207 17.182 -2.691 1.00 6.55 H new ATOM 0 HB2 PRO A 228 1.710 17.892 -4.992 1.00 6.38 H new ATOM 0 HB3 PRO A 228 1.701 18.656 -3.633 1.00 6.38 H new ATOM 0 HG2 PRO A 228 3.740 17.248 -4.130 1.00 7.40 H new ATOM 0 HG3 PRO A 228 3.195 17.201 -2.670 1.00 7.40 H new ATOM 0 HD2 PRO A 228 2.787 15.248 -4.678 1.00 7.92 H new ATOM 0 HD3 PRO A 228 3.082 14.979 -3.171 1.00 7.92 H new ATOM 1669 N ALA A 229 -1.554 17.877 -4.187 1.00 5.26 N ATOM 1670 CA ALA A 229 -2.784 18.016 -4.958 1.00 4.84 C ATOM 1671 C ALA A 229 -2.558 18.246 -6.442 1.00 5.39 C ATOM 1672 O ALA A 229 -3.331 17.757 -7.265 1.00 6.23 O ATOM 1673 CB ALA A 229 -3.647 19.123 -4.387 1.00 7.42 C ATOM 0 H ALA A 229 -1.490 18.419 -3.522 1.00 5.26 H new ATOM 0 HA ALA A 229 -3.242 17.164 -4.880 1.00 4.84 H new ATOM 0 HB1 ALA A 229 -4.460 19.202 -4.910 1.00 7.42 H new ATOM 0 HB2 ALA A 229 -3.874 18.915 -3.467 1.00 7.42 H new ATOM 0 HB3 ALA A 229 -3.160 19.961 -4.417 1.00 7.42 H new ATOM 1674 N THR A 230 -1.510 18.984 -6.791 1.00 5.33 N ATOM 1675 CA THR A 230 -1.208 19.245 -8.192 1.00 6.56 C ATOM 1676 C THR A 230 -0.907 17.940 -8.927 1.00 5.19 C ATOM 1677 O THR A 230 -1.375 17.710 -10.045 1.00 6.03 O ATOM 1678 CB THR A 230 -0.006 20.194 -8.335 1.00 6.00 C ATOM 1679 OG1 THR A 230 1.056 19.720 -7.505 1.00 9.47 O ATOM 1680 CG2 THR A 230 -0.378 21.620 -7.916 1.00 9.35 C ATOM 0 H THR A 230 -0.963 19.342 -6.233 1.00 5.33 H new ATOM 0 HA THR A 230 -1.989 19.666 -8.584 1.00 6.56 H new ATOM 0 HB THR A 230 0.270 20.212 -9.265 1.00 6.00 H new ATOM 0 HG1 THR A 230 1.794 19.903 -7.862 1.00 9.47 H new ATOM 0 HG21 THR A 230 0.394 22.198 -8.015 1.00 9.35 H new ATOM 0 HG22 THR A 230 -1.099 21.945 -8.478 1.00 9.35 H new ATOM 0 HG23 THR A 230 -0.666 21.621 -6.990 1.00 9.35 H new ATOM 1681 N VAL A 231 -0.094 17.099 -8.296 1.00 5.50 N ATOM 1682 CA VAL A 231 0.340 15.843 -8.894 1.00 6.47 C ATOM 1683 C VAL A 231 -0.858 14.906 -9.043 1.00 5.41 C ATOM 1684 O VAL A 231 -1.056 14.280 -10.089 1.00 5.99 O ATOM 1685 CB VAL A 231 1.421 15.186 -8.011 1.00 5.00 C ATOM 1686 CG1 VAL A 231 1.845 13.841 -8.587 1.00 7.40 C ATOM 1687 CG2 VAL A 231 2.621 16.129 -7.856 1.00 7.10 C ATOM 0 H VAL A 231 0.221 17.241 -7.509 1.00 5.50 H new ATOM 0 HA VAL A 231 0.717 16.018 -9.770 1.00 6.47 H new ATOM 0 HB VAL A 231 1.048 15.023 -7.131 1.00 5.00 H new ATOM 0 HG11 VAL A 231 2.524 13.445 -8.019 1.00 7.40 H new ATOM 0 HG12 VAL A 231 1.076 13.251 -8.631 1.00 7.40 H new ATOM 0 HG13 VAL A 231 2.205 13.970 -9.478 1.00 7.40 H new ATOM 0 HG21 VAL A 231 3.294 15.707 -7.300 1.00 7.10 H new ATOM 0 HG22 VAL A 231 2.997 16.321 -8.729 1.00 7.10 H new ATOM 0 HG23 VAL A 231 2.331 16.956 -7.441 1.00 7.10 H new ATOM 1688 N VAL A 232 -1.668 14.821 -7.997 1.00 5.26 N ATOM 1689 CA VAL A 232 -2.824 13.930 -7.985 1.00 5.55 C ATOM 1690 C VAL A 232 -3.873 14.351 -9.022 1.00 5.85 C ATOM 1691 O VAL A 232 -4.476 13.511 -9.691 1.00 5.36 O ATOM 1692 CB VAL A 232 -3.396 13.856 -6.562 1.00 5.39 C ATOM 1693 CG1 VAL A 232 -4.653 13.014 -6.512 1.00 8.79 C ATOM 1694 CG2 VAL A 232 -2.326 13.294 -5.616 1.00 7.71 C ATOM 0 H VAL A 232 -1.565 15.276 -7.275 1.00 5.26 H new ATOM 0 HA VAL A 232 -2.542 13.038 -8.243 1.00 5.55 H new ATOM 0 HB VAL A 232 -3.641 14.751 -6.278 1.00 5.39 H new ATOM 0 HG11 VAL A 232 -4.989 12.987 -5.602 1.00 8.79 H new ATOM 0 HG12 VAL A 232 -5.326 13.402 -7.093 1.00 8.79 H new ATOM 0 HG13 VAL A 232 -4.451 12.113 -6.808 1.00 8.79 H new ATOM 0 HG21 VAL A 232 -2.683 13.246 -4.715 1.00 7.71 H new ATOM 0 HG22 VAL A 232 -2.068 12.406 -5.909 1.00 7.71 H new ATOM 0 HG23 VAL A 232 -1.549 13.875 -5.624 1.00 7.71 H new ATOM 1695 N SER A 233 -4.079 15.656 -9.172 1.00 5.09 N ATOM 1696 CA SER A 233 -5.011 16.170 -10.170 1.00 5.50 C ATOM 1697 C SER A 233 -4.528 15.816 -11.570 1.00 5.27 C ATOM 1698 O SER A 233 -5.324 15.412 -12.425 1.00 5.86 O ATOM 1699 CB SER A 233 -5.145 17.684 -10.016 1.00 5.59 C ATOM 1700 OG SER A 233 -6.077 18.203 -10.947 1.00 6.81 O ATOM 0 H SER A 233 -3.688 16.262 -8.704 1.00 5.09 H new ATOM 0 HA SER A 233 -5.881 15.763 -10.035 1.00 5.50 H new ATOM 0 HB2 SER A 233 -5.430 17.898 -9.114 1.00 5.59 H new ATOM 0 HB3 SER A 233 -4.281 18.105 -10.148 1.00 5.59 H new ATOM 0 HG SER A 233 -6.267 17.612 -11.513 1.00 6.81 H new ATOM 1701 N ALA A 234 -3.225 15.957 -11.809 1.00 5.11 N ATOM 1702 CA ALA A 234 -2.663 15.595 -13.108 1.00 4.87 C ATOM 1703 C ALA A 234 -2.870 14.116 -13.433 1.00 6.08 C ATOM 1704 O ALA A 234 -3.106 13.756 -14.585 1.00 7.33 O ATOM 1705 CB ALA A 234 -1.195 15.957 -13.172 1.00 7.04 C ATOM 0 H ALA A 234 -2.655 16.257 -11.239 1.00 5.11 H new ATOM 0 HA ALA A 234 -3.140 16.105 -13.781 1.00 4.87 H new ATOM 0 HB1 ALA A 234 -0.838 15.710 -14.040 1.00 7.04 H new ATOM 0 HB2 ALA A 234 -1.091 16.912 -13.040 1.00 7.04 H new ATOM 0 HB3 ALA A 234 -0.713 15.481 -12.478 1.00 7.04 H new ATOM 1706 N TYR A 235 -2.770 13.261 -12.421 1.00 5.31 N ATOM 1707 CA TYR A 235 -3.016 11.840 -12.632 1.00 5.45 C ATOM 1708 C TYR A 235 -4.485 11.580 -13.000 1.00 4.68 C ATOM 1709 O TYR A 235 -4.789 10.986 -14.049 1.00 5.27 O ATOM 1710 CB TYR A 235 -2.587 11.009 -11.407 1.00 4.68 C ATOM 1711 CG TYR A 235 -2.897 9.549 -11.628 1.00 4.77 C ATOM 1712 CD1 TYR A 235 -4.083 8.990 -11.174 1.00 4.94 C ATOM 1713 CD2 TYR A 235 -2.039 8.742 -12.373 1.00 6.03 C ATOM 1714 CE1 TYR A 235 -4.395 7.660 -11.434 1.00 4.27 C ATOM 1715 CE2 TYR A 235 -2.344 7.414 -12.635 1.00 4.89 C ATOM 1716 CZ TYR A 235 -3.522 6.885 -12.161 1.00 4.66 C ATOM 1717 OH TYR A 235 -3.858 5.574 -12.426 1.00 5.94 O ATOM 0 H TYR A 235 -2.564 13.479 -11.615 1.00 5.31 H new ATOM 0 HA TYR A 235 -2.471 11.555 -13.382 1.00 5.45 H new ATOM 0 HB2 TYR A 235 -1.637 11.124 -11.248 1.00 4.68 H new ATOM 0 HB3 TYR A 235 -3.048 11.327 -10.615 1.00 4.68 H new ATOM 0 HD1 TYR A 235 -4.679 9.513 -10.688 1.00 4.94 H new ATOM 0 HD2 TYR A 235 -1.246 9.101 -12.701 1.00 6.03 H new ATOM 0 HE1 TYR A 235 -5.190 7.296 -11.118 1.00 4.27 H new ATOM 0 HE2 TYR A 235 -1.757 6.886 -13.127 1.00 4.89 H new ATOM 0 HH TYR A 235 -3.306 5.247 -12.968 1.00 5.94 H new ATOM 1718 N TRP A 236 -5.406 12.028 -12.152 1.00 4.78 N ATOM 1719 CA TRP A 236 -6.814 11.678 -12.342 1.00 4.95 C ATOM 1720 C TRP A 236 -7.453 12.349 -13.556 1.00 5.43 C ATOM 1721 O TRP A 236 -8.440 11.846 -14.088 1.00 5.77 O ATOM 1722 CB TRP A 236 -7.625 11.878 -11.051 1.00 5.05 C ATOM 1723 CG TRP A 236 -7.232 10.852 -10.029 1.00 5.01 C ATOM 1724 CD1 TRP A 236 -6.515 11.062 -8.889 1.00 4.75 C ATOM 1725 CD2 TRP A 236 -7.485 9.438 -10.092 1.00 4.91 C ATOM 1726 NE1 TRP A 236 -6.308 9.869 -8.229 1.00 5.34 N ATOM 1727 CE2 TRP A 236 -6.901 8.859 -8.944 1.00 4.10 C ATOM 1728 CE3 TRP A 236 -8.158 8.609 -11.002 1.00 4.83 C ATOM 1729 CZ2 TRP A 236 -6.948 7.482 -8.694 1.00 4.97 C ATOM 1730 CZ3 TRP A 236 -8.219 7.242 -10.744 1.00 4.20 C ATOM 1731 CH2 TRP A 236 -7.620 6.697 -9.602 1.00 5.40 C ATOM 0 H TRP A 236 -5.243 12.527 -11.471 1.00 4.78 H new ATOM 0 HA TRP A 236 -6.833 10.730 -12.547 1.00 4.95 H new ATOM 0 HB2 TRP A 236 -7.472 12.769 -10.700 1.00 5.05 H new ATOM 0 HB3 TRP A 236 -8.573 11.807 -11.242 1.00 5.05 H new ATOM 0 HD1 TRP A 236 -6.209 11.891 -8.598 1.00 4.75 H new ATOM 0 HE1 TRP A 236 -5.878 9.774 -7.490 1.00 5.34 H new ATOM 0 HE3 TRP A 236 -8.556 8.966 -11.763 1.00 4.83 H new ATOM 0 HZ2 TRP A 236 -6.541 7.113 -7.944 1.00 4.97 H new ATOM 0 HZ3 TRP A 236 -8.664 6.683 -11.339 1.00 4.20 H new ATOM 0 HH2 TRP A 236 -7.678 5.781 -9.453 1.00 5.40 H new ATOM 1732 N ALA A 237 -6.863 13.457 -14.007 1.00 5.76 N ATOM 1733 CA ALA A 237 -7.321 14.116 -15.229 1.00 4.97 C ATOM 1734 C ALA A 237 -7.177 13.200 -16.432 1.00 6.33 C ATOM 1735 O ALA A 237 -7.810 13.436 -17.462 1.00 7.33 O ATOM 1736 CB ALA A 237 -6.547 15.398 -15.454 1.00 7.57 C ATOM 0 H ALA A 237 -6.198 13.841 -13.621 1.00 5.76 H new ATOM 0 HA ALA A 237 -8.261 14.328 -15.122 1.00 4.97 H new ATOM 0 HB1 ALA A 237 -6.859 15.826 -16.267 1.00 7.57 H new ATOM 0 HB2 ALA A 237 -6.683 15.995 -14.702 1.00 7.57 H new ATOM 0 HB3 ALA A 237 -5.602 15.195 -15.538 1.00 7.57 H new ATOM 1737 N GLN A 238 -6.360 12.155 -16.315 1.00 6.33 N ATOM 1738 CA GLN A 238 -6.186 11.228 -17.433 1.00 6.61 C ATOM 1739 C GLN A 238 -7.195 10.082 -17.419 1.00 9.07 C ATOM 1740 O GLN A 238 -7.167 9.221 -18.306 1.00 12.63 O ATOM 1741 CB GLN A 238 -4.750 10.700 -17.472 1.00 7.88 C ATOM 1742 CG GLN A 238 -3.728 11.792 -17.740 1.00 7.09 C ATOM 1743 CD GLN A 238 -4.015 12.537 -19.028 1.00 8.26 C ATOM 1744 OE1 GLN A 238 -4.194 11.926 -20.081 1.00 9.55 O ATOM 1745 NE2 GLN A 238 -4.095 13.860 -18.945 1.00 8.16 N ATOM 0 H GLN A 238 -5.904 11.966 -15.610 1.00 6.33 H new ATOM 0 HA GLN A 238 -6.358 11.729 -18.245 1.00 6.61 H new ATOM 0 HB2 GLN A 238 -4.545 10.271 -16.627 1.00 7.88 H new ATOM 0 HB3 GLN A 238 -4.678 10.020 -18.160 1.00 7.88 H new ATOM 0 HG2 GLN A 238 -3.724 12.418 -16.999 1.00 7.09 H new ATOM 0 HG3 GLN A 238 -2.842 11.400 -17.785 1.00 7.09 H new ATOM 0 HE21 GLN A 238 -3.964 14.252 -18.191 1.00 8.16 H new ATOM 0 HE22 GLN A 238 -4.278 14.324 -19.645 1.00 8.16 H new ATOM 1746 N VAL A 239 -8.098 10.077 -16.439 1.00 6.45 N ATOM 1747 CA VAL A 239 -9.070 8.997 -16.285 1.00 6.98 C ATOM 1748 C VAL A 239 -10.465 9.567 -16.497 1.00 6.88 C ATOM 1749 O VAL A 239 -10.956 10.358 -15.698 1.00 7.46 O ATOM 1750 CB VAL A 239 -8.960 8.339 -14.892 1.00 6.89 C ATOM 1751 CG1 VAL A 239 -9.988 7.221 -14.748 1.00 8.57 C ATOM 1752 CG2 VAL A 239 -7.548 7.813 -14.648 1.00 8.31 C ATOM 0 H VAL A 239 -8.164 10.698 -15.847 1.00 6.45 H new ATOM 0 HA VAL A 239 -8.889 8.308 -16.943 1.00 6.98 H new ATOM 0 HB VAL A 239 -9.147 9.014 -14.221 1.00 6.89 H new ATOM 0 HG11 VAL A 239 -9.907 6.818 -13.870 1.00 8.57 H new ATOM 0 HG12 VAL A 239 -10.880 7.586 -14.855 1.00 8.57 H new ATOM 0 HG13 VAL A 239 -9.831 6.547 -15.428 1.00 8.57 H new ATOM 0 HG21 VAL A 239 -7.502 7.405 -13.769 1.00 8.31 H new ATOM 0 HG22 VAL A 239 -7.327 7.152 -15.323 1.00 8.31 H new ATOM 0 HG23 VAL A 239 -6.916 8.547 -14.696 1.00 8.31 H new ATOM 1753 N SER A 240 -11.102 9.172 -17.596 1.00 7.72 N ATOM 1754 CA ASER A 240 -12.448 9.646 -17.916 0.60 10.31 C ATOM 1755 CA BSER A 240 -12.436 9.664 -17.911 0.40 10.31 C ATOM 1756 C SER A 240 -13.419 9.391 -16.772 1.00 8.38 C ATOM 1757 O SER A 240 -13.576 8.261 -16.324 1.00 8.26 O ATOM 1758 CB ASER A 240 -12.975 8.966 -19.184 0.60 12.11 C ATOM 1759 CB BSER A 240 -12.946 9.046 -19.215 0.40 12.13 C ATOM 1760 OG ASER A 240 -12.195 9.309 -20.311 0.60 13.96 O ATOM 1761 OG BSER A 240 -14.134 9.686 -19.642 0.40 15.78 O ATOM 0 H ASER A 240 -10.771 8.627 -18.173 0.60 7.72 H new ATOM 0 H BSER A 240 -10.778 8.620 -18.171 0.40 7.72 H new ATOM 0 HA ASER A 240 -12.385 10.603 -18.062 0.60 10.31 H new ATOM 0 HA BSER A 240 -12.373 10.625 -18.025 0.40 10.31 H new ATOM 0 HB2ASER A 240 -12.969 8.003 -19.064 0.60 12.13 H new ATOM 0 HB2BSER A 240 -12.266 9.124 -19.903 0.40 12.13 H new ATOM 0 HB3ASER A 240 -13.897 9.227 -19.334 0.60 12.13 H new ATOM 0 HB3BSER A 240 -13.112 8.099 -19.086 0.40 12.13 H new ATOM 0 HG ASER A 240 -11.462 8.900 -20.279 0.60 15.78 H new ATOM 0 HG BSER A 240 -13.939 10.365 -20.096 0.40 15.78 H new ATOM 1762 N GLY A 241 -14.075 10.444 -16.310 1.00 8.41 N ATOM 1763 CA GLY A 241 -15.085 10.321 -15.280 1.00 9.51 C ATOM 1764 C GLY A 241 -14.562 10.360 -13.856 1.00 8.48 C ATOM 1765 O GLY A 241 -15.352 10.335 -12.916 1.00 10.20 O ATOM 0 H GLY A 241 -13.946 11.248 -16.586 1.00 8.41 H new ATOM 0 HA2 GLY A 241 -15.730 11.037 -15.392 1.00 9.51 H new ATOM 0 HA3 GLY A 241 -15.561 9.486 -15.412 1.00 9.51 H new ATOM 1766 N ALA A 242 -13.244 10.440 -13.681 1.00 7.49 N ATOM 1767 CA ALA A 242 -12.674 10.536 -12.339 1.00 8.01 C ATOM 1768 C ALA A 242 -12.987 11.889 -11.714 1.00 9.96 C ATOM 1769 O ALA A 242 -13.037 12.906 -12.407 1.00 12.69 O ATOM 1770 CB ALA A 242 -11.172 10.300 -12.377 1.00 7.92 C ATOM 0 H ALA A 242 -12.668 10.440 -14.319 1.00 7.49 H new ATOM 0 HA ALA A 242 -13.079 9.847 -11.789 1.00 8.01 H new ATOM 0 HB1 ALA A 242 -10.811 10.367 -11.479 1.00 7.92 H new ATOM 0 HB2 ALA A 242 -10.992 9.415 -12.732 1.00 7.92 H new ATOM 0 HB3 ALA A 242 -10.754 10.967 -12.944 1.00 7.92 H new ATOM 1771 N LYS A 243 -13.182 11.905 -10.400 1.00 8.51 N ATOM 1772 CA LYS A 243 -13.506 13.141 -9.696 1.00 9.29 C ATOM 1773 C LYS A 243 -13.138 13.020 -8.231 1.00 8.91 C ATOM 1774 O LYS A 243 -13.098 11.923 -7.674 1.00 8.36 O ATOM 1775 CB LYS A 243 -14.987 13.468 -9.833 1.00 16.17 C ATOM 0 H LYS A 243 -13.131 11.210 -9.896 1.00 8.51 H new ATOM 0 HA LYS A 243 -12.993 13.861 -10.095 1.00 9.29 H new ATOM 1776 N SER A 244 -12.880 14.155 -7.595 1.00 8.30 N ATOM 1777 CA SER A 244 -12.677 14.165 -6.160 1.00 8.61 C ATOM 1778 C SER A 244 -14.027 14.290 -5.469 1.00 8.62 C ATOM 1779 O SER A 244 -14.770 15.244 -5.714 1.00 13.78 O ATOM 1780 CB SER A 244 -11.779 15.329 -5.763 1.00 10.44 C ATOM 1781 OG SER A 244 -11.555 15.305 -4.366 1.00 13.44 O ATOM 0 H SER A 244 -12.819 14.924 -7.975 1.00 8.30 H new ATOM 0 HA SER A 244 -12.247 13.339 -5.889 1.00 8.61 H new ATOM 0 HB2 SER A 244 -10.934 15.273 -6.236 1.00 10.44 H new ATOM 0 HB3 SER A 244 -12.192 16.169 -6.019 1.00 10.44 H new ATOM 0 HG SER A 244 -10.734 15.211 -4.215 1.00 13.44 H new ATOM 1782 N SER A 245 -14.352 13.319 -4.630 1.00 9.95 N ATOM 1783 CA SER A 245 -15.620 13.307 -3.915 1.00 11.03 C ATOM 1784 C SER A 245 -15.416 13.640 -2.443 1.00 12.56 C ATOM 1785 O SER A 245 -14.755 12.910 -1.720 1.00 12.58 O ATOM 1786 CB SER A 245 -16.279 11.941 -4.048 1.00 13.05 C ATOM 1787 OG SER A 245 -17.333 11.810 -3.110 1.00 13.41 O ATOM 0 H SER A 245 -13.844 12.647 -4.458 1.00 9.95 H new ATOM 0 HA SER A 245 -16.196 13.982 -4.306 1.00 11.03 H new ATOM 0 HB2 SER A 245 -16.623 11.827 -4.948 1.00 13.05 H new ATOM 0 HB3 SER A 245 -15.621 11.242 -3.905 1.00 13.05 H new ATOM 0 HG SER A 245 -17.982 11.416 -3.470 1.00 13.41 H new ATOM 1788 N SER A 246 -15.991 14.750 -1.998 1.00 16.85 N ATOM 1789 CA SER A 246 -15.910 15.115 -0.591 1.00 17.73 C ATOM 1790 C SER A 246 -16.668 14.117 0.292 1.00 16.40 C ATOM 1791 O SER A 246 -16.245 13.819 1.408 1.00 19.94 O ATOM 1792 CB SER A 246 -16.434 16.538 -0.376 1.00 20.09 C ATOM 1793 OG SER A 246 -17.751 16.683 -0.878 1.00 29.11 O ATOM 0 H SER A 246 -16.430 15.302 -2.490 1.00 16.85 H new ATOM 0 HA SER A 246 -14.976 15.086 -0.329 1.00 17.73 H new ATOM 0 HB2 SER A 246 -16.421 16.750 0.570 1.00 20.09 H new ATOM 0 HB3 SER A 246 -15.846 17.171 -0.817 1.00 20.09 H new ATOM 0 HG SER A 246 -17.729 16.721 -1.717 1.00 29.11 H new ATOM 1794 N SER A 247 -17.780 13.595 -0.214 1.00 15.29 N ATOM 1795 CA SER A 247 -18.584 12.653 0.560 1.00 17.49 C ATOM 1796 C SER A 247 -17.877 11.317 0.756 1.00 14.68 C ATOM 1797 O SER A 247 -17.972 10.711 1.817 1.00 18.16 O ATOM 1798 CB SER A 247 -19.964 12.445 -0.075 1.00 19.48 C ATOM 1799 OG SER A 247 -19.865 11.873 -1.367 1.00 20.80 O ATOM 0 H SER A 247 -18.086 13.771 -0.998 1.00 15.29 H new ATOM 0 HA SER A 247 -18.707 13.048 1.437 1.00 17.49 H new ATOM 0 HB2 SER A 247 -20.499 11.870 0.494 1.00 19.48 H new ATOM 0 HB3 SER A 247 -20.426 13.296 -0.132 1.00 19.48 H new ATOM 0 HG SER A 247 -19.073 11.934 -1.641 1.00 20.80 H new ATOM 1800 N VAL A 248 -17.166 10.858 -0.269 1.00 12.51 N ATOM 1801 CA VAL A 248 -16.452 9.589 -0.173 1.00 13.45 C ATOM 1802 C VAL A 248 -15.117 9.761 0.548 1.00 13.17 C ATOM 1803 O VAL A 248 -14.683 8.876 1.289 1.00 18.03 O ATOM 1804 CB VAL A 248 -16.242 8.960 -1.563 1.00 11.65 C ATOM 1805 CG1 VAL A 248 -15.398 7.702 -1.460 1.00 17.86 C ATOM 1806 CG2 VAL A 248 -17.590 8.650 -2.206 1.00 15.23 C ATOM 0 H VAL A 248 -17.084 11.262 -1.024 1.00 12.51 H new ATOM 0 HA VAL A 248 -17.001 8.984 0.350 1.00 13.45 H new ATOM 0 HB VAL A 248 -15.769 9.595 -2.123 1.00 11.65 H new ATOM 0 HG11 VAL A 248 -15.277 7.320 -2.343 1.00 17.86 H new ATOM 0 HG12 VAL A 248 -14.532 7.923 -1.082 1.00 17.86 H new ATOM 0 HG13 VAL A 248 -15.845 7.058 -0.889 1.00 17.86 H new ATOM 0 HG21 VAL A 248 -17.448 8.255 -3.080 1.00 15.23 H new ATOM 0 HG22 VAL A 248 -18.081 8.028 -1.646 1.00 15.23 H new ATOM 0 HG23 VAL A 248 -18.100 9.470 -2.301 1.00 15.23 H new ATOM 1807 N GLY A 249 -14.483 10.910 0.343 1.00 10.40 N ATOM 1808 CA GLY A 249 -13.216 11.209 0.990 1.00 14.43 C ATOM 1809 C GLY A 249 -11.987 11.103 0.105 1.00 10.76 C ATOM 1810 O GLY A 249 -10.887 10.847 0.600 1.00 14.31 O ATOM 0 H GLY A 249 -14.775 11.534 -0.172 1.00 10.40 H new ATOM 0 HA2 GLY A 249 -13.259 12.109 1.350 1.00 14.43 H new ATOM 0 HA3 GLY A 249 -13.106 10.607 1.743 1.00 14.43 H new ATOM 1811 N GLY A 250 -12.158 11.304 -1.197 1.00 8.80 N ATOM 1812 CA GLY A 250 -11.030 11.276 -2.105 1.00 9.73 C ATOM 1813 C GLY A 250 -11.468 11.100 -3.539 1.00 6.15 C ATOM 1814 O GLY A 250 -12.657 11.173 -3.866 1.00 6.87 O ATOM 0 H GLY A 250 -12.918 11.457 -1.569 1.00 8.80 H new ATOM 0 HA2 GLY A 250 -10.526 12.100 -2.020 1.00 9.73 H new ATOM 0 HA3 GLY A 250 -10.434 10.552 -1.858 1.00 9.73 H new ATOM 1815 N TYR A 251 -10.489 10.893 -4.403 1.00 5.73 N ATOM 1816 CA TYR A 251 -10.746 10.627 -5.807 1.00 5.26 C ATOM 1817 C TYR A 251 -11.371 9.270 -6.010 1.00 4.96 C ATOM 1818 O TYR A 251 -10.903 8.264 -5.452 1.00 5.63 O ATOM 1819 CB TYR A 251 -9.452 10.715 -6.617 1.00 5.68 C ATOM 1820 CG TYR A 251 -9.053 12.137 -6.922 1.00 5.49 C ATOM 1821 CD1 TYR A 251 -8.261 12.861 -6.041 1.00 6.74 C ATOM 1822 CD2 TYR A 251 -9.467 12.753 -8.090 1.00 7.08 C ATOM 1823 CE1 TYR A 251 -7.885 14.173 -6.326 1.00 7.41 C ATOM 1824 CE2 TYR A 251 -9.105 14.063 -8.382 1.00 7.40 C ATOM 1825 CZ TYR A 251 -8.312 14.760 -7.498 1.00 8.06 C ATOM 1826 OH TYR A 251 -7.949 16.061 -7.790 1.00 10.61 O ATOM 0 H TYR A 251 -9.655 10.903 -4.192 1.00 5.73 H new ATOM 0 HA TYR A 251 -11.370 11.302 -6.117 1.00 5.26 H new ATOM 0 HB2 TYR A 251 -8.737 10.281 -6.126 1.00 5.68 H new ATOM 0 HB3 TYR A 251 -9.562 10.228 -7.449 1.00 5.68 H new ATOM 0 HD1 TYR A 251 -7.977 12.465 -5.249 1.00 6.74 H new ATOM 0 HD2 TYR A 251 -9.998 12.282 -8.691 1.00 7.08 H new ATOM 0 HE1 TYR A 251 -7.351 14.648 -5.731 1.00 7.41 H new ATOM 0 HE2 TYR A 251 -9.396 14.466 -9.168 1.00 7.40 H new ATOM 0 HH TYR A 251 -7.810 16.135 -8.615 1.00 10.61 H new ATOM 1827 N VAL A 252 -12.427 9.270 -6.814 1.00 6.61 N ATOM 1828 CA VAL A 252 -13.117 8.057 -7.241 1.00 5.54 C ATOM 1829 C VAL A 252 -13.160 8.047 -8.759 1.00 6.90 C ATOM 1830 O VAL A 252 -12.973 9.081 -9.396 1.00 7.26 O ATOM 1831 CB VAL A 252 -14.543 7.987 -6.674 1.00 7.14 C ATOM 1832 CG1 VAL A 252 -14.506 7.936 -5.141 1.00 8.58 C ATOM 1833 CG2 VAL A 252 -15.373 9.163 -7.161 1.00 10.80 C ATOM 0 H VAL A 252 -12.771 9.990 -7.134 1.00 6.61 H new ATOM 0 HA VAL A 252 -12.637 7.284 -6.906 1.00 5.54 H new ATOM 0 HB VAL A 252 -14.963 7.174 -6.994 1.00 7.14 H new ATOM 0 HG11 VAL A 252 -15.412 7.892 -4.797 1.00 8.58 H new ATOM 0 HG12 VAL A 252 -14.013 7.151 -4.855 1.00 8.58 H new ATOM 0 HG13 VAL A 252 -14.070 8.733 -4.801 1.00 8.58 H new ATOM 0 HG21 VAL A 252 -16.268 9.102 -6.793 1.00 10.80 H new ATOM 0 HG22 VAL A 252 -14.961 9.992 -6.871 1.00 10.80 H new ATOM 0 HG23 VAL A 252 -15.420 9.147 -8.130 1.00 10.80 H new ATOM 1834 N PHE A 253 -13.384 6.878 -9.342 1.00 5.56 N ATOM 1835 CA PHE A 253 -13.367 6.758 -10.793 1.00 5.94 C ATOM 1836 C PHE A 253 -14.282 5.606 -11.212 1.00 5.40 C ATOM 1837 O PHE A 253 -14.597 4.729 -10.412 1.00 5.59 O ATOM 1838 CB PHE A 253 -11.933 6.528 -11.289 1.00 5.98 C ATOM 1839 CG PHE A 253 -11.366 5.199 -10.879 1.00 5.52 C ATOM 1840 CD1 PHE A 253 -10.763 5.023 -9.636 1.00 6.23 C ATOM 1841 CD2 PHE A 253 -11.465 4.103 -11.724 1.00 5.30 C ATOM 1842 CE1 PHE A 253 -10.266 3.784 -9.259 1.00 6.95 C ATOM 1843 CE2 PHE A 253 -10.969 2.869 -11.350 1.00 6.76 C ATOM 1844 CZ PHE A 253 -10.368 2.708 -10.122 1.00 6.41 C ATOM 0 H PHE A 253 -13.547 6.147 -8.920 1.00 5.56 H new ATOM 0 HA PHE A 253 -13.692 7.580 -11.193 1.00 5.94 H new ATOM 0 HB2 PHE A 253 -11.918 6.594 -12.257 1.00 5.98 H new ATOM 0 HB3 PHE A 253 -11.363 7.235 -10.948 1.00 5.98 H new ATOM 0 HD1 PHE A 253 -10.693 5.744 -9.053 1.00 6.23 H new ATOM 0 HD2 PHE A 253 -11.871 4.201 -12.555 1.00 5.30 H new ATOM 0 HE1 PHE A 253 -9.865 3.677 -8.427 1.00 6.95 H new ATOM 0 HE2 PHE A 253 -11.041 2.145 -11.929 1.00 6.76 H new ATOM 0 HZ PHE A 253 -10.031 1.878 -9.873 1.00 6.41 H new ATOM 1845 N PRO A 254 -14.714 5.595 -12.475 1.00 5.79 N ATOM 1846 CA PRO A 254 -15.615 4.516 -12.900 1.00 6.40 C ATOM 1847 C PRO A 254 -14.913 3.172 -12.838 1.00 6.28 C ATOM 1848 O PRO A 254 -13.787 3.036 -13.315 1.00 6.83 O ATOM 1849 CB PRO A 254 -15.921 4.876 -14.357 1.00 7.94 C ATOM 1850 CG PRO A 254 -15.616 6.352 -14.480 1.00 8.12 C ATOM 1851 CD PRO A 254 -14.471 6.585 -13.539 1.00 7.25 C ATOM 0 HA PRO A 254 -16.404 4.440 -12.341 1.00 6.40 H new ATOM 0 HB2 PRO A 254 -15.377 4.355 -14.967 1.00 7.94 H new ATOM 0 HB3 PRO A 254 -16.848 4.691 -14.575 1.00 7.94 H new ATOM 0 HG2 PRO A 254 -15.377 6.588 -15.390 1.00 8.12 H new ATOM 0 HG3 PRO A 254 -16.385 6.892 -14.239 1.00 8.12 H new ATOM 0 HD2 PRO A 254 -13.615 6.444 -13.973 1.00 7.25 H new ATOM 0 HD3 PRO A 254 -14.468 7.491 -13.193 1.00 7.25 H new ATOM 1852 N CYS A 255 -15.562 2.166 -12.258 1.00 5.78 N ATOM 1853 CA CYS A 255 -14.922 0.869 -12.143 1.00 7.49 C ATOM 1854 C CYS A 255 -14.628 0.257 -13.515 1.00 7.31 C ATOM 1855 O CYS A 255 -13.802 -0.650 -13.614 1.00 9.88 O ATOM 1856 CB CYS A 255 -15.758 -0.090 -11.291 1.00 7.68 C ATOM 1857 SG CYS A 255 -15.902 0.361 -9.539 1.00 9.22 S ATOM 0 H CYS A 255 -16.356 2.215 -11.932 1.00 5.78 H new ATOM 0 HA CYS A 255 -14.073 1.010 -11.695 1.00 7.49 H new ATOM 0 HB2 CYS A 255 -16.649 -0.145 -11.671 1.00 7.68 H new ATOM 0 HB3 CYS A 255 -15.369 -0.977 -11.351 1.00 7.68 H new ATOM 1858 N SER A 256 -15.291 0.756 -14.557 1.00 6.04 N ATOM 1859 CA SER A 256 -15.042 0.299 -15.931 1.00 8.41 C ATOM 1860 C SER A 256 -13.739 0.835 -16.540 1.00 10.03 C ATOM 1861 O SER A 256 -13.356 0.426 -17.633 1.00 10.21 O ATOM 1862 CB SER A 256 -16.229 0.641 -16.842 1.00 9.03 C ATOM 1863 OG SER A 256 -16.477 2.038 -16.868 1.00 8.59 O ATOM 0 H SER A 256 -15.895 1.365 -14.492 1.00 6.04 H new ATOM 0 HA SER A 256 -14.940 -0.664 -15.871 1.00 8.41 H new ATOM 0 HB2 SER A 256 -16.049 0.326 -17.742 1.00 9.03 H new ATOM 0 HB3 SER A 256 -17.022 0.176 -16.531 1.00 9.03 H new ATOM 0 HG SER A 256 -17.129 2.198 -17.373 1.00 8.59 H new ATOM 1864 N ALA A 257 -13.055 1.739 -15.846 1.00 7.95 N ATOM 1865 CA ALA A 257 -11.848 2.362 -16.395 1.00 9.37 C ATOM 1866 C ALA A 257 -10.638 1.436 -16.409 1.00 10.32 C ATOM 1867 O ALA A 257 -10.491 0.560 -15.561 1.00 14.47 O ATOM 1868 CB ALA A 257 -11.503 3.624 -15.608 1.00 12.11 C ATOM 0 H ALA A 257 -13.270 2.007 -15.057 1.00 7.95 H new ATOM 0 HA ALA A 257 -12.054 2.578 -17.318 1.00 9.37 H new ATOM 0 HB1 ALA A 257 -10.703 4.028 -15.979 1.00 12.11 H new ATOM 0 HB2 ALA A 257 -12.239 4.253 -15.665 1.00 12.11 H new ATOM 0 HB3 ALA A 257 -11.347 3.394 -14.679 1.00 12.11 H new ATOM 1869 N THR A 258 -9.758 1.672 -17.375 1.00 12.30 N ATOM 1870 CA THR A 258 -8.413 1.119 -17.369 1.00 12.98 C ATOM 1871 C THR A 258 -7.492 2.258 -16.957 1.00 11.54 C ATOM 1872 O THR A 258 -7.419 3.276 -17.636 1.00 14.70 O ATOM 1873 CB THR A 258 -8.004 0.638 -18.769 1.00 16.47 C ATOM 1874 OG1 THR A 258 -9.033 -0.198 -19.308 1.00 21.13 O ATOM 1875 CG2 THR A 258 -6.699 -0.140 -18.707 1.00 19.65 C ATOM 0 H THR A 258 -9.929 2.164 -18.060 1.00 12.30 H new ATOM 0 HA THR A 258 -8.363 0.359 -16.768 1.00 12.98 H new ATOM 0 HB THR A 258 -7.878 1.413 -19.339 1.00 16.47 H new ATOM 0 HG1 THR A 258 -9.573 0.271 -19.749 1.00 21.13 H new ATOM 0 HG21 THR A 258 -6.456 -0.436 -19.598 1.00 19.65 H new ATOM 0 HG22 THR A 258 -5.998 0.430 -18.354 1.00 19.65 H new ATOM 0 HG23 THR A 258 -6.809 -0.912 -18.130 1.00 19.65 H new ATOM 1876 N LEU A 259 -6.800 2.099 -15.835 1.00 8.26 N ATOM 1877 CA LEU A 259 -6.027 3.199 -15.262 1.00 8.10 C ATOM 1878 C LEU A 259 -4.643 3.297 -15.890 1.00 6.89 C ATOM 1879 O LEU A 259 -4.022 2.275 -16.200 1.00 7.56 O ATOM 1880 CB LEU A 259 -5.873 3.005 -13.754 1.00 6.49 C ATOM 1881 CG LEU A 259 -7.169 3.021 -12.950 1.00 6.59 C ATOM 1882 CD1 LEU A 259 -6.873 2.766 -11.483 1.00 8.74 C ATOM 1883 CD2 LEU A 259 -7.923 4.342 -13.123 1.00 8.00 C ATOM 0 H LEU A 259 -6.764 1.364 -15.389 1.00 8.26 H new ATOM 0 HA LEU A 259 -6.511 4.020 -15.446 1.00 8.10 H new ATOM 0 HB2 LEU A 259 -5.425 2.159 -13.597 1.00 6.49 H new ATOM 0 HB3 LEU A 259 -5.291 3.702 -13.413 1.00 6.49 H new ATOM 0 HG LEU A 259 -7.740 2.313 -13.287 1.00 6.59 H new ATOM 0 HD11 LEU A 259 -7.702 2.778 -10.979 1.00 8.74 H new ATOM 0 HD12 LEU A 259 -6.447 1.900 -11.384 1.00 8.74 H new ATOM 0 HD13 LEU A 259 -6.281 3.457 -11.147 1.00 8.74 H new ATOM 0 HD21 LEU A 259 -8.740 4.319 -12.600 1.00 8.00 H new ATOM 0 HD22 LEU A 259 -7.365 5.075 -12.819 1.00 8.00 H new ATOM 0 HD23 LEU A 259 -8.142 4.469 -14.059 1.00 8.00 H new ATOM 1884 N PRO A 260 -4.133 4.518 -16.046 1.00 6.03 N ATOM 1885 CA PRO A 260 -2.745 4.686 -16.490 1.00 6.96 C ATOM 1886 C PRO A 260 -1.765 4.384 -15.357 1.00 6.09 C ATOM 1887 O PRO A 260 -2.107 4.451 -14.175 1.00 5.80 O ATOM 1888 CB PRO A 260 -2.676 6.168 -16.870 1.00 9.01 C ATOM 1889 CG PRO A 260 -3.695 6.818 -16.001 1.00 9.37 C ATOM 1890 CD PRO A 260 -4.811 5.806 -15.825 1.00 7.15 C ATOM 0 HA PRO A 260 -2.508 4.088 -17.216 1.00 6.96 H new ATOM 0 HB2 PRO A 260 -1.791 6.533 -16.712 1.00 9.01 H new ATOM 0 HB3 PRO A 260 -2.875 6.302 -17.810 1.00 9.01 H new ATOM 0 HG2 PRO A 260 -3.313 7.064 -15.144 1.00 9.37 H new ATOM 0 HG3 PRO A 260 -4.028 7.633 -16.408 1.00 9.37 H new ATOM 0 HD2 PRO A 260 -5.205 5.857 -14.940 1.00 7.15 H new ATOM 0 HD3 PRO A 260 -5.528 5.948 -16.463 1.00 7.15 H new ATOM 1891 N SER A 261 -0.540 4.056 -15.725 1.00 5.76 N ATOM 1892 CA SER A 261 0.518 3.892 -14.741 1.00 5.58 C ATOM 1893 C SER A 261 0.921 5.235 -14.139 1.00 5.69 C ATOM 1894 O SER A 261 0.536 6.299 -14.628 1.00 5.45 O ATOM 1895 CB SER A 261 1.734 3.229 -15.388 1.00 7.03 C ATOM 1896 OG SER A 261 2.276 4.073 -16.392 1.00 8.11 O ATOM 0 H SER A 261 -0.298 3.923 -16.539 1.00 5.76 H new ATOM 0 HA SER A 261 0.182 3.327 -14.028 1.00 5.58 H new ATOM 0 HB2 SER A 261 2.407 3.044 -14.714 1.00 7.03 H new ATOM 0 HB3 SER A 261 1.478 2.377 -15.775 1.00 7.03 H new ATOM 0 HG SER A 261 2.726 3.613 -16.932 1.00 8.11 H new ATOM 1897 N PHE A 262 1.689 5.173 -13.060 1.00 4.68 N ATOM 1898 CA PHE A 262 2.255 6.359 -12.428 1.00 5.09 C ATOM 1899 C PHE A 262 3.717 6.068 -12.128 1.00 5.42 C ATOM 1900 O PHE A 262 4.032 5.057 -11.498 1.00 6.08 O ATOM 1901 CB PHE A 262 1.513 6.711 -11.131 1.00 6.23 C ATOM 1902 CG PHE A 262 2.005 7.975 -10.472 1.00 5.43 C ATOM 1903 CD1 PHE A 262 1.455 9.208 -10.813 1.00 5.91 C ATOM 1904 CD2 PHE A 262 3.007 7.942 -9.509 1.00 5.50 C ATOM 1905 CE1 PHE A 262 1.890 10.377 -10.209 1.00 5.98 C ATOM 1906 CE2 PHE A 262 3.454 9.119 -8.903 1.00 5.66 C ATOM 1907 CZ PHE A 262 2.888 10.336 -9.258 1.00 6.11 C ATOM 0 H PHE A 262 1.899 4.436 -12.670 1.00 4.68 H new ATOM 0 HA PHE A 262 2.167 7.119 -13.025 1.00 5.09 H new ATOM 0 HB2 PHE A 262 0.567 6.804 -11.325 1.00 6.23 H new ATOM 0 HB3 PHE A 262 1.603 5.974 -10.506 1.00 6.23 H new ATOM 0 HD1 PHE A 262 0.785 9.248 -11.457 1.00 5.91 H new ATOM 0 HD2 PHE A 262 3.384 7.127 -9.265 1.00 5.50 H new ATOM 0 HE1 PHE A 262 1.508 11.191 -10.446 1.00 5.98 H new ATOM 0 HE2 PHE A 262 4.129 9.087 -8.264 1.00 5.66 H new ATOM 0 HZ PHE A 262 3.181 11.122 -8.856 1.00 6.11 H new ATOM 1908 N THR A 263 4.606 6.945 -12.581 1.00 4.96 N ATOM 1909 CA THR A 263 6.045 6.774 -12.377 1.00 5.80 C ATOM 1910 C THR A 263 6.533 7.778 -11.347 1.00 6.32 C ATOM 1911 O THR A 263 6.148 8.949 -11.400 1.00 7.07 O ATOM 1912 CB THR A 263 6.797 7.017 -13.695 1.00 6.67 C ATOM 1913 OG1 THR A 263 6.361 6.071 -14.670 1.00 8.27 O ATOM 1914 CG2 THR A 263 8.296 6.864 -13.509 1.00 8.17 C ATOM 0 H THR A 263 4.395 7.656 -13.015 1.00 4.96 H new ATOM 0 HA THR A 263 6.212 5.870 -12.069 1.00 5.80 H new ATOM 0 HB THR A 263 6.608 7.923 -13.987 1.00 6.67 H new ATOM 0 HG1 THR A 263 6.756 6.215 -15.397 1.00 8.27 H new ATOM 0 HG21 THR A 263 8.745 7.022 -14.354 1.00 8.17 H new ATOM 0 HG22 THR A 263 8.608 7.506 -12.852 1.00 8.17 H new ATOM 0 HG23 THR A 263 8.494 5.966 -13.201 1.00 8.17 H new ATOM 1915 N PHE A 264 7.354 7.334 -10.396 1.00 6.31 N ATOM 1916 CA PHE A 264 8.041 8.260 -9.504 1.00 6.56 C ATOM 1917 C PHE A 264 9.556 8.144 -9.625 1.00 6.29 C ATOM 1918 O PHE A 264 10.092 7.078 -9.928 1.00 6.78 O ATOM 1919 CB PHE A 264 7.553 8.166 -8.043 1.00 6.42 C ATOM 1920 CG PHE A 264 7.843 6.855 -7.348 1.00 6.04 C ATOM 1921 CD1 PHE A 264 8.998 6.691 -6.597 1.00 7.47 C ATOM 1922 CD2 PHE A 264 6.918 5.822 -7.374 1.00 6.18 C ATOM 1923 CE1 PHE A 264 9.247 5.504 -5.916 1.00 6.96 C ATOM 1924 CE2 PHE A 264 7.148 4.642 -6.697 1.00 7.04 C ATOM 1925 CZ PHE A 264 8.324 4.480 -5.966 1.00 7.18 C ATOM 0 H PHE A 264 7.525 6.503 -10.253 1.00 6.31 H new ATOM 0 HA PHE A 264 7.802 9.153 -9.799 1.00 6.56 H new ATOM 0 HB2 PHE A 264 7.963 8.883 -7.534 1.00 6.42 H new ATOM 0 HB3 PHE A 264 6.595 8.319 -8.027 1.00 6.42 H new ATOM 0 HD1 PHE A 264 9.615 7.385 -6.548 1.00 7.47 H new ATOM 0 HD2 PHE A 264 6.129 5.926 -7.856 1.00 6.18 H new ATOM 0 HE1 PHE A 264 10.033 5.401 -5.429 1.00 6.96 H new ATOM 0 HE2 PHE A 264 6.520 3.957 -6.728 1.00 7.04 H new ATOM 0 HZ PHE A 264 8.486 3.684 -5.513 1.00 7.18 H new ATOM 1926 N GLY A 265 10.238 9.261 -9.418 1.00 6.09 N ATOM 1927 CA GLY A 265 11.683 9.298 -9.536 1.00 7.10 C ATOM 1928 C GLY A 265 12.411 9.015 -8.240 1.00 6.36 C ATOM 1929 O GLY A 265 12.009 9.451 -7.163 1.00 5.83 O ATOM 0 H GLY A 265 9.878 10.013 -9.207 1.00 6.09 H new ATOM 0 HA2 GLY A 265 11.961 8.649 -10.201 1.00 7.10 H new ATOM 0 HA3 GLY A 265 11.950 10.172 -9.863 1.00 7.10 H new ATOM 1930 N VAL A 266 13.501 8.263 -8.361 1.00 7.05 N ATOM 1931 CA VAL A 266 14.437 8.059 -7.266 1.00 6.34 C ATOM 1932 C VAL A 266 15.797 8.407 -7.849 1.00 6.63 C ATOM 1933 O VAL A 266 16.351 7.647 -8.634 1.00 7.57 O ATOM 1934 CB VAL A 266 14.418 6.606 -6.760 1.00 7.34 C ATOM 1935 CG1 VAL A 266 15.377 6.435 -5.594 1.00 7.80 C ATOM 1936 CG2 VAL A 266 12.992 6.201 -6.361 1.00 8.67 C ATOM 0 H VAL A 266 13.718 7.855 -9.086 1.00 7.05 H new ATOM 0 HA VAL A 266 14.210 8.606 -6.498 1.00 6.34 H new ATOM 0 HB VAL A 266 14.711 6.023 -7.477 1.00 7.34 H new ATOM 0 HG11 VAL A 266 15.353 5.515 -5.287 1.00 7.80 H new ATOM 0 HG12 VAL A 266 16.277 6.657 -5.880 1.00 7.80 H new ATOM 0 HG13 VAL A 266 15.114 7.024 -4.869 1.00 7.80 H new ATOM 0 HG21 VAL A 266 12.992 5.284 -6.044 1.00 8.67 H new ATOM 0 HG22 VAL A 266 12.675 6.786 -5.656 1.00 8.67 H new ATOM 0 HG23 VAL A 266 12.407 6.276 -7.131 1.00 8.67 H new ATOM 1937 N GLY A 267 16.321 9.580 -7.505 1.00 6.96 N ATOM 1938 CA GLY A 267 17.490 10.075 -8.215 1.00 8.13 C ATOM 1939 C GLY A 267 17.189 10.068 -9.706 1.00 9.99 C ATOM 1940 O GLY A 267 16.125 10.525 -10.134 1.00 8.60 O ATOM 0 H GLY A 267 16.023 10.091 -6.881 1.00 6.96 H new ATOM 0 HA2 GLY A 267 17.709 10.973 -7.920 1.00 8.13 H new ATOM 0 HA3 GLY A 267 18.261 9.518 -8.024 1.00 8.13 H new ATOM 1941 N SER A 268 18.110 9.541 -10.511 1.00 8.69 N ATOM 1942 CA SER A 268 17.891 9.446 -11.953 1.00 9.42 C ATOM 1943 C SER A 268 17.088 8.206 -12.358 1.00 8.96 C ATOM 1944 O SER A 268 16.750 8.030 -13.530 1.00 10.94 O ATOM 1945 CB SER A 268 19.226 9.459 -12.699 1.00 14.74 C ATOM 1946 OG SER A 268 20.026 8.365 -12.293 1.00 20.05 O ATOM 0 H SER A 268 18.867 9.233 -10.243 1.00 8.69 H new ATOM 0 HA SER A 268 17.365 10.223 -12.200 1.00 9.42 H new ATOM 0 HB2 SER A 268 19.070 9.416 -13.655 1.00 14.74 H new ATOM 0 HB3 SER A 268 19.693 10.291 -12.525 1.00 14.74 H new ATOM 0 HG SER A 268 19.623 7.928 -11.699 1.00 20.05 H new ATOM 1947 N ALA A 269 16.785 7.350 -11.386 1.00 8.42 N ATOM 1948 CA ALA A 269 16.020 6.130 -11.638 1.00 8.76 C ATOM 1949 C ALA A 269 14.510 6.382 -11.618 1.00 6.94 C ATOM 1950 O ALA A 269 14.052 7.420 -11.136 1.00 8.03 O ATOM 1951 CB ALA A 269 16.393 5.063 -10.624 1.00 11.30 C ATOM 0 H ALA A 269 17.016 7.459 -10.565 1.00 8.42 H new ATOM 0 HA ALA A 269 16.247 5.820 -12.529 1.00 8.76 H new ATOM 0 HB1 ALA A 269 15.881 4.258 -10.798 1.00 11.30 H new ATOM 0 HB2 ALA A 269 17.340 4.866 -10.695 1.00 11.30 H new ATOM 0 HB3 ALA A 269 16.196 5.383 -9.730 1.00 11.30 H new ATOM 1952 N ARG A 270 13.755 5.425 -12.139 1.00 7.07 N ATOM 1953 CA ARG A 270 12.311 5.566 -12.254 1.00 6.17 C ATOM 1954 C ARG A 270 11.642 4.277 -11.799 1.00 8.65 C ATOM 1955 O ARG A 270 12.023 3.186 -12.229 1.00 11.27 O ATOM 1956 CB ARG A 270 11.934 5.849 -13.708 1.00 9.82 C ATOM 1957 CG ARG A 270 12.669 7.049 -14.336 1.00 9.21 C ATOM 1958 CD ARG A 270 12.184 8.381 -13.757 1.00 8.30 C ATOM 1959 NE ARG A 270 12.891 9.544 -14.312 1.00 9.72 N ATOM 1960 CZ ARG A 270 13.806 10.266 -13.667 1.00 8.30 C ATOM 1961 NH1 ARG A 270 14.171 9.972 -12.428 1.00 9.28 N ATOM 1962 NH2 ARG A 270 14.371 11.309 -14.273 1.00 11.94 N ATOM 0 H ARG A 270 14.063 4.679 -12.435 1.00 7.07 H new ATOM 0 HA ARG A 270 12.014 6.303 -11.697 1.00 6.17 H new ATOM 0 HB2 ARG A 270 12.118 5.058 -14.238 1.00 9.82 H new ATOM 0 HB3 ARG A 270 10.978 6.007 -13.758 1.00 9.82 H new ATOM 0 HG2 ARG A 270 13.623 6.959 -14.185 1.00 9.21 H new ATOM 0 HG3 ARG A 270 12.532 7.045 -15.296 1.00 9.21 H new ATOM 0 HD2 ARG A 270 11.234 8.475 -13.929 1.00 8.30 H new ATOM 0 HD3 ARG A 270 12.298 8.369 -12.794 1.00 8.30 H new ATOM 0 HE ARG A 270 12.699 9.777 -15.117 1.00 9.72 H new ATOM 0 HH11 ARG A 270 13.815 9.302 -12.022 1.00 9.28 H new ATOM 0 HH12 ARG A 270 14.764 10.451 -12.029 1.00 9.28 H new ATOM 0 HH21 ARG A 270 14.145 11.514 -15.077 1.00 11.94 H new ATOM 0 HH22 ARG A 270 14.962 11.778 -13.860 1.00 11.94 H new ATOM 1963 N ILE A 271 10.642 4.403 -10.934 1.00 6.19 N ATOM 1964 CA ILE A 271 9.822 3.274 -10.512 1.00 6.61 C ATOM 1965 C ILE A 271 8.429 3.441 -11.115 1.00 5.44 C ATOM 1966 O ILE A 271 7.783 4.480 -10.930 1.00 6.28 O ATOM 1967 CB ILE A 271 9.740 3.190 -8.969 1.00 5.80 C ATOM 1968 CG1 ILE A 271 11.135 3.005 -8.350 1.00 8.09 C ATOM 1969 CG2 ILE A 271 8.785 2.071 -8.560 1.00 7.26 C ATOM 1970 CD1 ILE A 271 11.813 1.712 -8.734 1.00 10.57 C ATOM 0 H ILE A 271 10.419 5.151 -10.573 1.00 6.19 H new ATOM 0 HA ILE A 271 10.223 2.448 -10.824 1.00 6.61 H new ATOM 0 HB ILE A 271 9.389 4.027 -8.627 1.00 5.80 H new ATOM 0 HG12 ILE A 271 11.699 3.747 -8.619 1.00 8.09 H new ATOM 0 HG13 ILE A 271 11.057 3.044 -7.384 1.00 8.09 H new ATOM 0 HG21 ILE A 271 8.738 2.023 -7.592 1.00 7.26 H new ATOM 0 HG22 ILE A 271 7.902 2.252 -8.918 1.00 7.26 H new ATOM 0 HG23 ILE A 271 9.108 1.226 -8.910 1.00 7.26 H new ATOM 0 HD11 ILE A 271 12.684 1.664 -8.309 1.00 10.57 H new ATOM 0 HD12 ILE A 271 11.270 0.963 -8.443 1.00 10.57 H new ATOM 0 HD13 ILE A 271 11.921 1.677 -9.697 1.00 10.57 H new ATOM 1971 N VAL A 272 7.984 2.433 -11.855 1.00 5.11 N ATOM 1972 CA VAL A 272 6.683 2.480 -12.514 1.00 5.70 C ATOM 1973 C VAL A 272 5.644 1.668 -11.746 1.00 6.73 C ATOM 1974 O VAL A 272 5.806 0.463 -11.539 1.00 7.51 O ATOM 1975 CB VAL A 272 6.776 1.963 -13.964 1.00 6.65 C ATOM 1976 CG1 VAL A 272 5.393 2.032 -14.639 1.00 9.15 C ATOM 1977 CG2 VAL A 272 7.823 2.751 -14.743 1.00 9.43 C ATOM 0 H VAL A 272 8.424 1.706 -11.990 1.00 5.11 H new ATOM 0 HA VAL A 272 6.403 3.409 -12.529 1.00 5.70 H new ATOM 0 HB VAL A 272 7.057 1.035 -13.955 1.00 6.65 H new ATOM 0 HG11 VAL A 272 5.461 1.705 -15.550 1.00 9.15 H new ATOM 0 HG12 VAL A 272 4.764 1.483 -14.145 1.00 9.15 H new ATOM 0 HG13 VAL A 272 5.083 2.951 -14.648 1.00 9.15 H new ATOM 0 HG21 VAL A 272 7.871 2.416 -15.652 1.00 9.43 H new ATOM 0 HG22 VAL A 272 7.577 3.689 -14.758 1.00 9.43 H new ATOM 0 HG23 VAL A 272 8.688 2.650 -14.316 1.00 9.43 H new ATOM 1978 N ILE A 273 4.580 2.344 -11.313 1.00 5.42 N ATOM 1979 CA ILE A 273 3.449 1.704 -10.658 1.00 6.02 C ATOM 1980 C ILE A 273 2.412 1.404 -11.740 1.00 5.57 C ATOM 1981 O ILE A 273 1.856 2.327 -12.333 1.00 6.00 O ATOM 1982 CB ILE A 273 2.806 2.637 -9.606 1.00 4.24 C ATOM 1983 CG1 ILE A 273 3.832 3.133 -8.581 1.00 4.80 C ATOM 1984 CG2 ILE A 273 1.626 1.937 -8.938 1.00 7.05 C ATOM 1985 CD1 ILE A 273 3.280 4.235 -7.682 1.00 5.28 C ATOM 0 H ILE A 273 4.497 3.196 -11.394 1.00 5.42 H new ATOM 0 HA ILE A 273 3.750 0.901 -10.205 1.00 6.02 H new ATOM 0 HB ILE A 273 2.473 3.426 -10.061 1.00 4.24 H new ATOM 0 HG12 ILE A 273 4.122 2.388 -8.032 1.00 4.80 H new ATOM 0 HG13 ILE A 273 4.616 3.463 -9.047 1.00 4.80 H new ATOM 0 HG21 ILE A 273 1.229 2.529 -8.280 1.00 7.05 H new ATOM 0 HG22 ILE A 273 0.963 1.708 -9.608 1.00 7.05 H new ATOM 0 HG23 ILE A 273 1.935 1.128 -8.500 1.00 7.05 H new ATOM 0 HD11 ILE A 273 3.964 4.514 -7.054 1.00 5.28 H new ATOM 0 HD12 ILE A 273 3.013 4.993 -8.225 1.00 5.28 H new ATOM 0 HD13 ILE A 273 2.511 3.900 -7.194 1.00 5.28 H new ATOM 1986 N PRO A 274 2.155 0.122 -12.029 1.00 5.90 N ATOM 1987 CA PRO A 274 1.153 -0.185 -13.059 1.00 6.19 C ATOM 1988 C PRO A 274 -0.226 0.344 -12.672 1.00 6.55 C ATOM 1989 O PRO A 274 -0.559 0.410 -11.484 1.00 5.38 O ATOM 1990 CB PRO A 274 1.146 -1.721 -13.094 1.00 7.36 C ATOM 1991 CG PRO A 274 2.515 -2.109 -12.604 1.00 7.54 C ATOM 1992 CD PRO A 274 2.831 -1.088 -11.525 1.00 5.67 C ATOM 0 HA PRO A 274 1.360 0.223 -13.914 1.00 6.19 H new ATOM 0 HB2 PRO A 274 0.450 -2.085 -12.525 1.00 7.36 H new ATOM 0 HB3 PRO A 274 0.983 -2.054 -13.990 1.00 7.36 H new ATOM 0 HG2 PRO A 274 2.521 -3.012 -12.250 1.00 7.54 H new ATOM 0 HG3 PRO A 274 3.168 -2.081 -13.320 1.00 7.54 H new ATOM 0 HD2 PRO A 274 2.489 -1.359 -10.659 1.00 5.67 H new ATOM 0 HD3 PRO A 274 3.786 -0.953 -11.423 1.00 5.67 H new ATOM 1993 N GLY A 275 -1.027 0.714 -13.669 1.00 6.24 N ATOM 1994 CA GLY A 275 -2.361 1.228 -13.420 1.00 6.66 C ATOM 1995 C GLY A 275 -3.205 0.350 -12.515 1.00 6.74 C ATOM 1996 O GLY A 275 -3.945 0.857 -11.659 1.00 6.48 O ATOM 0 H GLY A 275 -0.811 0.673 -14.500 1.00 6.24 H new ATOM 0 HA2 GLY A 275 -2.288 2.110 -13.023 1.00 6.66 H new ATOM 0 HA3 GLY A 275 -2.819 1.336 -14.268 1.00 6.66 H new ATOM 1997 N ASP A 276 -3.103 -0.969 -12.674 1.00 6.47 N ATOM 1998 CA ASP A 276 -3.948 -1.859 -11.887 1.00 7.59 C ATOM 1999 C ASP A 276 -3.679 -1.723 -10.384 1.00 7.08 C ATOM 2000 O ASP A 276 -4.563 -1.979 -9.564 1.00 8.40 O ATOM 2001 CB ASP A 276 -3.797 -3.323 -12.331 1.00 10.45 C ATOM 2002 CG ASP A 276 -4.449 -3.616 -13.682 1.00 18.06 C ATOM 2003 OD1 ASP A 276 -5.127 -2.739 -14.255 1.00 19.09 O ATOM 2004 OD2 ASP A 276 -4.288 -4.758 -14.165 1.00 26.77 O ATOM 0 H ASP A 276 -2.564 -1.359 -13.219 1.00 6.47 H new ATOM 0 HA ASP A 276 -4.865 -1.587 -12.050 1.00 7.59 H new ATOM 0 HB2 ASP A 276 -2.854 -3.544 -12.380 1.00 10.45 H new ATOM 0 HB3 ASP A 276 -4.189 -3.901 -11.658 1.00 10.45 H new ATOM 2005 N TYR A 277 -2.462 -1.321 -10.016 1.00 5.92 N ATOM 2006 CA TYR A 277 -2.116 -1.169 -8.602 1.00 5.51 C ATOM 2007 C TYR A 277 -2.882 -0.021 -7.943 1.00 4.88 C ATOM 2008 O TYR A 277 -2.921 0.087 -6.721 1.00 7.18 O ATOM 2009 CB TYR A 277 -0.623 -0.872 -8.409 1.00 6.15 C ATOM 2010 CG TYR A 277 0.368 -1.981 -8.707 1.00 5.71 C ATOM 2011 CD1 TYR A 277 0.087 -2.999 -9.618 1.00 7.62 C ATOM 2012 CD2 TYR A 277 1.608 -1.987 -8.077 1.00 6.48 C ATOM 2013 CE1 TYR A 277 1.028 -3.990 -9.886 1.00 8.32 C ATOM 2014 CE2 TYR A 277 2.549 -2.977 -8.330 1.00 6.33 C ATOM 2015 CZ TYR A 277 2.254 -3.966 -9.240 1.00 7.40 C ATOM 2016 OH TYR A 277 3.190 -4.954 -9.498 1.00 9.87 O ATOM 0 H TYR A 277 -1.827 -1.133 -10.564 1.00 5.92 H new ATOM 0 HA TYR A 277 -2.353 -2.015 -8.190 1.00 5.51 H new ATOM 0 HB2 TYR A 277 -0.396 -0.113 -8.968 1.00 6.15 H new ATOM 0 HB3 TYR A 277 -0.492 -0.595 -7.489 1.00 6.15 H new ATOM 0 HD1 TYR A 277 -0.736 -3.016 -10.050 1.00 7.62 H new ATOM 0 HD2 TYR A 277 1.812 -1.311 -7.471 1.00 6.48 H new ATOM 0 HE1 TYR A 277 0.835 -4.665 -10.496 1.00 8.32 H new ATOM 0 HE2 TYR A 277 3.368 -2.971 -7.890 1.00 6.33 H new ATOM 0 HH TYR A 277 2.919 -5.439 -10.128 1.00 9.87 H new ATOM 2017 N ILE A 278 -3.464 0.844 -8.767 1.00 5.02 N ATOM 2018 CA ILE A 278 -4.090 2.073 -8.312 1.00 5.16 C ATOM 2019 C ILE A 278 -5.616 1.890 -8.147 1.00 5.22 C ATOM 2020 O ILE A 278 -6.319 2.801 -7.718 1.00 5.72 O ATOM 2021 CB ILE A 278 -3.662 3.224 -9.266 1.00 5.54 C ATOM 2022 CG1 ILE A 278 -2.137 3.407 -9.181 1.00 5.62 C ATOM 2023 CG2 ILE A 278 -4.353 4.534 -8.926 1.00 5.71 C ATOM 2024 CD1 ILE A 278 -1.503 4.136 -10.352 1.00 6.88 C ATOM 0 H ILE A 278 -3.505 0.729 -9.618 1.00 5.02 H new ATOM 0 HA ILE A 278 -3.786 2.316 -7.424 1.00 5.16 H new ATOM 0 HB ILE A 278 -3.926 2.981 -10.167 1.00 5.54 H new ATOM 0 HG12 ILE A 278 -1.929 3.892 -8.367 1.00 5.62 H new ATOM 0 HG13 ILE A 278 -1.725 2.532 -9.103 1.00 5.62 H new ATOM 0 HG21 ILE A 278 -4.060 5.224 -9.542 1.00 5.71 H new ATOM 0 HG22 ILE A 278 -5.314 4.422 -9.000 1.00 5.71 H new ATOM 0 HG23 ILE A 278 -4.127 4.793 -8.019 1.00 5.71 H new ATOM 0 HD11 ILE A 278 -0.546 4.204 -10.211 1.00 6.88 H new ATOM 0 HD12 ILE A 278 -1.675 3.645 -11.171 1.00 6.88 H new ATOM 0 HD13 ILE A 278 -1.883 5.026 -10.423 1.00 6.88 H new ATOM 2025 N ASP A 279 -6.119 0.695 -8.451 1.00 6.14 N ATOM 2026 CA ASP A 279 -7.551 0.399 -8.325 1.00 6.61 C ATOM 2027 C ASP A 279 -7.839 -0.225 -6.957 1.00 6.49 C ATOM 2028 O ASP A 279 -7.386 -1.332 -6.663 1.00 8.04 O ATOM 2029 CB ASP A 279 -7.953 -0.575 -9.442 1.00 8.20 C ATOM 2030 CG ASP A 279 -9.445 -0.849 -9.499 1.00 10.83 C ATOM 2031 OD1 ASP A 279 -9.893 -1.315 -10.573 1.00 18.78 O ATOM 2032 OD2 ASP A 279 -10.178 -0.591 -8.531 1.00 9.22 O ATOM 0 H ASP A 279 -5.646 0.035 -8.734 1.00 6.14 H new ATOM 0 HA ASP A 279 -8.064 1.219 -8.403 1.00 6.61 H new ATOM 0 HB2 ASP A 279 -7.665 -0.214 -10.295 1.00 8.20 H new ATOM 0 HB3 ASP A 279 -7.482 -1.413 -9.315 1.00 8.20 H new ATOM 2033 N PHE A 280 -8.608 0.477 -6.124 1.00 6.36 N ATOM 2034 CA PHE A 280 -8.995 -0.063 -4.822 1.00 6.11 C ATOM 2035 C PHE A 280 -10.455 -0.474 -4.711 1.00 6.72 C ATOM 2036 O PHE A 280 -10.988 -0.653 -3.619 1.00 8.01 O ATOM 2037 CB PHE A 280 -8.493 0.817 -3.676 1.00 8.16 C ATOM 2038 CG PHE A 280 -7.065 0.554 -3.384 1.00 6.71 C ATOM 2039 CD1 PHE A 280 -6.083 1.027 -4.232 1.00 6.87 C ATOM 2040 CD2 PHE A 280 -6.702 -0.300 -2.360 1.00 8.57 C ATOM 2041 CE1 PHE A 280 -4.761 0.724 -4.024 1.00 8.47 C ATOM 2042 CE2 PHE A 280 -5.377 -0.610 -2.149 1.00 8.11 C ATOM 2043 CZ PHE A 280 -4.409 -0.101 -2.986 1.00 8.17 C ATOM 0 H PHE A 280 -8.914 1.263 -6.293 1.00 6.36 H new ATOM 0 HA PHE A 280 -8.533 -0.912 -4.736 1.00 6.11 H new ATOM 0 HB2 PHE A 280 -8.612 1.752 -3.907 1.00 8.16 H new ATOM 0 HB3 PHE A 280 -9.024 0.651 -2.881 1.00 8.16 H new ATOM 0 HD1 PHE A 280 -6.322 1.560 -4.956 1.00 6.87 H new ATOM 0 HD2 PHE A 280 -7.356 -0.667 -1.810 1.00 8.57 H new ATOM 0 HE1 PHE A 280 -4.107 1.076 -4.584 1.00 8.47 H new ATOM 0 HE2 PHE A 280 -5.136 -1.163 -1.441 1.00 8.11 H new ATOM 0 HZ PHE A 280 -3.515 -0.317 -2.847 1.00 8.17 H new ATOM 2044 N GLY A 281 -11.067 -0.687 -5.866 1.00 6.53 N ATOM 2045 CA GLY A 281 -12.362 -1.335 -5.922 1.00 6.79 C ATOM 2046 C GLY A 281 -13.531 -0.458 -5.518 1.00 6.12 C ATOM 2047 O GLY A 281 -13.374 0.714 -5.177 1.00 6.10 O ATOM 0 H GLY A 281 -10.746 -0.462 -6.631 1.00 6.53 H new ATOM 0 HA2 GLY A 281 -12.511 -1.654 -6.826 1.00 6.79 H new ATOM 0 HA3 GLY A 281 -12.345 -2.115 -5.345 1.00 6.79 H new ATOM 2048 N PRO A 282 -14.734 -1.037 -5.548 1.00 6.33 N ATOM 2049 CA PRO A 282 -15.954 -0.271 -5.284 1.00 6.71 C ATOM 2050 C PRO A 282 -15.921 0.490 -3.963 1.00 7.57 C ATOM 2051 O PRO A 282 -15.425 -0.023 -2.955 1.00 7.94 O ATOM 2052 CB PRO A 282 -17.034 -1.357 -5.282 1.00 6.79 C ATOM 2053 CG PRO A 282 -16.530 -2.329 -6.289 1.00 7.47 C ATOM 2054 CD PRO A 282 -15.043 -2.404 -6.009 1.00 6.84 C ATOM 0 HA PRO A 282 -16.097 0.429 -5.940 1.00 6.71 H new ATOM 0 HB2 PRO A 282 -17.133 -1.764 -4.407 1.00 6.79 H new ATOM 0 HB3 PRO A 282 -17.902 -1.001 -5.529 1.00 6.79 H new ATOM 0 HG2 PRO A 282 -16.955 -3.196 -6.191 1.00 7.47 H new ATOM 0 HG3 PRO A 282 -16.707 -2.028 -7.194 1.00 7.47 H new ATOM 0 HD2 PRO A 282 -14.836 -3.068 -5.333 1.00 6.84 H new ATOM 0 HD3 PRO A 282 -14.538 -2.640 -6.803 1.00 6.84 H new ATOM 2055 N ILE A 283 -16.458 1.705 -3.967 1.00 6.42 N ATOM 2056 CA ILE A 283 -16.463 2.534 -2.762 1.00 8.20 C ATOM 2057 C ILE A 283 -17.365 1.952 -1.682 1.00 8.24 C ATOM 2058 O ILE A 283 -17.151 2.193 -0.489 1.00 12.25 O ATOM 2059 CB ILE A 283 -16.858 3.988 -3.071 1.00 9.57 C ATOM 2060 CG1 ILE A 283 -18.266 4.055 -3.681 1.00 9.54 C ATOM 2061 CG2 ILE A 283 -15.819 4.621 -3.995 1.00 10.24 C ATOM 2062 CD1 ILE A 283 -18.796 5.476 -3.876 1.00 12.36 C ATOM 0 H ILE A 283 -16.824 2.069 -4.654 1.00 6.42 H new ATOM 0 HA ILE A 283 -15.554 2.538 -2.423 1.00 8.20 H new ATOM 0 HB ILE A 283 -16.879 4.492 -2.243 1.00 9.57 H new ATOM 0 HG12 ILE A 283 -18.258 3.603 -4.539 1.00 9.54 H new ATOM 0 HG13 ILE A 283 -18.879 3.567 -3.109 1.00 9.54 H new ATOM 0 HG21 ILE A 283 -16.072 5.537 -4.187 1.00 10.24 H new ATOM 0 HG22 ILE A 283 -14.951 4.610 -3.562 1.00 10.24 H new ATOM 0 HG23 ILE A 283 -15.773 4.118 -4.823 1.00 10.24 H new ATOM 0 HD11 ILE A 283 -19.685 5.440 -4.263 1.00 12.36 H new ATOM 0 HD12 ILE A 283 -18.835 5.927 -3.018 1.00 12.36 H new ATOM 0 HD13 ILE A 283 -18.205 5.963 -4.471 1.00 12.36 H new ATOM 2063 N SER A 284 -18.368 1.193 -2.110 1.00 7.78 N ATOM 2064 CA SER A 284 -19.254 0.441 -1.224 1.00 8.31 C ATOM 2065 C SER A 284 -19.672 -0.796 -1.990 1.00 6.71 C ATOM 2066 O SER A 284 -19.623 -0.820 -3.221 1.00 7.32 O ATOM 2067 CB SER A 284 -20.491 1.258 -0.844 1.00 11.25 C ATOM 2068 OG SER A 284 -20.158 2.369 -0.033 1.00 15.92 O ATOM 0 H SER A 284 -18.558 1.098 -2.943 1.00 7.78 H new ATOM 0 HA SER A 284 -18.797 0.220 -0.398 1.00 8.31 H new ATOM 0 HB2 SER A 284 -20.935 1.567 -1.649 1.00 11.25 H new ATOM 0 HB3 SER A 284 -21.121 0.691 -0.373 1.00 11.25 H new ATOM 0 HG SER A 284 -19.324 2.406 0.064 1.00 15.92 H new ATOM 2069 N THR A 285 -20.077 -1.837 -1.276 1.00 9.65 N ATOM 2070 CA THR A 285 -20.361 -3.098 -1.935 1.00 8.35 C ATOM 2071 C THR A 285 -21.365 -2.938 -3.086 1.00 8.40 C ATOM 2072 O THR A 285 -22.456 -2.394 -2.904 1.00 8.49 O ATOM 2073 CB THR A 285 -20.886 -4.120 -0.923 1.00 10.94 C ATOM 2074 OG1 THR A 285 -19.963 -4.197 0.171 1.00 15.18 O ATOM 2075 CG2 THR A 285 -21.028 -5.473 -1.568 1.00 13.27 C ATOM 0 H THR A 285 -20.192 -1.834 -0.424 1.00 9.65 H new ATOM 0 HA THR A 285 -19.527 -3.416 -2.316 1.00 8.35 H new ATOM 0 HB THR A 285 -21.759 -3.841 -0.604 1.00 10.94 H new ATOM 0 HG1 THR A 285 -20.345 -4.538 0.837 1.00 15.18 H new ATOM 0 HG21 THR A 285 -21.361 -6.109 -0.916 1.00 13.27 H new ATOM 0 HG22 THR A 285 -21.651 -5.415 -2.309 1.00 13.27 H new ATOM 0 HG23 THR A 285 -20.164 -5.768 -1.895 1.00 13.27 H new ATOM 2076 N GLY A 286 -20.993 -3.402 -4.272 1.00 7.96 N ATOM 2077 CA GLY A 286 -21.882 -3.364 -5.415 1.00 8.34 C ATOM 2078 C GLY A 286 -21.887 -2.065 -6.208 1.00 7.27 C ATOM 2079 O GLY A 286 -22.539 -1.980 -7.233 1.00 7.15 O ATOM 0 H GLY A 286 -20.221 -3.746 -4.433 1.00 7.96 H new ATOM 0 HA2 GLY A 286 -21.642 -4.088 -6.014 1.00 8.34 H new ATOM 0 HA3 GLY A 286 -22.785 -3.538 -5.107 1.00 8.34 H new ATOM 2080 N SER A 287 -21.159 -1.054 -5.748 1.00 6.22 N ATOM 2081 CA SER A 287 -21.098 0.219 -6.465 1.00 5.38 C ATOM 2082 C SER A 287 -20.245 0.106 -7.727 1.00 5.29 C ATOM 2083 O SER A 287 -19.278 -0.666 -7.762 1.00 7.03 O ATOM 2084 CB SER A 287 -20.504 1.291 -5.551 1.00 6.48 C ATOM 2085 OG SER A 287 -20.393 2.530 -6.237 1.00 6.49 O ATOM 0 H SER A 287 -20.694 -1.082 -5.025 1.00 6.22 H new ATOM 0 HA SER A 287 -22.000 0.462 -6.726 1.00 5.38 H new ATOM 0 HB2 SER A 287 -21.063 1.400 -4.766 1.00 6.48 H new ATOM 0 HB3 SER A 287 -19.630 1.009 -5.240 1.00 6.48 H new ATOM 0 HG SER A 287 -21.023 3.035 -6.007 1.00 6.49 H new ATOM 2086 N SER A 288 -20.574 0.899 -8.739 1.00 5.58 N ATOM 2087 CA SER A 288 -19.722 1.009 -9.927 1.00 5.17 C ATOM 2088 C SER A 288 -18.739 2.182 -9.849 1.00 6.31 C ATOM 2089 O SER A 288 -18.079 2.489 -10.836 1.00 7.84 O ATOM 2090 CB SER A 288 -20.573 1.129 -11.190 1.00 8.02 C ATOM 2091 OG SER A 288 -21.234 2.376 -11.234 1.00 9.89 O ATOM 0 H SER A 288 -21.284 1.383 -8.762 1.00 5.58 H new ATOM 0 HA SER A 288 -19.196 0.195 -9.964 1.00 5.17 H new ATOM 0 HB2 SER A 288 -20.011 1.028 -11.974 1.00 8.02 H new ATOM 0 HB3 SER A 288 -21.225 0.412 -11.215 1.00 8.02 H new ATOM 0 HG SER A 288 -20.800 2.907 -11.719 1.00 9.89 H new ATOM 2092 N SER A 289 -18.691 2.858 -8.707 1.00 5.79 N ATOM 2093 CA ASER A 289 -17.688 3.882 -8.446 0.54 5.75 C ATOM 2094 CA BSER A 289 -17.678 3.869 -8.461 0.46 5.77 C ATOM 2095 C SER A 289 -16.570 3.242 -7.632 1.00 5.47 C ATOM 2096 O SER A 289 -16.835 2.611 -6.600 1.00 6.79 O ATOM 2097 CB ASER A 289 -18.315 5.039 -7.669 0.54 7.10 C ATOM 2098 CB BSER A 289 -18.288 5.058 -7.732 0.46 7.11 C ATOM 2099 OG ASER A 289 -17.393 6.104 -7.481 0.54 8.20 O ATOM 2100 OG BSER A 289 -19.196 5.739 -8.575 0.46 10.25 O ATOM 0 H ASER A 289 -19.242 2.735 -8.059 0.54 5.79 H new ATOM 0 H BSER A 289 -19.243 2.743 -8.057 0.46 5.79 H new ATOM 0 HA ASER A 289 -17.336 4.235 -9.278 0.54 5.77 H new ATOM 0 HA BSER A 289 -17.316 4.191 -9.301 0.46 5.77 H new ATOM 0 HB2ASER A 289 -19.094 5.365 -8.146 0.54 7.11 H new ATOM 0 HB2BSER A 289 -18.745 4.755 -6.932 0.46 7.11 H new ATOM 0 HB3ASER A 289 -18.623 4.721 -6.806 0.54 7.11 H new ATOM 0 HB3BSER A 289 -17.587 5.664 -7.445 0.46 7.11 H new ATOM 0 HG ASER A 289 -17.184 6.429 -8.227 0.54 10.25 H new ATOM 0 HG BSER A 289 -19.344 6.506 -8.267 0.46 10.25 H new ATOM 2101 N CYS A 290 -15.332 3.397 -8.095 1.00 5.18 N ATOM 2102 CA CYS A 290 -14.171 2.771 -7.451 1.00 4.61 C ATOM 2103 C CYS A 290 -13.266 3.800 -6.778 1.00 5.59 C ATOM 2104 O CYS A 290 -13.196 4.950 -7.204 1.00 6.43 O ATOM 2105 CB CYS A 290 -13.363 1.964 -8.477 1.00 6.05 C ATOM 2106 SG CYS A 290 -13.993 0.289 -8.805 1.00 8.07 S ATOM 0 H CYS A 290 -15.138 3.866 -8.789 1.00 5.18 H new ATOM 0 HA CYS A 290 -14.510 2.177 -6.763 1.00 4.61 H new ATOM 0 HB2 CYS A 290 -13.342 2.457 -9.312 1.00 6.05 H new ATOM 0 HB3 CYS A 290 -12.447 1.895 -8.166 1.00 6.05 H new ATOM 2107 N PHE A 291 -12.579 3.376 -5.721 1.00 5.73 N ATOM 2108 CA PHE A 291 -11.723 4.281 -4.968 1.00 5.52 C ATOM 2109 C PHE A 291 -10.301 4.276 -5.510 1.00 5.02 C ATOM 2110 O PHE A 291 -9.713 3.221 -5.742 1.00 6.21 O ATOM 2111 CB PHE A 291 -11.719 3.931 -3.479 1.00 8.20 C ATOM 2112 CG PHE A 291 -11.218 5.050 -2.607 1.00 7.99 C ATOM 2113 CD1 PHE A 291 -11.964 6.202 -2.466 1.00 9.00 C ATOM 2114 CD2 PHE A 291 -9.991 4.965 -1.962 1.00 9.93 C ATOM 2115 CE1 PHE A 291 -11.519 7.254 -1.680 1.00 11.48 C ATOM 2116 CE2 PHE A 291 -9.542 6.012 -1.162 1.00 10.05 C ATOM 2117 CZ PHE A 291 -10.302 7.156 -1.030 1.00 10.75 C ATOM 0 H PHE A 291 -12.596 2.569 -5.425 1.00 5.73 H new ATOM 0 HA PHE A 291 -12.088 5.174 -5.073 1.00 5.52 H new ATOM 0 HB2 PHE A 291 -12.619 3.695 -3.206 1.00 8.20 H new ATOM 0 HB3 PHE A 291 -11.165 3.147 -3.339 1.00 8.20 H new ATOM 0 HD1 PHE A 291 -12.780 6.274 -2.906 1.00 9.00 H new ATOM 0 HD2 PHE A 291 -9.466 4.204 -2.065 1.00 9.93 H new ATOM 0 HE1 PHE A 291 -12.036 8.022 -1.590 1.00 11.48 H new ATOM 0 HE2 PHE A 291 -8.729 5.940 -0.716 1.00 10.05 H new ATOM 0 HZ PHE A 291 -9.996 7.860 -0.505 1.00 10.75 H new ATOM 2118 N GLY A 292 -9.743 5.466 -5.706 1.00 4.72 N ATOM 2119 CA GLY A 292 -8.394 5.587 -6.239 1.00 4.99 C ATOM 2120 C GLY A 292 -7.276 5.294 -5.258 1.00 4.84 C ATOM 2121 O GLY A 292 -7.379 5.584 -4.069 1.00 5.84 O ATOM 0 H GLY A 292 -10.130 6.215 -5.536 1.00 4.72 H new ATOM 0 HA2 GLY A 292 -8.306 4.985 -6.994 1.00 4.99 H new ATOM 0 HA3 GLY A 292 -8.277 6.488 -6.579 1.00 4.99 H new ATOM 2122 N GLY A 293 -6.187 4.740 -5.779 1.00 4.51 N ATOM 2123 CA GLY A 293 -5.028 4.412 -4.960 1.00 5.43 C ATOM 2124 C GLY A 293 -3.997 5.527 -4.818 1.00 4.09 C ATOM 2125 O GLY A 293 -3.020 5.380 -4.082 1.00 5.94 O ATOM 0 H GLY A 293 -6.100 4.545 -6.612 1.00 4.51 H new ATOM 0 HA2 GLY A 293 -5.336 4.161 -4.075 1.00 5.43 H new ATOM 0 HA3 GLY A 293 -4.591 3.634 -5.340 1.00 5.43 H new ATOM 2126 N ILE A 294 -4.191 6.605 -5.570 1.00 4.19 N ATOM 2127 CA ILE A 294 -3.385 7.815 -5.452 1.00 4.85 C ATOM 2128 C ILE A 294 -4.328 8.914 -4.976 1.00 4.07 C ATOM 2129 O ILE A 294 -5.371 9.155 -5.602 1.00 5.17 O ATOM 2130 CB ILE A 294 -2.756 8.195 -6.798 1.00 4.51 C ATOM 2131 CG1 ILE A 294 -1.754 7.114 -7.216 1.00 5.27 C ATOM 2132 CG2 ILE A 294 -2.089 9.563 -6.710 1.00 7.79 C ATOM 2133 CD1 ILE A 294 -1.103 7.326 -8.563 1.00 7.62 C ATOM 0 H ILE A 294 -4.803 6.655 -6.172 1.00 4.19 H new ATOM 0 HA ILE A 294 -2.653 7.681 -4.830 1.00 4.85 H new ATOM 0 HB ILE A 294 -3.450 8.252 -7.473 1.00 4.51 H new ATOM 0 HG12 ILE A 294 -1.059 7.060 -6.542 1.00 5.27 H new ATOM 0 HG13 ILE A 294 -2.209 6.257 -7.224 1.00 5.27 H new ATOM 0 HG21 ILE A 294 -1.697 9.788 -7.568 1.00 7.79 H new ATOM 0 HG22 ILE A 294 -2.751 10.231 -6.472 1.00 7.79 H new ATOM 0 HG23 ILE A 294 -1.394 9.542 -6.033 1.00 7.79 H new ATOM 0 HD11 ILE A 294 -0.488 6.598 -8.744 1.00 7.62 H new ATOM 0 HD12 ILE A 294 -1.785 7.351 -9.252 1.00 7.62 H new ATOM 0 HD13 ILE A 294 -0.617 8.166 -8.559 1.00 7.62 H new ATOM 2134 N GLN A 295 -3.989 9.544 -3.854 1.00 4.99 N ATOM 2135 CA GLN A 295 -4.858 10.525 -3.208 1.00 4.90 C ATOM 2136 C GLN A 295 -4.038 11.726 -2.784 1.00 4.47 C ATOM 2137 O GLN A 295 -2.814 11.645 -2.662 1.00 5.28 O ATOM 2138 CB GLN A 295 -5.559 9.912 -1.988 1.00 5.36 C ATOM 2139 CG GLN A 295 -6.508 8.741 -2.305 1.00 5.35 C ATOM 2140 CD GLN A 295 -7.721 9.168 -3.120 1.00 6.38 C ATOM 2141 OE1 GLN A 295 -8.027 10.357 -3.223 1.00 6.04 O ATOM 2142 NE2 GLN A 295 -8.420 8.199 -3.708 1.00 5.84 N ATOM 0 H GLN A 295 -3.244 9.414 -3.444 1.00 4.99 H new ATOM 0 HA GLN A 295 -5.538 10.803 -3.841 1.00 4.90 H new ATOM 0 HB2 GLN A 295 -4.883 9.604 -1.364 1.00 5.36 H new ATOM 0 HB3 GLN A 295 -6.064 10.608 -1.538 1.00 5.36 H new ATOM 0 HG2 GLN A 295 -6.021 8.058 -2.792 1.00 5.35 H new ATOM 0 HG3 GLN A 295 -6.807 8.339 -1.475 1.00 5.35 H new ATOM 0 HE21 GLN A 295 -8.179 7.379 -3.616 1.00 5.84 H new ATOM 0 HE22 GLN A 295 -9.112 8.394 -4.180 1.00 5.84 H new ATOM 2143 N SER A 296 -4.711 12.845 -2.558 1.00 5.47 N ATOM 2144 CA SER A 296 -4.040 14.059 -2.138 1.00 5.14 C ATOM 2145 C SER A 296 -3.549 13.982 -0.702 1.00 5.81 C ATOM 2146 O SER A 296 -4.237 13.491 0.182 1.00 6.97 O ATOM 2147 CB SER A 296 -5.001 15.228 -2.270 1.00 7.07 C ATOM 2148 OG SER A 296 -4.369 16.421 -1.850 1.00 7.40 O ATOM 0 H SER A 296 -5.563 12.920 -2.644 1.00 5.47 H new ATOM 0 HA SER A 296 -3.265 14.178 -2.708 1.00 5.14 H new ATOM 0 HB2 SER A 296 -5.293 15.314 -3.191 1.00 7.07 H new ATOM 0 HB3 SER A 296 -5.794 15.067 -1.735 1.00 7.07 H new ATOM 0 HG SER A 296 -4.930 17.046 -1.836 1.00 7.40 H new ATOM 2149 N SER A 297 -2.342 14.486 -0.477 1.00 5.61 N ATOM 2150 CA SER A 297 -1.802 14.611 0.866 1.00 6.49 C ATOM 2151 C SER A 297 -2.156 15.951 1.508 1.00 9.32 C ATOM 2152 O SER A 297 -1.741 16.224 2.633 1.00 9.93 O ATOM 2153 CB SER A 297 -0.280 14.494 0.824 1.00 7.51 C ATOM 2154 OG SER A 297 0.270 15.560 0.061 1.00 8.36 O ATOM 0 H SER A 297 -1.816 14.764 -1.098 1.00 5.61 H new ATOM 0 HA SER A 297 -2.194 13.899 1.396 1.00 6.49 H new ATOM 0 HB2 SER A 297 0.078 14.513 1.725 1.00 7.51 H new ATOM 0 HB3 SER A 297 -0.024 13.643 0.435 1.00 7.51 H new ATOM 0 HG SER A 297 1.078 15.399 -0.104 1.00 8.36 H new ATOM 2155 N AALA A 298 -2.896 16.794 0.795 0.60 7.66 N ATOM 2156 N BALA A 298 -2.934 16.771 0.807 0.40 7.69 N ATOM 2157 CA AALA A 298 -3.234 18.103 1.343 0.60 10.02 C ATOM 2158 CA BALA A 298 -3.188 18.149 1.238 0.40 10.06 C ATOM 2159 C AALA A 298 -4.042 17.908 2.619 0.60 11.53 C ATOM 2160 C BALA A 298 -3.524 18.304 2.723 0.40 14.35 C ATOM 2161 O AALA A 298 -5.064 17.230 2.622 0.60 13.14 O ATOM 2162 O BALA A 298 -3.041 19.227 3.378 0.40 14.46 O ATOM 2163 CB AALA A 298 -4.002 18.938 0.327 0.60 10.33 C ATOM 2164 CB BALA A 298 -4.276 18.788 0.376 0.40 10.87 C ATOM 0 H AALA A 298 -3.206 16.633 0.009 0.60 7.69 H new ATOM 0 H BALA A 298 -3.327 16.550 0.075 0.40 7.69 H new ATOM 0 HA AALA A 298 -2.419 18.587 1.551 0.60 10.06 H new ATOM 0 HA BALA A 298 -2.347 18.616 1.113 0.40 10.06 H new ATOM 0 HB1AALA A 298 -4.215 19.802 0.713 0.60 10.87 H new ATOM 0 HB1BALA A 298 -4.432 19.698 0.673 0.40 10.87 H new ATOM 0 HB2AALA A 298 -3.458 19.064 -0.466 0.60 10.87 H new ATOM 0 HB2BALA A 298 -3.992 18.796 -0.551 0.40 10.87 H new ATOM 0 HB3AALA A 298 -4.823 18.481 0.086 0.60 10.87 H new ATOM 0 HB3BALA A 298 -5.096 18.276 0.458 0.40 10.87 H new ATOM 2165 N AGLY A 299 -3.558 18.481 3.714 0.60 13.40 N ATOM 2166 N BGLY A 299 -4.355 17.411 3.253 0.40 10.09 N ATOM 2167 CA AGLY A 299 -4.195 18.290 4.999 0.60 17.90 C ATOM 2168 CA BGLY A 299 -4.775 17.514 4.640 0.40 15.66 C ATOM 2169 C AGLY A 299 -3.444 17.307 5.874 0.60 21.01 C ATOM 2170 C BGLY A 299 -3.965 16.677 5.616 0.40 18.77 C ATOM 2171 O AGLY A 299 -3.527 17.380 7.099 0.60 22.66 O ATOM 2172 O BGLY A 299 -4.455 16.328 6.691 0.40 25.57 O ATOM 0 H AGLY A 299 -2.861 18.984 3.730 0.60 10.09 H new ATOM 0 H BGLY A 299 -4.684 16.741 2.826 0.40 10.09 H new ATOM 0 HA2AGLY A 299 -4.258 19.143 5.456 0.60 15.66 H new ATOM 0 HA2BGLY A 299 -4.724 18.444 4.912 0.40 15.66 H new ATOM 0 HA3AGLY A 299 -5.102 17.972 4.864 0.60 15.66 H new ATOM 0 HA3BGLY A 299 -5.706 17.250 4.703 0.40 15.66 H new ATOM 2173 N ILE A 300 -2.718 16.378 5.258 1.00 18.19 N ATOM 2174 CA ILE A 300 -1.883 15.457 6.038 1.00 19.13 C ATOM 2175 C ILE A 300 -0.668 16.157 6.624 1.00 19.87 C ATOM 2176 O ILE A 300 -0.269 15.875 7.754 1.00 22.68 O ATOM 2177 CB ILE A 300 -1.381 14.252 5.201 1.00 18.95 C ATOM 2178 CG1 ILE A 300 -2.549 13.386 4.745 1.00 20.32 C ATOM 2179 CG2 ILE A 300 -0.393 13.406 6.009 1.00 20.42 C ATOM 2180 CD1 ILE A 300 -2.118 12.177 3.934 1.00 19.64 C ATOM 0 H AILE A 300 -2.692 16.262 4.406 0.60 18.19 H new ATOM 0 H BILE A 300 -2.331 16.700 4.561 0.40 18.19 H new ATOM 0 HA ILE A 300 -2.458 15.134 6.749 1.00 19.13 H new ATOM 0 HB ILE A 300 -0.928 14.602 4.418 1.00 18.95 H new ATOM 0 HG12 ILE A 300 -3.044 13.086 5.523 1.00 20.32 H new ATOM 0 HG13 ILE A 300 -3.155 13.925 4.213 1.00 20.32 H new ATOM 0 HG21 ILE A 300 -0.091 12.658 5.470 1.00 20.42 H new ATOM 0 HG22 ILE A 300 0.369 13.951 6.262 1.00 20.42 H new ATOM 0 HG23 ILE A 300 -0.830 13.072 6.808 1.00 20.42 H new ATOM 0 HD11 ILE A 300 -2.900 11.666 3.673 1.00 19.64 H new ATOM 0 HD12 ILE A 300 -1.645 12.472 3.140 1.00 19.64 H new ATOM 0 HD13 ILE A 300 -1.533 11.619 4.470 1.00 19.64 H new ATOM 2181 N GLY A 301 -0.072 17.058 5.849 1.00 16.83 N ATOM 2182 CA GLY A 301 1.123 17.762 6.274 1.00 22.71 C ATOM 2183 C GLY A 301 2.381 17.083 5.773 1.00 18.90 C ATOM 2184 O GLY A 301 3.489 17.590 5.954 1.00 24.28 O ATOM 0 H GLY A 301 -0.351 17.275 5.065 1.00 16.83 H new ATOM 0 HA2 GLY A 301 1.095 18.675 5.946 1.00 22.71 H new ATOM 0 HA3 GLY A 301 1.144 17.809 7.243 1.00 22.71 H new ATOM 2185 N ILE A 302 2.207 15.928 5.132 1.00 17.82 N ATOM 2186 CA ILE A 302 3.332 15.175 4.596 1.00 17.58 C ATOM 2187 C ILE A 302 2.873 14.259 3.455 1.00 8.58 C ATOM 2188 O ILE A 302 1.753 13.759 3.460 1.00 11.51 O ATOM 2189 CB ILE A 302 4.026 14.334 5.708 1.00 19.15 C ATOM 2190 CG1 ILE A 302 5.397 13.831 5.249 1.00 22.74 C ATOM 2191 CG2 ILE A 302 3.130 13.194 6.156 1.00 20.69 C ATOM 2192 CD1 ILE A 302 6.526 14.814 5.480 1.00 37.56 C ATOM 0 H ILE A 302 1.439 15.564 4.998 1.00 17.82 H new ATOM 0 HA ILE A 302 3.976 15.812 4.249 1.00 17.58 H new ATOM 0 HB ILE A 302 4.176 14.910 6.474 1.00 19.15 H new ATOM 0 HG12 ILE A 302 5.600 13.005 5.715 1.00 22.74 H new ATOM 0 HG13 ILE A 302 5.353 13.620 4.303 1.00 22.74 H new ATOM 0 HG21 ILE A 302 3.578 12.682 6.848 1.00 20.69 H new ATOM 0 HG22 ILE A 302 2.300 13.553 6.507 1.00 20.69 H new ATOM 0 HG23 ILE A 302 2.938 12.617 5.400 1.00 20.69 H new ATOM 0 HD11 ILE A 302 7.359 14.429 5.167 1.00 37.56 H new ATOM 0 HD12 ILE A 302 6.346 15.634 4.994 1.00 37.56 H new ATOM 0 HD13 ILE A 302 6.597 15.009 6.428 1.00 37.56 H new ATOM 2193 N ASN A 303 3.755 14.051 2.484 1.00 8.49 N ATOM 2194 CA ASN A 303 3.490 13.069 1.435 1.00 6.91 C ATOM 2195 C ASN A 303 3.866 11.683 1.925 1.00 5.74 C ATOM 2196 O ASN A 303 4.828 11.525 2.681 1.00 6.89 O ATOM 2197 CB ASN A 303 4.259 13.419 0.168 1.00 7.09 C ATOM 2198 CG ASN A 303 3.883 14.782 -0.367 1.00 7.56 C ATOM 2199 OD1 ASN A 303 2.717 15.050 -0.631 1.00 8.51 O ATOM 2200 ND2 ASN A 303 4.865 15.653 -0.525 1.00 8.61 N ATOM 0 H ASN A 303 4.507 14.463 2.413 1.00 8.49 H new ATOM 0 HA ASN A 303 2.543 13.081 1.223 1.00 6.91 H new ATOM 0 HB2 ASN A 303 5.211 13.397 0.352 1.00 7.09 H new ATOM 0 HB3 ASN A 303 4.085 12.748 -0.510 1.00 7.09 H new ATOM 0 HD21 ASN A 303 4.696 16.442 -0.823 1.00 8.61 H new ATOM 0 HD22 ASN A 303 5.672 15.431 -0.329 1.00 8.61 H new ATOM 2201 N ILE A 304 3.104 10.685 1.501 1.00 5.89 N ATOM 2202 CA ILE A 304 3.307 9.328 1.996 1.00 5.74 C ATOM 2203 C ILE A 304 3.415 8.340 0.854 1.00 5.55 C ATOM 2204 O ILE A 304 2.447 8.113 0.115 1.00 5.80 O ATOM 2205 CB ILE A 304 2.176 8.884 2.937 1.00 5.82 C ATOM 2206 CG1 ILE A 304 1.989 9.889 4.076 1.00 7.52 C ATOM 2207 CG2 ILE A 304 2.478 7.498 3.498 1.00 7.81 C ATOM 2208 CD1 ILE A 304 0.838 9.533 5.005 1.00 12.60 C ATOM 0 H ILE A 304 2.467 10.769 0.930 1.00 5.89 H new ATOM 0 HA ILE A 304 4.139 9.340 2.494 1.00 5.74 H new ATOM 0 HB ILE A 304 1.351 8.846 2.429 1.00 5.82 H new ATOM 0 HG12 ILE A 304 2.809 9.941 4.592 1.00 7.52 H new ATOM 0 HG13 ILE A 304 1.834 10.770 3.700 1.00 7.52 H new ATOM 0 HG21 ILE A 304 1.760 7.225 4.091 1.00 7.81 H new ATOM 0 HG22 ILE A 304 2.554 6.863 2.769 1.00 7.81 H new ATOM 0 HG23 ILE A 304 3.312 7.523 3.992 1.00 7.81 H new ATOM 0 HD11 ILE A 304 0.767 10.202 5.704 1.00 12.60 H new ATOM 0 HD12 ILE A 304 0.011 9.506 4.500 1.00 12.60 H new ATOM 0 HD13 ILE A 304 1.001 8.664 5.405 1.00 12.60 H new ATOM 2209 N PHE A 305 4.600 7.757 0.708 1.00 5.17 N ATOM 2210 CA PHE A 305 4.819 6.667 -0.229 1.00 4.89 C ATOM 2211 C PHE A 305 4.425 5.369 0.475 1.00 5.05 C ATOM 2212 O PHE A 305 5.249 4.688 1.093 1.00 6.06 O ATOM 2213 CB PHE A 305 6.265 6.652 -0.744 1.00 6.18 C ATOM 2214 CG PHE A 305 6.604 7.848 -1.599 1.00 6.27 C ATOM 2215 CD1 PHE A 305 6.486 7.790 -2.977 1.00 7.86 C ATOM 2216 CD2 PHE A 305 7.031 9.031 -1.019 1.00 8.36 C ATOM 2217 CE1 PHE A 305 6.783 8.899 -3.764 1.00 7.76 C ATOM 2218 CE2 PHE A 305 7.325 10.141 -1.807 1.00 9.92 C ATOM 2219 CZ PHE A 305 7.196 10.065 -3.176 1.00 9.22 C ATOM 0 H PHE A 305 5.301 7.985 1.152 1.00 5.17 H new ATOM 0 HA PHE A 305 4.270 6.780 -1.021 1.00 4.89 H new ATOM 0 HB2 PHE A 305 6.871 6.620 0.013 1.00 6.18 H new ATOM 0 HB3 PHE A 305 6.411 5.842 -1.258 1.00 6.18 H new ATOM 0 HD1 PHE A 305 6.205 7.001 -3.382 1.00 7.86 H new ATOM 0 HD2 PHE A 305 7.122 9.085 -0.095 1.00 8.36 H new ATOM 0 HE1 PHE A 305 6.701 8.848 -4.689 1.00 7.76 H new ATOM 0 HE2 PHE A 305 7.608 10.933 -1.409 1.00 9.92 H new ATOM 0 HZ PHE A 305 7.390 10.807 -3.702 1.00 9.22 H new ATOM 2220 N GLY A 306 3.133 5.062 0.417 1.00 5.29 N ATOM 2221 CA GLY A 306 2.592 3.866 1.035 1.00 6.15 C ATOM 2222 C GLY A 306 2.685 2.648 0.136 1.00 5.24 C ATOM 2223 O GLY A 306 3.425 2.641 -0.850 1.00 5.42 O ATOM 0 H GLY A 306 2.546 5.546 0.016 1.00 5.29 H new ATOM 0 HA2 GLY A 306 3.068 3.690 1.862 1.00 6.15 H new ATOM 0 HA3 GLY A 306 1.663 4.020 1.270 1.00 6.15 H new ATOM 2224 N ASP A 307 1.915 1.618 0.457 1.00 5.44 N ATOM 2225 CA ASP A 307 2.066 0.324 -0.202 1.00 5.80 C ATOM 2226 C ASP A 307 1.888 0.398 -1.718 1.00 4.94 C ATOM 2227 O ASP A 307 2.567 -0.318 -2.456 1.00 5.57 O ATOM 2228 CB ASP A 307 1.084 -0.703 0.386 1.00 5.28 C ATOM 2229 CG ASP A 307 1.316 -0.976 1.867 1.00 7.16 C ATOM 2230 OD1 ASP A 307 2.462 -0.806 2.345 1.00 6.85 O ATOM 2231 OD2 ASP A 307 0.346 -1.371 2.545 1.00 8.54 O ATOM 0 H ASP A 307 1.297 1.645 1.055 1.00 5.44 H new ATOM 0 HA ASP A 307 2.978 0.040 -0.034 1.00 5.80 H new ATOM 0 HB2 ASP A 307 0.177 -0.383 0.260 1.00 5.28 H new ATOM 0 HB3 ASP A 307 1.162 -1.535 -0.106 1.00 5.28 H new ATOM 2232 N VAL A 308 0.980 1.251 -2.187 1.00 5.32 N ATOM 2233 CA VAL A 308 0.761 1.400 -3.631 1.00 6.68 C ATOM 2234 C VAL A 308 2.071 1.679 -4.371 1.00 6.20 C ATOM 2235 O VAL A 308 2.324 1.113 -5.441 1.00 6.40 O ATOM 2236 CB VAL A 308 -0.283 2.495 -3.939 1.00 5.62 C ATOM 2237 CG1 VAL A 308 -0.199 2.945 -5.402 1.00 7.88 C ATOM 2238 CG2 VAL A 308 -1.675 1.988 -3.606 1.00 7.00 C ATOM 0 H VAL A 308 0.483 1.750 -1.694 1.00 5.32 H new ATOM 0 HA VAL A 308 0.409 0.555 -3.952 1.00 6.68 H new ATOM 0 HB VAL A 308 -0.091 3.269 -3.386 1.00 5.62 H new ATOM 0 HG11 VAL A 308 -0.864 3.631 -5.568 1.00 7.88 H new ATOM 0 HG12 VAL A 308 0.685 3.302 -5.581 1.00 7.88 H new ATOM 0 HG13 VAL A 308 -0.365 2.187 -5.984 1.00 7.88 H new ATOM 0 HG21 VAL A 308 -2.327 2.679 -3.801 1.00 7.00 H new ATOM 0 HG22 VAL A 308 -1.869 1.201 -4.139 1.00 7.00 H new ATOM 0 HG23 VAL A 308 -1.720 1.759 -2.664 1.00 7.00 H new ATOM 2239 N ALA A 309 2.889 2.560 -3.811 1.00 5.51 N ATOM 2240 CA ALA A 309 4.194 2.874 -4.384 1.00 4.69 C ATOM 2241 C ALA A 309 5.233 1.804 -4.056 1.00 5.72 C ATOM 2242 O ALA A 309 5.966 1.346 -4.936 1.00 5.88 O ATOM 2243 CB ALA A 309 4.680 4.220 -3.883 1.00 7.21 C ATOM 0 H ALA A 309 2.706 2.992 -3.091 1.00 5.51 H new ATOM 0 HA ALA A 309 4.084 2.903 -5.347 1.00 4.69 H new ATOM 0 HB1 ALA A 309 5.547 4.416 -4.271 1.00 7.21 H new ATOM 0 HB2 ALA A 309 4.048 4.909 -4.141 1.00 7.21 H new ATOM 0 HB3 ALA A 309 4.757 4.197 -2.916 1.00 7.21 H new ATOM 2244 N LEU A 310 5.317 1.423 -2.784 1.00 4.56 N ATOM 2245 CA LEU A 310 6.387 0.537 -2.359 1.00 5.36 C ATOM 2246 C LEU A 310 6.290 -0.843 -3.017 1.00 5.59 C ATOM 2247 O LEU A 310 7.317 -1.458 -3.315 1.00 5.66 O ATOM 2248 CB LEU A 310 6.433 0.431 -0.831 1.00 6.50 C ATOM 2249 CG LEU A 310 6.637 1.746 -0.073 1.00 5.63 C ATOM 2250 CD1 LEU A 310 6.685 1.486 1.420 1.00 8.11 C ATOM 2251 CD2 LEU A 310 7.872 2.513 -0.527 1.00 7.79 C ATOM 0 H LEU A 310 4.773 1.663 -2.163 1.00 4.56 H new ATOM 0 HA LEU A 310 7.223 0.928 -2.658 1.00 5.36 H new ATOM 0 HB2 LEU A 310 5.604 0.028 -0.527 1.00 6.50 H new ATOM 0 HB3 LEU A 310 7.149 -0.176 -0.588 1.00 6.50 H new ATOM 0 HG LEU A 310 5.876 2.311 -0.279 1.00 5.63 H new ATOM 0 HD11 LEU A 310 6.814 2.324 1.891 1.00 8.11 H new ATOM 0 HD12 LEU A 310 5.851 1.081 1.705 1.00 8.11 H new ATOM 0 HD13 LEU A 310 7.420 0.886 1.621 1.00 8.11 H new ATOM 0 HD21 LEU A 310 7.950 3.333 -0.015 1.00 7.79 H new ATOM 0 HD22 LEU A 310 8.662 1.968 -0.386 1.00 7.79 H new ATOM 0 HD23 LEU A 310 7.792 2.727 -1.470 1.00 7.79 H new ATOM 2252 N LYS A 311 5.079 -1.324 -3.274 1.00 5.14 N ATOM 2253 CA LYS A 311 4.930 -2.664 -3.837 1.00 4.61 C ATOM 2254 C LYS A 311 5.386 -2.743 -5.288 1.00 6.46 C ATOM 2255 O LYS A 311 5.580 -3.841 -5.817 1.00 6.18 O ATOM 2256 CB LYS A 311 3.506 -3.213 -3.670 1.00 6.12 C ATOM 2257 CG LYS A 311 2.435 -2.638 -4.600 1.00 7.19 C ATOM 2258 CD LYS A 311 1.101 -3.273 -4.187 1.00 11.81 C ATOM 2259 CE LYS A 311 -0.131 -2.583 -4.681 1.00 18.84 C ATOM 2260 NZ LYS A 311 -1.243 -3.088 -3.804 1.00 10.77 N ATOM 0 H LYS A 311 4.343 -0.902 -3.134 1.00 5.14 H new ATOM 0 HA LYS A 311 5.521 -3.235 -3.322 1.00 4.61 H new ATOM 0 HB2 LYS A 311 3.535 -4.174 -3.799 1.00 6.12 H new ATOM 0 HB3 LYS A 311 3.227 -3.058 -2.754 1.00 6.12 H new ATOM 0 HG2 LYS A 311 2.395 -1.672 -4.522 1.00 7.19 H new ATOM 0 HG3 LYS A 311 2.640 -2.840 -5.526 1.00 7.19 H new ATOM 0 HD2 LYS A 311 1.087 -4.190 -4.504 1.00 11.81 H new ATOM 0 HD3 LYS A 311 1.065 -3.308 -3.218 1.00 11.81 H new ATOM 0 HE2 LYS A 311 -0.043 -1.619 -4.616 1.00 18.84 H new ATOM 0 HE3 LYS A 311 -0.299 -2.790 -5.614 1.00 18.84 H new ATOM 0 HZ1 LYS A 311 -2.027 -2.877 -4.168 1.00 10.77 H new ATOM 0 HZ2 LYS A 311 -1.181 -3.972 -3.725 1.00 10.77 H new ATOM 0 HZ3 LYS A 311 -1.180 -2.714 -2.999 1.00 10.77 H new ATOM 2261 N ALA A 312 5.577 -1.589 -5.931 1.00 4.78 N ATOM 2262 CA ALA A 312 6.143 -1.565 -7.280 1.00 5.13 C ATOM 2263 C ALA A 312 7.674 -1.676 -7.281 1.00 6.00 C ATOM 2264 O ALA A 312 8.285 -1.734 -8.345 1.00 7.88 O ATOM 2265 CB ALA A 312 5.701 -0.308 -8.007 1.00 6.42 C ATOM 0 H ALA A 312 5.387 -0.816 -5.606 1.00 4.78 H new ATOM 0 HA ALA A 312 5.806 -2.346 -7.747 1.00 5.13 H new ATOM 0 HB1 ALA A 312 6.080 -0.300 -8.900 1.00 6.42 H new ATOM 0 HB2 ALA A 312 4.733 -0.292 -8.067 1.00 6.42 H new ATOM 0 HB3 ALA A 312 6.007 0.473 -7.519 1.00 6.42 H new ATOM 2266 N ALA A 313 8.287 -1.726 -6.099 1.00 5.52 N ATOM 2267 CA ALA A 313 9.750 -1.710 -5.982 1.00 5.40 C ATOM 2268 C ALA A 313 10.250 -2.750 -4.996 1.00 5.72 C ATOM 2269 O ALA A 313 9.501 -3.283 -4.172 1.00 6.14 O ATOM 2270 CB ALA A 313 10.232 -0.337 -5.535 1.00 7.26 C ATOM 0 H ALA A 313 7.873 -1.770 -5.347 1.00 5.52 H new ATOM 0 HA ALA A 313 10.106 -1.919 -6.860 1.00 5.40 H new ATOM 0 HB1 ALA A 313 11.199 -0.341 -5.462 1.00 7.26 H new ATOM 0 HB2 ALA A 313 9.960 0.329 -6.186 1.00 7.26 H new ATOM 0 HB3 ALA A 313 9.844 -0.123 -4.672 1.00 7.26 H new ATOM 2271 N PHE A 314 11.544 -3.023 -5.096 1.00 4.96 N ATOM 2272 CA PHE A 314 12.296 -3.681 -4.043 1.00 4.98 C ATOM 2273 C PHE A 314 12.941 -2.542 -3.259 1.00 5.43 C ATOM 2274 O PHE A 314 13.665 -1.718 -3.843 1.00 6.28 O ATOM 2275 CB PHE A 314 13.352 -4.587 -4.678 1.00 6.04 C ATOM 2276 CG PHE A 314 14.259 -5.268 -3.694 1.00 6.08 C ATOM 2277 CD1 PHE A 314 13.913 -6.498 -3.148 1.00 7.03 C ATOM 2278 CD2 PHE A 314 15.460 -4.685 -3.316 1.00 5.80 C ATOM 2279 CE1 PHE A 314 14.752 -7.136 -2.239 1.00 7.28 C ATOM 2280 CE2 PHE A 314 16.309 -5.328 -2.419 1.00 6.95 C ATOM 2281 CZ PHE A 314 15.944 -6.550 -1.881 1.00 5.87 C ATOM 0 H PHE A 314 12.015 -2.828 -5.788 1.00 4.96 H new ATOM 0 HA PHE A 314 11.750 -4.239 -3.468 1.00 4.98 H new ATOM 0 HB2 PHE A 314 12.904 -5.263 -5.210 1.00 6.04 H new ATOM 0 HB3 PHE A 314 13.892 -4.059 -5.287 1.00 6.04 H new ATOM 0 HD1 PHE A 314 13.111 -6.900 -3.393 1.00 7.03 H new ATOM 0 HD2 PHE A 314 15.700 -3.857 -3.665 1.00 5.80 H new ATOM 0 HE1 PHE A 314 14.507 -7.956 -1.875 1.00 7.28 H new ATOM 0 HE2 PHE A 314 17.119 -4.937 -2.182 1.00 6.95 H new ATOM 0 HZ PHE A 314 16.507 -6.976 -1.275 1.00 5.87 H new ATOM 2282 N VAL A 315 12.667 -2.462 -1.960 1.00 5.17 N ATOM 2283 CA VAL A 315 13.033 -1.287 -1.178 1.00 5.68 C ATOM 2284 C VAL A 315 13.991 -1.674 -0.054 1.00 4.95 C ATOM 2285 O VAL A 315 13.697 -2.565 0.754 1.00 6.03 O ATOM 2286 CB VAL A 315 11.784 -0.587 -0.595 1.00 5.45 C ATOM 2287 CG1 VAL A 315 12.174 0.720 0.088 1.00 6.40 C ATOM 2288 CG2 VAL A 315 10.746 -0.345 -1.690 1.00 7.39 C ATOM 0 H VAL A 315 12.269 -3.079 -1.512 1.00 5.17 H new ATOM 0 HA VAL A 315 13.477 -0.662 -1.772 1.00 5.68 H new ATOM 0 HB VAL A 315 11.387 -1.168 0.072 1.00 5.45 H new ATOM 0 HG11 VAL A 315 11.381 1.146 0.448 1.00 6.40 H new ATOM 0 HG12 VAL A 315 12.797 0.536 0.809 1.00 6.40 H new ATOM 0 HG13 VAL A 315 12.593 1.310 -0.558 1.00 6.40 H new ATOM 0 HG21 VAL A 315 9.970 0.094 -1.309 1.00 7.39 H new ATOM 0 HG22 VAL A 315 11.129 0.218 -2.380 1.00 7.39 H new ATOM 0 HG23 VAL A 315 10.479 -1.194 -2.077 1.00 7.39 H new ATOM 2289 N VAL A 316 15.147 -1.017 -0.027 1.00 5.70 N ATOM 2290 CA VAL A 316 16.157 -1.229 1.007 1.00 6.15 C ATOM 2291 C VAL A 316 16.091 -0.125 2.047 1.00 4.78 C ATOM 2292 O VAL A 316 16.235 1.065 1.724 1.00 5.93 O ATOM 2293 CB VAL A 316 17.580 -1.245 0.414 1.00 6.48 C ATOM 2294 CG1 VAL A 316 18.608 -1.489 1.518 1.00 7.63 C ATOM 2295 CG2 VAL A 316 17.693 -2.308 -0.663 1.00 6.79 C ATOM 0 H VAL A 316 15.370 -0.430 -0.614 1.00 5.70 H new ATOM 0 HA VAL A 316 15.969 -2.089 1.414 1.00 6.15 H new ATOM 0 HB VAL A 316 17.759 -0.381 0.010 1.00 6.48 H new ATOM 0 HG11 VAL A 316 19.499 -1.497 1.135 1.00 7.63 H new ATOM 0 HG12 VAL A 316 18.547 -0.782 2.179 1.00 7.63 H new ATOM 0 HG13 VAL A 316 18.431 -2.343 1.942 1.00 7.63 H new ATOM 0 HG21 VAL A 316 18.592 -2.306 -1.026 1.00 6.79 H new ATOM 0 HG22 VAL A 316 17.501 -3.178 -0.280 1.00 6.79 H new ATOM 0 HG23 VAL A 316 17.058 -2.120 -1.372 1.00 6.79 H new ATOM 2296 N PHE A 317 15.860 -0.523 3.293 1.00 5.52 N ATOM 2297 CA PHE A 317 15.901 0.374 4.429 1.00 5.80 C ATOM 2298 C PHE A 317 17.277 0.183 5.060 1.00 6.49 C ATOM 2299 O PHE A 317 17.537 -0.793 5.769 1.00 6.88 O ATOM 2300 CB PHE A 317 14.746 0.082 5.401 1.00 6.14 C ATOM 2301 CG PHE A 317 13.387 0.374 4.817 1.00 5.53 C ATOM 2302 CD1 PHE A 317 12.781 -0.523 3.954 1.00 5.62 C ATOM 2303 CD2 PHE A 317 12.722 1.553 5.126 1.00 5.51 C ATOM 2304 CE1 PHE A 317 11.542 -0.241 3.404 1.00 6.97 C ATOM 2305 CE2 PHE A 317 11.480 1.830 4.593 1.00 6.09 C ATOM 2306 CZ PHE A 317 10.892 0.936 3.732 1.00 6.24 C ATOM 0 H PHE A 317 15.672 -1.336 3.501 1.00 5.52 H new ATOM 0 HA PHE A 317 15.780 1.301 4.170 1.00 5.80 H new ATOM 0 HB2 PHE A 317 14.783 -0.850 5.667 1.00 6.14 H new ATOM 0 HB3 PHE A 317 14.866 0.611 6.205 1.00 6.14 H new ATOM 0 HD1 PHE A 317 13.209 -1.321 3.742 1.00 5.62 H new ATOM 0 HD2 PHE A 317 13.120 2.166 5.701 1.00 5.51 H new ATOM 0 HE1 PHE A 317 11.147 -0.842 2.815 1.00 6.97 H new ATOM 0 HE2 PHE A 317 11.042 2.620 4.816 1.00 6.09 H new ATOM 0 HZ PHE A 317 10.056 1.122 3.369 1.00 6.24 H new ATOM 2307 N ASN A 318 18.180 1.097 4.728 1.00 7.37 N ATOM 2308 CA ASN A 318 19.575 0.990 5.138 1.00 7.48 C ATOM 2309 C ASN A 318 19.798 1.700 6.461 1.00 6.62 C ATOM 2310 O ASN A 318 19.755 2.937 6.522 1.00 7.97 O ATOM 2311 CB ASN A 318 20.494 1.572 4.065 1.00 8.22 C ATOM 2312 CG ASN A 318 21.936 1.631 4.517 1.00 10.48 C ATOM 2313 OD1 ASN A 318 22.357 0.854 5.373 1.00 11.36 O ATOM 2314 ND2 ASN A 318 22.699 2.570 3.961 1.00 13.11 N ATOM 0 H ASN A 318 18.002 1.796 4.259 1.00 7.37 H new ATOM 0 HA ASN A 318 19.787 0.050 5.252 1.00 7.48 H new ATOM 0 HB2 ASN A 318 20.431 1.033 3.261 1.00 8.22 H new ATOM 0 HB3 ASN A 318 20.193 2.464 3.833 1.00 8.22 H new ATOM 0 HD21 ASN A 318 23.522 2.651 4.198 1.00 13.11 H new ATOM 0 HD22 ASN A 318 22.369 3.095 3.365 1.00 13.11 H new ATOM 2315 N GLY A 319 20.015 0.925 7.520 1.00 8.53 N ATOM 2316 CA GLY A 319 20.215 1.460 8.857 1.00 11.36 C ATOM 2317 C GLY A 319 21.665 1.631 9.266 1.00 12.64 C ATOM 2318 O GLY A 319 21.998 1.520 10.446 1.00 16.04 O ATOM 0 H GLY A 319 20.050 0.067 7.479 1.00 8.53 H new ATOM 0 HA2 GLY A 319 19.772 2.321 8.916 1.00 11.36 H new ATOM 0 HA3 GLY A 319 19.780 0.873 9.495 1.00 11.36 H new ATOM 2319 N ALA A 320 22.525 1.904 8.298 1.00 11.34 N ATOM 2320 CA ALA A 320 23.911 2.250 8.589 1.00 13.23 C ATOM 2321 C ALA A 320 23.970 3.544 9.401 1.00 15.48 C ATOM 2322 O ALA A 320 22.947 4.196 9.633 1.00 14.12 O ATOM 2323 CB ALA A 320 24.685 2.395 7.304 1.00 17.05 C ATOM 0 H ALA A 320 22.327 1.895 7.461 1.00 11.34 H new ATOM 0 HA ALA A 320 24.312 1.540 9.114 1.00 13.23 H new ATOM 0 HB1 ALA A 320 25.606 2.625 7.505 1.00 17.05 H new ATOM 0 HB2 ALA A 320 24.661 1.558 6.815 1.00 17.05 H new ATOM 0 HB3 ALA A 320 24.287 3.096 6.764 1.00 17.05 H new ATOM 2324 N THR A 321 25.179 3.907 9.829 1.00 19.42 N ATOM 2325 CA THR A 321 25.388 5.079 10.675 1.00 18.85 C ATOM 2326 C THR A 321 24.650 6.295 10.122 1.00 13.75 C ATOM 2327 O THR A 321 23.998 7.030 10.865 1.00 15.74 O ATOM 2328 CB THR A 321 26.883 5.405 10.822 1.00 21.63 C ATOM 2329 OG1 THR A 321 27.579 4.248 11.307 1.00 31.14 O ATOM 2330 CG2 THR A 321 27.079 6.555 11.798 1.00 24.03 C ATOM 0 H THR A 321 25.900 3.480 9.636 1.00 19.42 H new ATOM 0 HA THR A 321 25.030 4.865 11.551 1.00 18.85 H new ATOM 0 HB THR A 321 27.235 5.662 9.955 1.00 21.63 H new ATOM 0 HG1 THR A 321 28.396 4.425 11.386 1.00 31.14 H new ATOM 0 HG21 THR A 321 28.025 6.751 11.882 1.00 24.03 H new ATOM 0 HG22 THR A 321 26.615 7.341 11.470 1.00 24.03 H new ATOM 0 HG23 THR A 321 26.722 6.308 12.665 1.00 24.03 H new ATOM 2331 N THR A 322 24.768 6.497 8.815 1.00 14.36 N ATOM 2332 CA THR A 322 23.921 7.450 8.108 1.00 12.37 C ATOM 2333 C THR A 322 22.901 6.659 7.288 1.00 10.00 C ATOM 2334 O THR A 322 23.244 6.081 6.259 1.00 10.81 O ATOM 2335 CB THR A 322 24.730 8.360 7.180 1.00 13.73 C ATOM 2336 OG1 THR A 322 25.705 9.080 7.949 1.00 16.79 O ATOM 2337 CG2 THR A 322 23.822 9.358 6.497 1.00 13.82 C ATOM 0 H THR A 322 25.337 6.089 8.316 1.00 14.36 H new ATOM 0 HA THR A 322 23.483 8.021 8.759 1.00 12.37 H new ATOM 0 HB THR A 322 25.166 7.810 6.511 1.00 13.73 H new ATOM 0 HG1 THR A 322 26.449 8.695 7.890 1.00 16.79 H new ATOM 0 HG21 THR A 322 24.347 9.927 5.913 1.00 13.82 H new ATOM 0 HG22 THR A 322 23.156 8.885 5.973 1.00 13.82 H new ATOM 0 HG23 THR A 322 23.379 9.903 7.166 1.00 13.82 H new ATOM 2338 N PRO A 323 21.643 6.618 7.754 1.00 9.16 N ATOM 2339 CA PRO A 323 20.652 5.823 7.022 1.00 8.73 C ATOM 2340 C PRO A 323 20.378 6.360 5.626 1.00 9.28 C ATOM 2341 O PRO A 323 20.445 7.569 5.392 1.00 8.53 O ATOM 2342 CB PRO A 323 19.407 5.941 7.900 1.00 10.26 C ATOM 2343 CG PRO A 323 19.956 6.141 9.291 1.00 12.72 C ATOM 2344 CD PRO A 323 21.138 7.052 9.068 1.00 10.40 C ATOM 0 HA PRO A 323 20.951 4.912 6.876 1.00 8.73 H new ATOM 0 HB2 PRO A 323 18.850 6.687 7.628 1.00 10.26 H new ATOM 0 HB3 PRO A 323 18.858 5.143 7.846 1.00 10.26 H new ATOM 0 HG2 PRO A 323 19.300 6.544 9.881 1.00 12.72 H new ATOM 0 HG3 PRO A 323 20.223 5.301 9.695 1.00 12.72 H new ATOM 0 HD2 PRO A 323 20.876 7.986 9.062 1.00 10.40 H new ATOM 0 HD3 PRO A 323 21.807 6.949 9.762 1.00 10.40 H new ATOM 2345 N THR A 324 20.073 5.451 4.705 1.00 7.01 N ATOM 2346 CA THR A 324 19.604 5.809 3.375 1.00 7.91 C ATOM 2347 C THR A 324 18.501 4.843 2.965 1.00 6.82 C ATOM 2348 O THR A 324 18.232 3.865 3.670 1.00 7.35 O ATOM 2349 CB THR A 324 20.721 5.739 2.327 1.00 7.05 C ATOM 2350 OG1 THR A 324 21.184 4.386 2.215 1.00 9.01 O ATOM 2351 CG2 THR A 324 21.877 6.660 2.708 1.00 11.10 C ATOM 0 H THR A 324 20.134 4.603 4.837 1.00 7.01 H new ATOM 0 HA THR A 324 19.282 6.723 3.413 1.00 7.91 H new ATOM 0 HB THR A 324 20.369 6.033 1.472 1.00 7.05 H new ATOM 0 HG1 THR A 324 21.795 4.345 1.640 1.00 9.01 H new ATOM 0 HG21 THR A 324 22.573 6.602 2.034 1.00 11.10 H new ATOM 0 HG22 THR A 324 21.558 7.574 2.765 1.00 11.10 H new ATOM 0 HG23 THR A 324 22.237 6.390 3.567 1.00 11.10 H new ATOM 2352 N LEU A 325 17.865 5.131 1.835 1.00 6.39 N ATOM 2353 CA LEU A 325 16.830 4.277 1.266 1.00 6.41 C ATOM 2354 C LEU A 325 17.235 3.885 -0.137 1.00 6.63 C ATOM 2355 O LEU A 325 17.724 4.716 -0.901 1.00 9.26 O ATOM 2356 CB LEU A 325 15.520 5.053 1.158 1.00 10.12 C ATOM 2357 CG LEU A 325 14.497 5.036 2.286 1.00 10.99 C ATOM 2358 CD1 LEU A 325 13.375 6.007 1.946 1.00 13.54 C ATOM 2359 CD2 LEU A 325 13.924 3.636 2.454 1.00 11.19 C ATOM 0 H LEU A 325 18.025 5.837 1.371 1.00 6.39 H new ATOM 0 HA LEU A 325 16.718 3.498 1.833 1.00 6.41 H new ATOM 0 HB2 LEU A 325 15.753 5.981 1.001 1.00 10.12 H new ATOM 0 HB3 LEU A 325 15.068 4.735 0.361 1.00 10.12 H new ATOM 0 HG LEU A 325 14.926 5.299 3.115 1.00 10.99 H new ATOM 0 HD11 LEU A 325 12.717 6.004 2.659 1.00 13.54 H new ATOM 0 HD12 LEU A 325 13.739 6.901 1.846 1.00 13.54 H new ATOM 0 HD13 LEU A 325 12.953 5.736 1.116 1.00 13.54 H new ATOM 0 HD21 LEU A 325 13.274 3.636 3.174 1.00 11.19 H new ATOM 0 HD22 LEU A 325 13.492 3.362 1.630 1.00 11.19 H new ATOM 0 HD23 LEU A 325 14.640 3.016 2.665 1.00 11.19 H new ATOM 2360 N GLY A 326 17.022 2.630 -0.502 1.00 6.14 N ATOM 2361 CA GLY A 326 17.306 2.173 -1.850 1.00 6.97 C ATOM 2362 C GLY A 326 16.052 1.662 -2.540 1.00 6.27 C ATOM 2363 O GLY A 326 15.199 1.035 -1.902 1.00 6.57 O ATOM 0 H GLY A 326 16.711 2.023 0.022 1.00 6.14 H new ATOM 0 HA2 GLY A 326 17.687 2.901 -2.366 1.00 6.97 H new ATOM 0 HA3 GLY A 326 17.971 1.467 -1.820 1.00 6.97 H new ATOM 2364 N PHE A 327 15.931 1.927 -3.837 1.00 5.20 N ATOM 2365 CA PHE A 327 14.812 1.428 -4.636 1.00 5.61 C ATOM 2366 C PHE A 327 15.330 0.760 -5.893 1.00 5.26 C ATOM 2367 O PHE A 327 16.205 1.317 -6.582 1.00 6.84 O ATOM 2368 CB PHE A 327 13.883 2.567 -5.087 1.00 6.94 C ATOM 2369 CG PHE A 327 13.108 3.219 -3.983 1.00 6.01 C ATOM 2370 CD1 PHE A 327 13.685 4.194 -3.194 1.00 8.12 C ATOM 2371 CD2 PHE A 327 11.770 2.905 -3.782 1.00 7.22 C ATOM 2372 CE1 PHE A 327 12.958 4.819 -2.188 1.00 9.23 C ATOM 2373 CE2 PHE A 327 11.038 3.525 -2.783 1.00 9.32 C ATOM 2374 CZ PHE A 327 11.634 4.485 -1.989 1.00 9.47 C ATOM 0 H PHE A 327 16.495 2.401 -4.280 1.00 5.20 H new ATOM 0 HA PHE A 327 14.323 0.805 -4.075 1.00 5.61 H new ATOM 0 HB2 PHE A 327 14.415 3.243 -5.535 1.00 6.94 H new ATOM 0 HB3 PHE A 327 13.258 2.218 -5.742 1.00 6.94 H new ATOM 0 HD1 PHE A 327 14.572 4.436 -3.338 1.00 8.12 H new ATOM 0 HD2 PHE A 327 11.361 2.271 -4.325 1.00 7.22 H new ATOM 0 HE1 PHE A 327 13.363 5.461 -1.650 1.00 9.23 H new ATOM 0 HE2 PHE A 327 10.147 3.295 -2.647 1.00 9.32 H new ATOM 0 HZ PHE A 327 11.143 4.906 -1.321 1.00 9.47 H new ATOM 2375 N ALA A 328 14.789 -0.414 -6.206 1.00 5.07 N ATOM 2376 CA ALA A 328 15.032 -1.075 -7.485 1.00 6.08 C ATOM 2377 C ALA A 328 13.701 -1.481 -8.090 1.00 6.65 C ATOM 2378 O ALA A 328 12.734 -1.754 -7.362 1.00 6.56 O ATOM 2379 CB ALA A 328 15.921 -2.305 -7.294 1.00 7.38 C ATOM 0 H ALA A 328 14.268 -0.852 -5.680 1.00 5.07 H new ATOM 0 HA ALA A 328 15.490 -0.462 -8.081 1.00 6.08 H new ATOM 0 HB1 ALA A 328 16.072 -2.732 -8.152 1.00 7.38 H new ATOM 0 HB2 ALA A 328 16.771 -2.034 -6.914 1.00 7.38 H new ATOM 0 HB3 ALA A 328 15.484 -2.930 -6.695 1.00 7.38 H new ATOM 2380 N SER A 329 13.647 -1.529 -9.416 1.00 6.26 N ATOM 2381 CA SER A 329 12.523 -2.159 -10.100 1.00 7.33 C ATOM 2382 C SER A 329 12.591 -3.671 -9.886 1.00 7.18 C ATOM 2383 O SER A 329 13.631 -4.207 -9.485 1.00 8.19 O ATOM 2384 CB SER A 329 12.525 -1.831 -11.594 1.00 7.67 C ATOM 2385 OG SER A 329 12.400 -0.435 -11.805 1.00 9.86 O ATOM 0 H SER A 329 14.249 -1.204 -9.937 1.00 6.26 H new ATOM 0 HA SER A 329 11.697 -1.812 -9.728 1.00 7.33 H new ATOM 0 HB2 SER A 329 13.347 -2.151 -11.998 1.00 7.67 H new ATOM 0 HB3 SER A 329 11.794 -2.295 -12.032 1.00 7.67 H new ATOM 0 HG SER A 329 13.120 -0.055 -11.598 1.00 9.86 H new ATOM 2386 N LYS A 330 11.493 -4.373 -10.160 1.00 8.01 N ATOM 2387 CA LYS A 330 11.461 -5.815 -9.920 1.00 8.95 C ATOM 2388 C LYS A 330 10.499 -6.527 -10.853 1.00 11.61 C ATOM 2389 O LYS A 330 9.917 -5.909 -11.737 1.00 13.47 O ATOM 2390 CB LYS A 330 11.118 -6.130 -8.455 1.00 7.87 C ATOM 2391 CG LYS A 330 9.706 -5.748 -8.030 1.00 7.80 C ATOM 2392 CD LYS A 330 9.509 -5.920 -6.534 1.00 7.49 C ATOM 2393 CE LYS A 330 8.068 -5.647 -6.152 1.00 5.84 C ATOM 2394 NZ LYS A 330 7.912 -5.557 -4.673 1.00 7.14 N ATOM 2395 OXT LYS A 330 10.308 -7.740 -10.727 1.00 14.76 O ATOM 0 H LYS A 330 10.767 -4.041 -10.480 1.00 8.01 H new ATOM 0 HA LYS A 330 12.353 -6.148 -10.106 1.00 8.95 H new ATOM 0 HB2 LYS A 330 11.241 -7.080 -8.305 1.00 7.87 H new ATOM 0 HB3 LYS A 330 11.750 -5.668 -7.882 1.00 7.87 H new ATOM 0 HG2 LYS A 330 9.531 -4.826 -8.277 1.00 7.80 H new ATOM 0 HG3 LYS A 330 9.064 -6.296 -8.507 1.00 7.80 H new ATOM 0 HD2 LYS A 330 9.753 -6.821 -6.272 1.00 7.49 H new ATOM 0 HD3 LYS A 330 10.096 -5.316 -6.054 1.00 7.49 H new ATOM 0 HE2 LYS A 330 7.773 -4.819 -6.562 1.00 5.84 H new ATOM 0 HE3 LYS A 330 7.500 -6.353 -6.498 1.00 5.84 H new ATOM 0 HZ1 LYS A 330 7.048 -5.601 -4.462 1.00 7.14 H new ATOM 0 HZ2 LYS A 330 8.346 -6.232 -4.287 1.00 7.14 H new ATOM 0 HZ3 LYS A 330 8.249 -4.785 -4.385 1.00 7.14 H new TER 2396 LYS A 330 HETATM 2397 C1 7SP A1001 -2.702 2.088 11.989 1.00 21.46 C HETATM 2398 C2 7SP A1001 -1.690 1.180 12.234 1.00 22.84 C HETATM 2399 C3 7SP A1001 -0.488 1.275 11.528 1.00 26.33 C HETATM 2400 C4 7SP A1001 -0.313 2.282 10.582 1.00 19.43 C HETATM 2401 C5 7SP A1001 -1.326 3.189 10.324 1.00 19.95 C HETATM 2402 C6 7SP A1001 -2.528 3.093 11.042 1.00 21.72 C HETATM 2403 C7 7SP A1001 -1.126 4.282 9.305 1.00 20.10 C HETATM 2404 C8 7SP A1001 -0.967 5.564 10.062 1.00 18.33 C HETATM 2405 O9 7SP A1001 -1.921 6.322 10.210 1.00 22.57 O HETATM 2406 N10 7SP A1001 0.310 5.888 10.644 1.00 20.49 N HETATM 2407 N11 7SP A1001 0.457 7.042 11.346 1.00 18.53 N HETATM 2408 C12 7SP A1001 1.731 7.056 12.030 1.00 21.39 C HETATM 2409 C13 7SP A1001 2.080 8.274 12.832 1.00 23.49 C HETATM 2410 C14 7SP A1001 1.624 9.517 12.435 1.00 26.44 C HETATM 2411 C15 7SP A1001 1.937 10.659 13.163 1.00 27.27 C HETATM 2412 C16 7SP A1001 2.717 10.553 14.307 1.00 29.31 C HETATM 2413 C17 7SP A1001 3.175 9.311 14.713 1.00 28.75 C HETATM 2414 C18 7SP A1001 2.863 8.160 13.982 1.00 22.50 C HETATM 2415 C19 7SP A1001 3.344 6.939 14.429 1.00 20.63 C HETATM 2416 C20 7SP A1001 4.125 6.852 15.579 1.00 24.27 C HETATM 2417 C21 7SP A1001 4.428 7.996 16.294 1.00 26.78 C HETATM 2418 C22 7SP A1001 3.956 9.218 15.864 1.00 31.44 C HETATM 2419 O23 7SP A1001 3.031 11.675 15.033 1.00 41.51 O HETATM 2420 N24 7SP A1001 -2.264 4.390 8.421 1.00 28.15 N HETATM 0 HO23 7SP A1001 2.733 11.596 15.814 1.00 41.51 H new HETATM 0 HN2A 7SP A1001 -2.268 4.980 7.795 1.00 28.15 H new HETATM 0 HN24 7SP A1001 -2.937 3.864 8.521 1.00 28.15 H new HETATM 0 HN10 7SP A1001 0.977 5.353 10.548 1.00 20.49 H new HETATM 0 H7 7SP A1001 -0.348 4.085 8.760 1.00 20.10 H new HETATM 0 H6 7SP A1001 -3.241 3.730 10.878 1.00 21.72 H new HETATM 0 H4 7SP A1001 0.526 2.348 10.100 1.00 19.43 H new HETATM 0 H3 7SP A1001 0.225 0.639 11.697 1.00 26.33 H new HETATM 0 H22 7SP A1001 4.169 10.020 16.367 1.00 31.44 H new HETATM 0 H21 7SP A1001 4.971 7.939 17.096 1.00 26.78 H new HETATM 0 H20 7SP A1001 4.456 5.990 15.878 1.00 24.27 H new HETATM 0 H2 7SP A1001 -1.813 0.479 12.893 1.00 22.84 H new HETATM 0 H19 7SP A1001 3.133 6.132 13.933 1.00 20.63 H new HETATM 0 H15 7SP A1001 1.612 11.526 12.873 1.00 27.27 H new HETATM 0 H14 7SP A1001 1.078 9.593 11.637 1.00 26.44 H new HETATM 0 H12 7SP A1001 2.339 6.303 11.972 1.00 21.39 H new HETATM 0 H1 7SP A1001 -3.537 2.025 12.479 1.00 21.46 H new HETATM 2421 C8 7SP A2001 -5.492 10.991 7.668 1.00 32.78 C HETATM 2422 N10 7SP A2001 -4.133 11.339 8.022 1.00 34.98 N HETATM 2423 N11 7SP A2001 -3.164 10.376 8.030 1.00 33.55 N HETATM 2424 C12 7SP A2001 -1.926 10.936 8.535 1.00 23.59 C HETATM 2425 C13 7SP A2001 -0.676 10.101 8.520 1.00 23.90 C HETATM 2426 C14 7SP A2001 -0.709 8.782 8.110 1.00 26.33 C HETATM 2427 C15 7SP A2001 0.450 8.010 8.103 1.00 24.99 C HETATM 2428 C16 7SP A2001 1.656 8.567 8.511 1.00 22.54 C HETATM 2429 C17 7SP A2001 1.694 9.886 8.926 1.00 26.33 C HETATM 2430 C18 7SP A2001 0.531 10.665 8.933 1.00 25.42 C HETATM 2431 C19 7SP A2001 0.612 11.982 9.356 1.00 30.75 C HETATM 2432 C20 7SP A2001 1.829 12.529 9.763 1.00 27.22 C HETATM 2433 C21 7SP A2001 2.973 11.750 9.751 1.00 33.44 C HETATM 2434 C22 7SP A2001 2.907 10.436 9.335 1.00 29.37 C HETATM 2435 O23 7SP A2001 2.802 7.811 8.505 1.00 29.92 O HETATM 0 HO23 7SP A2001 2.709 7.164 7.977 1.00 29.92 H new HETATM 0 HN10 7SP A2001 -3.936 12.151 8.227 1.00 34.98 H new HETATM 0 H22 7SP A2001 3.710 9.892 9.327 1.00 29.37 H new HETATM 0 H21 7SP A2001 3.820 12.127 10.035 1.00 33.44 H new HETATM 0 H20 7SP A2001 1.873 13.453 10.054 1.00 27.22 H new HETATM 0 H19 7SP A2001 -0.188 12.531 9.369 1.00 30.75 H new HETATM 0 H15 7SP A2001 0.416 7.085 7.814 1.00 24.99 H new HETATM 0 H14 7SP A2001 -1.549 8.389 7.824 1.00 26.33 H new HETATM 0 H12 7SP A2001 -1.904 11.842 8.880 1.00 23.59 H new HETATM 2436 C1 PGE A3001 -13.509 3.353 0.849 1.00 34.62 C HETATM 2437 O1 PGE A3001 -13.514 4.734 0.833 1.00 40.16 O HETATM 2438 C2 PGE A3001 -12.991 2.656 -0.362 1.00 29.51 C HETATM 2439 O2 PGE A3001 -12.569 1.350 -0.232 1.00 37.66 O HETATM 2440 C3 PGE A3001 -11.319 0.995 -0.693 1.00 26.48 C HETATM 2441 C4 PGE A3001 -10.214 0.878 0.303 1.00 27.66 C HETATM 2442 O4 PGE A3001 -7.438 3.370 2.451 1.00 33.82 O HETATM 2443 C6 PGE A3001 -7.692 2.031 2.232 1.00 27.99 C HETATM 2444 C5 PGE A3001 -8.019 1.602 0.843 1.00 23.53 C HETATM 2445 O3 PGE A3001 -9.274 1.884 0.353 1.00 38.50 O HETATM 0 HO4 PGE A3001 -7.268 3.494 3.264 1.00 33.82 H new HETATM 0 HO1 PGE A3001 -13.825 5.022 1.558 1.00 40.16 H new HETATM 0 H62 PGE A3001 -6.915 1.529 2.523 1.00 27.99 H new HETATM 0 H6 PGE A3001 -8.430 1.770 2.806 1.00 27.99 H new HETATM 0 H52 PGE A3001 -7.370 2.008 0.247 1.00 23.53 H new HETATM 0 H5 PGE A3001 -7.890 0.642 0.791 1.00 23.53 H new HETATM 0 H42 PGE A3001 -10.615 0.803 1.183 1.00 27.66 H new HETATM 0 H4 PGE A3001 -9.748 0.045 0.132 1.00 27.66 H new HETATM 0 H32 PGE A3001 -11.401 0.142 -1.148 1.00 26.48 H new HETATM 0 H3 PGE A3001 -11.051 1.647 -1.359 1.00 26.48 H new HETATM 0 H22 PGE A3001 -13.688 2.676 -1.036 1.00 29.51 H new HETATM 0 H2 PGE A3001 -12.247 3.175 -0.707 1.00 29.51 H new HETATM 0 H12 PGE A3001 -12.982 3.064 1.610 1.00 34.62 H new HETATM 0 H1 PGE A3001 -14.418 3.052 1.003 1.00 34.62 H new HETATM 2446 C1 GOL A3002 8.200 -3.401 -11.114 1.00 16.58 C HETATM 2447 O1 GOL A3002 9.211 -2.478 -10.770 1.00 10.08 O HETATM 2448 C2 GOL A3002 6.895 -2.668 -11.410 1.00 14.40 C HETATM 2449 O2 GOL A3002 7.070 -1.732 -12.458 1.00 15.79 O HETATM 2450 C3 GOL A3002 5.797 -3.669 -11.750 1.00 19.38 C HETATM 2451 O3 GOL A3002 6.074 -4.278 -12.993 1.00 22.47 O HETATM 0 HO3 GOL A3002 6.434 -3.718 -13.506 1.00 22.47 H new HETATM 0 HO2 GOL A3002 6.700 -1.007 -12.251 1.00 15.79 H new HETATM 0 HO1 GOL A3002 9.056 -2.164 -10.007 1.00 10.08 H new HETATM 0 H32 GOL A3002 5.737 -4.344 -11.056 1.00 19.38 H new HETATM 0 H31 GOL A3002 4.938 -3.220 -11.785 1.00 19.38 H new HETATM 0 H2 GOL A3002 6.628 -2.177 -10.617 1.00 14.40 H new HETATM 0 H12 GOL A3002 8.473 -3.915 -11.890 1.00 16.58 H new HETATM 0 H11 GOL A3002 8.067 -4.031 -10.388 1.00 16.58 H new HETATM 2452 S DMS A3003 4.879 -12.945 32.602 1.00 25.95 S HETATM 2453 O DMS A3003 5.389 -14.674 32.594 1.00 27.95 O HETATM 2454 C1 DMS A3003 3.162 -12.796 33.166 1.00 26.67 C HETATM 2455 C2 DMS A3003 5.738 -12.093 33.952 1.00 25.80 C HETATM 0 H23 DMS A3003 5.472 -11.160 33.967 1.00 25.80 H new HETATM 0 H22 DMS A3003 5.506 -12.509 34.797 1.00 25.80 H new HETATM 0 H21 DMS A3003 6.696 -12.153 33.815 1.00 25.80 H new HETATM 0 H13 DMS A3003 2.603 -12.505 32.429 1.00 26.67 H new HETATM 0 H12 DMS A3003 2.851 -13.657 33.487 1.00 26.67 H new HETATM 0 H11 DMS A3003 3.112 -12.146 33.885 1.00 26.67 H new HETATM 2456 C1 PGE A3004 12.842 17.523 5.881 1.00 27.89 C HETATM 2457 O1 PGE A3004 14.104 18.043 6.078 1.00 36.74 O HETATM 2458 C2 PGE A3004 12.590 16.830 4.589 1.00 30.43 C HETATM 2459 O2 PGE A3004 13.421 15.779 4.275 1.00 24.87 O HETATM 2460 C3 PGE A3004 13.322 15.198 3.032 1.00 23.81 C HETATM 2461 C4 PGE A3004 14.474 14.372 2.590 1.00 19.78 C HETATM 2462 O4 PGE A3004 18.391 15.704 1.520 1.00 34.11 O HETATM 2463 C6 PGE A3004 18.162 14.763 2.503 1.00 28.33 C HETATM 2464 C5 PGE A3004 16.819 14.122 2.532 1.00 26.50 C HETATM 2465 O3 PGE A3004 15.724 14.949 2.663 1.00 21.90 O HETATM 0 HO4 PGE A3004 17.716 15.760 1.023 1.00 34.11 H new HETATM 0 HO1 PGE A3004 14.635 17.711 5.518 1.00 36.74 H new HETATM 0 H62 PGE A3004 18.827 14.063 2.410 1.00 28.33 H new HETATM 0 H6 PGE A3004 18.312 15.185 3.364 1.00 28.33 H new HETATM 0 H52 PGE A3004 16.713 13.611 1.714 1.00 26.50 H new HETATM 0 H5 PGE A3004 16.805 13.488 3.266 1.00 26.50 H new HETATM 0 H42 PGE A3004 14.485 13.561 3.122 1.00 19.78 H new HETATM 0 H4 PGE A3004 14.318 14.106 1.670 1.00 19.78 H new HETATM 0 H32 PGE A3004 12.528 14.641 3.020 1.00 23.81 H new HETATM 0 H3 PGE A3004 13.185 15.902 2.379 1.00 23.81 H new HETATM 0 H22 PGE A3004 11.677 16.502 4.595 1.00 30.43 H new HETATM 0 H2 PGE A3004 12.651 17.486 3.877 1.00 30.43 H new HETATM 0 H12 PGE A3004 12.658 16.897 6.599 1.00 27.89 H new HETATM 0 H1 PGE A3004 12.202 18.247 5.965 1.00 27.89 H new HETATM 2466 O HOH A 331 24.927 -1.524 13.182 1.00 31.11 O HETATM 2467 O HOH A 332 8.247 -0.236 -16.803 1.00 27.75 O HETATM 2468 O HOH A 333 26.927 -3.325 11.418 1.00 29.10 O HETATM 2469 O HOH A 334 12.780 -9.537 -10.039 1.00 32.23 O HETATM 2470 O HOH A 335 -7.814 -12.780 29.274 1.00 31.23 O HETATM 2471 O HOH A 336 -4.060 -18.501 16.480 1.00 25.25 O HETATM 2472 O HOH A 337 12.292 -5.960 33.622 1.00 29.56 O HETATM 2473 O HOH A 338 -6.400 -20.078 17.817 1.00 29.05 O HETATM 2474 O HOH A 339 20.183 9.851 11.853 1.00 28.23 O HETATM 2475 O HOH A 340 -10.730 5.192 -18.576 1.00 28.41 O HETATM 2476 O HOH A 341 23.253 -1.081 17.189 1.00 30.36 O HETATM 2477 O HOH A 342 25.751 -8.996 -2.738 1.00 28.85 O HETATM 2478 O HOH A 343 -6.282 1.063 12.435 1.00 27.50 O HETATM 2479 O HOH A 344 5.973 9.249 19.426 1.00 27.35 O HETATM 2480 O HOH A 345 8.506 -15.442 11.614 1.00 6.57 O HETATM 2481 O HOH A 346 4.893 9.155 36.579 1.00 32.40 O HETATM 2482 O HOH A 347 -16.332 -3.458 -10.377 1.00 31.04 O HETATM 2483 O HOH A 348 18.707 0.035 -12.942 1.00 28.25 O HETATM 2484 O HOH A 349 23.333 -16.741 12.523 1.00 27.35 O HETATM 2485 O HOH A 350 -12.330 -8.890 10.264 1.00 25.77 O HETATM 2486 O HOH A 351 7.243 19.463 -5.930 1.00 26.54 O HETATM 2487 O HOH A 352 9.329 -1.261 18.745 1.00 7.61 O HETATM 2488 O HOH A 353 1.662 -9.185 -10.979 1.00 27.76 O HETATM 2489 O HOH A 354 -9.519 -11.210 4.415 1.00 28.79 O HETATM 2490 O HOH A 355 13.802 12.686 -16.971 1.00 27.81 O HETATM 2491 O HOH A 356 -13.744 14.658 2.542 1.00 31.45 O HETATM 2492 O HOH A 357 -8.653 -0.994 9.349 1.00 28.52 O HETATM 2493 O HOH A 358 -14.414 16.263 -13.867 1.00 31.25 O HETATM 2494 O HOH A 359 2.692 -17.470 34.705 1.00 32.57 O HETATM 2495 O HOH A 360 3.389 -14.348 -6.890 1.00 31.99 O HETATM 2496 O HOH A 361 3.828 -4.535 6.101 1.00 7.02 O HETATM 2497 O HOH A 362 13.328 18.883 -1.071 1.00 34.24 O HETATM 2498 O HOH A 363 7.425 -6.357 38.368 1.00 30.87 O HETATM 2499 O HOH A 364 13.867 -16.232 31.292 1.00 31.65 O HETATM 2500 O HOH A 365 8.130 -3.436 -1.503 1.00 5.96 O HETATM 2501 O HOH A 366 -22.402 4.599 -5.719 1.00 6.86 O HETATM 2502 O HOH A 367 27.285 -8.876 4.515 1.00 31.91 O HETATM 2503 O HOH A 368 3.990 -21.018 32.564 1.00 35.06 O HETATM 2504 O HOH A 369 -1.874 -7.817 33.763 1.00 30.67 O HETATM 2505 O HOH A 370 3.526 -6.944 7.465 1.00 6.34 O HETATM 2506 O HOH A 371 -17.429 16.638 -3.761 1.00 27.09 O HETATM 2507 O HOH A 372 12.624 -8.211 0.831 1.00 6.95 O HETATM 2508 O HOH A 373 15.820 1.594 25.557 1.00 29.53 O HETATM 2509 O HOH A 374 9.124 22.901 -11.072 1.00 31.79 O HETATM 2510 O HOH A 375 -11.211 -0.470 28.440 1.00 34.52 O HETATM 2511 O HOH A 376 20.120 -12.064 -10.276 1.00 33.07 O HETATM 2512 O HOH A 377 21.839 4.567 12.238 1.00 29.54 O HETATM 2513 O HOH A 378 16.847 -8.716 0.772 1.00 6.58 O HETATM 2514 O HOH A 379 5.218 -18.842 31.992 1.00 28.67 O HETATM 2515 O HOH A 380 4.785 -1.666 -15.898 1.00 35.15 O HETATM 2516 O HOH A 381 2.640 -13.744 5.706 1.00 7.60 O HETATM 2517 O HOH A 382 -7.587 12.899 -2.345 1.00 7.54 O HETATM 2518 O HOH A 383 16.132 11.508 -0.820 1.00 7.63 O HETATM 2519 O HOH A 384 -10.417 10.836 3.553 1.00 33.80 O HETATM 2520 O HOH A 385 9.785 7.855 27.530 1.00 26.83 O HETATM 2521 O HOH A 386 24.303 0.753 11.849 1.00 31.39 O HETATM 2522 O HOH A 387 2.756 -14.790 35.377 1.00 34.52 O HETATM 2523 O HOH A 388 -4.497 -7.018 -12.154 1.00 33.50 O HETATM 2524 O HOH A 389 -17.164 -7.922 27.765 1.00 36.07 O HETATM 2525 O HOH A 390 -16.234 -2.721 22.876 1.00 34.04 O HETATM 2526 O HOH A 391 17.013 9.633 21.349 1.00 31.61 O HETATM 2527 O HOH A 392 -16.357 9.706 -10.470 1.00 25.69 O HETATM 2528 O HOH A 393 3.115 14.466 -21.461 1.00 32.48 O HETATM 2529 O HOH A 394 15.406 -13.875 -10.131 1.00 32.83 O HETATM 2530 O HOH A 395 -5.641 -12.811 13.296 1.00 8.69 O HETATM 2531 O HOH A 396 9.663 -3.022 16.549 1.00 7.47 O HETATM 2532 O HOH A 397 1.598 10.436 -23.530 1.00 30.72 O HETATM 2533 O HOH A 398 5.838 4.763 17.343 1.00 7.91 O HETATM 2534 O HOH A 399 15.324 10.420 -4.940 1.00 8.46 O HETATM 2535 O HOH A 400 8.795 6.109 7.499 1.00 8.12 O HETATM 2536 O HOH A 401 16.251 -1.335 -10.771 1.00 8.53 O HETATM 2537 O HOH A 402 -6.262 -5.136 14.153 1.00 8.51 O HETATM 2538 O HOH A 403 12.930 -3.217 22.724 1.00 8.04 O HETATM 2539 O HOH A 404 1.178 -3.399 5.755 1.00 7.84 O HETATM 2540 O HOH A 405 -13.619 -12.326 21.379 1.00 33.72 O HETATM 2541 O HOH A 406 16.641 -17.989 15.565 1.00 31.45 O HETATM 2542 O HOH A 407 -8.156 -10.288 25.793 1.00 13.02 O HETATM 2543 O HOH A 408 3.298 20.852 -4.721 1.00 31.89 O HETATM 2544 O HOH A 409 3.493 0.966 16.012 1.00 9.25 O HETATM 2545 O HOH A 410 -4.083 4.569 2.900 1.00 10.10 O HETATM 2546 O HOH A 411 -4.167 -13.130 10.993 1.00 8.22 O HETATM 2547 O HOH A 412 -1.151 -0.870 4.888 1.00 10.18 O HETATM 2548 O HOH A 413 4.355 -2.488 32.057 1.00 8.10 O HETATM 2549 O HOH A 414 -20.006 6.292 0.399 1.00 27.68 O HETATM 2550 O HOH A 415 6.028 -26.015 27.770 1.00 33.45 O HETATM 2551 O HOH A 416 22.181 12.909 -1.662 1.00 31.18 O HETATM 2552 O HOH A 417 25.666 2.795 4.289 1.00 27.10 O HETATM 2553 O HOH A 418 12.769 -9.949 -1.284 1.00 8.17 O HETATM 2554 O HOH A 419 18.755 8.212 19.599 1.00 30.94 O HETATM 2555 O HOH A 420 -3.205 15.506 -16.688 1.00 7.85 O HETATM 2556 O HOH A 421 -16.234 -3.536 27.495 1.00 33.65 O HETATM 2557 O HOH A 422 9.664 0.038 -12.161 1.00 9.96 O HETATM 2558 O HOH A 423 5.942 -4.182 38.178 1.00 30.08 O HETATM 2559 O HOH A 424 4.267 -19.094 25.484 1.00 10.81 O HETATM 2560 O HOH A 425 -13.305 -1.753 -2.568 1.00 10.38 O HETATM 2561 O HOH A 426 28.232 7.898 7.830 1.00 31.72 O HETATM 2562 O HOH A 427 22.406 2.420 -8.655 1.00 9.97 O HETATM 2563 O HOH A 428 12.117 11.941 9.475 1.00 11.21 O HETATM 2564 O HOH A 429 9.732 8.501 -16.945 1.00 33.33 O HETATM 2565 O HOH A 430 28.499 3.088 6.995 1.00 36.78 O HETATM 2566 O HOH A 431 13.984 -12.496 -0.946 1.00 9.96 O HETATM 2567 O HOH A 432 -1.215 -11.152 32.272 1.00 33.37 O HETATM 2568 O HOH A 433 19.126 -14.589 15.477 1.00 12.47 O HETATM 2569 O HOH A 434 21.031 9.934 4.101 1.00 10.58 O HETATM 2570 O HOH A 435 24.420 -9.417 4.187 1.00 12.21 O HETATM 2571 O HOH A 436 3.830 6.248 -15.725 1.00 9.43 O HETATM 2572 O HOH A 437 -6.280 -17.527 24.690 1.00 33.47 O HETATM 2573 O HOH A 438 -3.233 -15.170 13.936 1.00 10.02 O HETATM 2574 O HOH A 439 -19.304 4.009 -13.054 1.00 10.54 O HETATM 2575 O HOH A 440 1.853 -20.383 24.822 1.00 13.20 O HETATM 2576 O HOH A 441 3.429 12.858 -17.269 1.00 15.81 O HETATM 2577 O HOH A 442 8.228 -2.114 21.179 1.00 8.70 O HETATM 2578 O HOH A 443 23.678 -8.151 1.701 1.00 14.30 O HETATM 2579 O HOH A 444 0.299 -17.138 12.022 1.00 10.09 O HETATM 2580 O HOH A 445 -3.060 -2.401 -5.506 1.00 11.29 O HETATM 2581 O HOH A 446 7.527 6.631 -20.938 1.00 34.56 O HETATM 2582 O HOH A 447 9.621 2.288 35.155 1.00 11.80 O HETATM 2583 O HOH A 448 -1.177 -1.003 7.543 1.00 10.19 O HETATM 2584 O HOH A 449 -6.660 -0.406 -14.320 1.00 18.28 O HETATM 2585 O HOH A 450 1.909 22.634 1.021 1.00 23.17 O HETATM 2586 O HOH A 451 -9.207 -0.571 -13.195 1.00 21.39 O HETATM 2587 O HOH A 452 22.083 -16.229 8.053 1.00 23.70 O HETATM 2588 O HOH A 453 9.162 -11.760 -2.455 1.00 13.65 O HETATM 2589 O HOH A 454 -5.735 -3.047 -4.771 1.00 11.66 O HETATM 2590 O HOH A 455 9.006 -2.709 40.415 1.00 23.94 O HETATM 2591 O HOH A 456 15.296 5.942 21.368 1.00 27.13 O HETATM 2592 O HOH A 457 -4.056 7.597 6.412 1.00 35.68 O HETATM 2593 O HOH A 458 -1.260 -18.689 32.656 1.00 31.58 O HETATM 2594 O HOH A 459 18.719 -17.197 9.957 1.00 31.08 O HETATM 2595 O HOH A 460 0.563 -15.459 -6.457 1.00 30.97 O HETATM 2596 O HOH A 461 -9.198 15.002 -3.117 1.00 15.41 O HETATM 2597 O HOH A 462 -1.298 19.817 -2.054 1.00 10.88 O HETATM 2598 O HOH A 463 -5.205 4.745 -19.416 1.00 32.66 O HETATM 2599 O HOH A 464 -5.217 7.393 -19.423 1.00 30.09 O HETATM 2600 O HOH A 465 7.408 -16.526 6.714 1.00 10.40 O HETATM 2601 O HOH A 466 14.292 -1.465 24.371 1.00 11.66 O HETATM 2602 O HOH A 467 -1.122 -16.953 14.322 1.00 11.10 O HETATM 2603 O HOH A 468 -9.531 -5.703 -7.063 1.00 39.23 O HETATM 2604 O HOH A 469 11.230 -17.085 13.462 1.00 13.21 O HETATM 2605 O HOH A 470 -13.525 -0.358 -20.165 1.00 13.42 O HETATM 2606 O HOH A 471 19.301 -6.790 21.384 1.00 32.10 O HETATM 2607 O HOH A 472 -18.535 -4.906 -4.651 1.00 14.42 O HETATM 2608 O HOH A 473 9.649 -16.481 20.386 1.00 11.86 O HETATM 2609 O HOH A 474 -6.514 18.078 -1.911 1.00 11.48 O HETATM 2610 O HOH A 475 13.905 -12.526 25.981 1.00 14.40 O HETATM 2611 O HOH A 476 -8.051 -1.083 30.714 1.00 35.14 O HETATM 2612 O HOH A 477 -1.712 -1.611 -1.256 1.00 10.53 O HETATM 2613 O HOH A 478 -8.192 10.191 0.373 1.00 12.66 O HETATM 2614 O HOH A 479 -4.520 -9.538 -2.355 1.00 13.82 O HETATM 2615 O HOH A 480 -12.736 -14.112 13.209 1.00 33.41 O HETATM 2616 O HOH A 481 -8.125 19.504 -9.425 1.00 11.14 O HETATM 2617 O HOH A 482 14.584 5.784 32.365 1.00 12.67 O HETATM 2618 O HOH A 483 3.987 4.782 32.673 1.00 13.52 O HETATM 2619 O HOH A 484 11.060 -9.833 -5.964 1.00 12.45 O HETATM 2620 O HOH A 485 -0.201 0.063 -16.367 1.00 13.44 O HETATM 2621 O HOH A 486 -2.060 -16.702 23.765 1.00 12.09 O HETATM 2622 O HOH A 487 -6.092 17.437 -6.366 1.00 13.73 O HETATM 2623 O HOH A 488 -12.328 -1.209 19.991 1.00 13.38 O HETATM 2624 O HOH A 489 -1.950 -2.176 -15.133 1.00 17.45 O HETATM 2625 O HOH A 490 19.850 11.818 -2.279 1.00 15.27 O HETATM 2626 O HOH A 491 -5.944 -3.519 11.812 1.00 17.48 O HETATM 2627 O HOH A 492 6.032 7.996 -18.971 1.00 15.50 O HETATM 2628 O HOH A 493 -5.462 -16.430 20.510 1.00 14.78 O HETATM 2629 O HOH A 494 20.110 9.629 7.257 1.00 12.13 O HETATM 2630 O HOH A 495 -0.315 3.767 -18.664 1.00 13.44 O HETATM 2631 O HOH A 496 12.977 11.941 20.729 1.00 37.00 O HETATM 2632 O HOH A 497 12.930 -8.303 35.392 1.00 35.12 O HETATM 2633 O HOH A 498 -21.372 -5.332 2.246 1.00 17.01 O HETATM 2634 O HOH A 499 11.047 -4.342 35.273 1.00 18.01 O HETATM 2635 O HOH A 500 7.245 -9.232 -5.582 1.00 21.85 O HETATM 2636 O HOH A 501 10.941 -16.163 3.497 1.00 20.14 O HETATM 2637 O HOH A 502 -0.400 -5.019 -13.200 1.00 29.47 O HETATM 2638 O HOH A 503 -7.405 -12.316 0.435 1.00 31.85 O HETATM 2639 O HOH A 504 -7.530 16.943 0.410 1.00 30.12 O HETATM 2640 O HOH A 505 -14.655 18.042 -4.440 1.00 30.02 O HETATM 2641 O HOH A 506 -6.911 12.740 0.388 1.00 14.70 O HETATM 2642 O HOH A 507 -5.896 -10.837 -4.360 1.00 32.46 O HETATM 2643 O HOH A 508 -7.443 -14.771 27.320 1.00 33.86 O HETATM 2644 O HOH A 509 12.402 16.055 -16.496 1.00 31.95 O HETATM 2645 O HOH A 510 2.262 4.144 9.526 1.00 14.07 O HETATM 2646 O HOH A 511 15.204 -5.449 27.405 1.00 27.06 O HETATM 2647 O HOH A 512 -3.528 3.491 5.270 1.00 16.36 O HETATM 2648 O HOH A 513 -4.161 1.330 28.387 1.00 14.80 O HETATM 2649 O HOH A 514 -16.475 -5.387 -12.127 1.00 36.72 O HETATM 2650 O HOH A 515 -21.942 4.333 0.619 1.00 13.97 O HETATM 2651 O HOH A 516 2.335 -21.324 22.214 1.00 15.01 O HETATM 2652 O HOH A 517 -4.031 -11.383 31.177 1.00 34.23 O HETATM 2653 O HOH A 518 18.891 13.046 9.309 1.00 18.65 O HETATM 2654 O HOH A 519 7.885 18.295 -1.165 1.00 16.52 O HETATM 2655 O HOH A 520 19.475 -10.343 16.969 1.00 15.95 O HETATM 2656 O HOH A 521 20.522 8.620 -8.991 1.00 14.78 O HETATM 2657 O HOH A 522 14.958 -16.851 24.594 1.00 14.86 O HETATM 2658 O HOH A 523 16.232 17.225 4.493 1.00 30.98 O HETATM 2659 O HOH A 524 -2.805 12.498 -22.331 1.00 16.52 O HETATM 2660 O HOH A 525 8.024 9.761 28.859 1.00 34.29 O HETATM 2661 O HOH A 526 -7.560 8.027 1.910 1.00 17.26 O HETATM 2662 O HOH A 527 19.079 13.296 -8.584 1.00 32.11 O HETATM 2663 O HOH A 528 15.206 3.352 -13.634 1.00 16.06 O HETATM 2664 O HOH A 529 11.666 -4.802 -13.724 1.00 18.41 O HETATM 2665 O HOH A 530 17.500 -15.494 6.494 1.00 16.01 O HETATM 2666 O HOH A 531 -10.985 13.254 -15.068 1.00 15.74 O HETATM 2667 O HOH A 532 -5.270 8.796 16.256 1.00 30.32 O HETATM 2668 O HOH A 533 -8.259 12.288 -20.613 1.00 11.98 O HETATM 2669 O HOH A 534 -19.763 -1.247 1.571 1.00 18.63 O HETATM 2670 O HOH A 535 -9.986 15.069 -12.191 1.00 10.23 O HETATM 2671 O HOH A 536 10.633 -20.032 21.388 1.00 22.12 O HETATM 2672 O HOH A 537 1.100 8.943 19.096 1.00 28.80 O HETATM 2673 O HOH A 538 -9.404 -14.084 20.086 1.00 25.63 O HETATM 2674 O HOH A 539 -9.862 18.747 -5.339 1.00 23.60 O HETATM 2675 O HOH A 540 16.291 13.715 -4.145 1.00 16.95 O HETATM 2676 O HOH A 541 -12.895 16.845 -8.955 1.00 20.74 O HETATM 2677 O HOH A 542 -13.054 -8.417 13.700 1.00 17.09 O HETATM 2678 O HOH A 543 14.363 1.428 -11.386 1.00 16.91 O HETATM 2679 O HOH A 544 4.484 -2.380 36.400 1.00 16.98 O HETATM 2680 O HOH A 545 13.810 0.640 13.351 1.00 15.63 O HETATM 2681 O HOH A 546 -0.556 -18.914 24.686 1.00 17.54 O HETATM 2682 O HOH A 547 -10.267 3.152 15.101 1.00 15.18 O HETATM 2683 O HOH A 548 18.108 1.991 -10.185 1.00 19.66 O HETATM 2684 O HOH A 549 13.526 -19.135 25.094 1.00 17.42 O HETATM 2685 O HOH A 550 13.811 -2.818 28.403 1.00 18.88 O HETATM 2686 O HOH A 551 21.009 -16.124 10.999 1.00 16.38 O HETATM 2687 O HOH A 552 11.629 -17.573 18.970 1.00 13.87 O HETATM 2688 O HOH A 553 -13.951 1.856 13.059 1.00 21.78 O HETATM 2689 O HOH A 554 -10.712 -10.160 0.461 1.00 20.17 O HETATM 2690 O HOH A 555 -1.702 2.268 29.308 1.00 21.40 O HETATM 2691 O HOH A 556 16.735 -2.779 23.962 1.00 18.82 O HETATM 2692 O HOH A 557 5.072 7.243 32.418 1.00 17.32 O HETATM 2693 O HOH A 558 24.966 -5.129 11.032 1.00 15.64 O HETATM 2694 O HOH A 559 19.432 -7.152 -10.938 1.00 18.98 O HETATM 2695 O HOH A 560 14.102 16.648 -9.491 1.00 19.15 O HETATM 2696 O HOH A 561 19.049 -10.131 21.097 1.00 23.15 O HETATM 2697 O HOH A 562 16.094 13.093 -12.265 1.00 22.18 O HETATM 2698 O HOH A 563 -5.710 3.978 23.824 1.00 21.35 O HETATM 2699 O HOH A 564 10.996 -6.386 31.380 1.00 17.55 O HETATM 2700 O HOH A 565 -16.816 -1.856 -1.218 1.00 16.85 O HETATM 2701 O HOH A 566 -0.548 19.279 3.878 1.00 22.95 O HETATM 2702 O HOH A 567 26.884 5.320 7.013 1.00 22.95 O HETATM 2703 O HOH A 568 22.671 -6.376 -7.855 1.00 19.14 O HETATM 2704 O HOH A 569 16.463 6.388 16.555 1.00 19.27 O HETATM 2705 O HOH A 570 5.107 18.540 -0.977 1.00 20.68 O HETATM 2706 O HOH A 571 9.335 -15.061 1.405 1.00 16.68 O HETATM 2707 O HOH A 572 8.645 7.472 24.588 1.00 18.16 O HETATM 2708 O HOH A 573 -1.146 -13.282 30.595 1.00 17.28 O HETATM 2709 O HOH A 574 -5.405 -12.954 5.833 1.00 30.44 O HETATM 2710 O HOH A 575 25.358 5.747 4.636 1.00 24.21 O HETATM 2711 O HOH A 576 21.056 -8.349 -9.136 1.00 19.20 O HETATM 2712 O HOH A 577 27.133 -3.950 5.161 1.00 18.80 O HETATM 2713 O HOH A 578 10.831 9.795 31.326 1.00 20.63 O HETATM 2714 O HOH A 579 1.799 5.911 28.364 1.00 19.34 O HETATM 2715 O HOH A 580 -7.168 -1.227 11.638 1.00 24.28 O HETATM 2716 O HOH A 581 2.059 8.324 24.294 1.00 20.07 O HETATM 2717 O HOH A 582 21.862 -3.402 17.679 1.00 17.60 O HETATM 2718 O HOH A 583 3.210 6.802 26.323 1.00 19.78 O HETATM 2719 O HOH A 584 -7.486 2.971 21.968 1.00 20.81 O HETATM 2720 O HOH A 585 3.553 -22.209 28.798 1.00 23.11 O HETATM 2721 O HOH A 586 19.318 5.653 -13.379 1.00 24.54 O HETATM 2722 O HOH A 587 26.625 -11.221 13.689 1.00 20.94 O HETATM 2723 O HOH A 588 -0.477 7.460 -20.858 1.00 21.07 O HETATM 2724 O HOH A 589 -0.115 11.896 -18.979 1.00 22.94 O HETATM 2725 O HOH A 590 2.285 17.156 -14.675 1.00 16.95 O HETATM 2726 O HOH A 591 12.885 7.594 27.776 1.00 19.20 O HETATM 2727 O HOH A 592 -4.940 -16.550 27.210 1.00 21.49 O HETATM 2728 O HOH A 593 5.808 4.588 35.777 1.00 16.11 O HETATM 2729 O HOH A 594 12.178 9.629 -17.132 1.00 20.61 O HETATM 2730 O HOH A 595 -22.051 4.985 -8.443 1.00 18.45 O HETATM 2731 O HOH A 596 -12.725 3.389 18.983 1.00 20.38 O HETATM 2732 O HOH A 597 -6.473 -5.479 31.261 1.00 24.46 O HETATM 2733 O HOH A 598 24.766 -12.148 4.463 1.00 20.72 O HETATM 2734 O HOH A 599 -14.611 13.612 -14.470 1.00 27.24 O HETATM 2735 O HOH A 600 -4.272 -0.543 -16.233 1.00 19.70 O HETATM 2736 O HOH A 601 7.635 6.500 -17.077 1.00 18.59 O HETATM 2737 O HOH A 602 3.962 -8.446 -7.198 1.00 24.32 O HETATM 2738 O HOH A 603 -10.260 3.001 -19.706 1.00 20.84 O HETATM 2739 O HOH A 604 7.645 -6.575 -12.814 1.00 28.34 O HETATM 2740 O HOH A 605 12.425 -20.376 29.590 1.00 21.74 O HETATM 2741 O HOH A 606 -8.728 6.337 18.233 1.00 18.89 O HETATM 2742 O HOH A 607 16.303 3.834 15.531 1.00 15.36 O HETATM 2743 O HOH A 608 17.570 13.710 -1.613 1.00 14.81 O HETATM 2744 O HOH A 609 2.712 -2.639 34.276 1.00 15.83 O HETATM 2745 O HOH A 610 20.868 -12.461 15.692 1.00 17.96 O HETATM 2746 O HOH A 611 -1.163 16.499 -18.180 1.00 16.96 O HETATM 2747 O HOH A 612 -12.298 -2.036 -11.463 1.00 17.37 O HETATM 2748 O HOH A 613 -13.964 -4.413 -2.969 1.00 15.61 O HETATM 2749 O HOH A 614 23.182 10.119 2.349 1.00 18.26 O HETATM 2750 O HOH A 615 1.359 20.178 -0.654 1.00 18.58 O HETATM 2751 O HOH A 616 3.675 20.583 -2.083 1.00 19.21 O HETATM 2752 O HOH A 617 -12.130 -13.303 19.464 1.00 22.01 O HETATM 2753 O HOH A 618 -11.139 0.669 -20.964 1.00 21.79 O HETATM 2754 O HOH A 619 10.639 -19.297 17.094 1.00 17.48 O HETATM 2755 O HOH A 620 22.184 -7.029 17.936 1.00 20.29 O HETATM 2756 O HOH A 621 15.465 4.786 26.634 1.00 18.78 O HETATM 2757 O HOH A 622 11.738 -2.516 -15.434 1.00 24.13 O HETATM 2758 O HOH A 623 2.827 -6.553 -11.581 1.00 23.53 O HETATM 2759 O HOH A 624 11.684 2.262 -14.943 1.00 22.62 O HETATM 2760 O HOH A 625 -10.165 14.671 -17.878 1.00 19.87 O HETATM 2761 O HOH A 626 -10.010 17.672 -8.719 1.00 19.24 O HETATM 2762 O HOH A 627 11.950 -19.455 14.834 1.00 22.08 O HETATM 2763 O HOH A 628 10.351 19.042 -15.679 1.00 18.78 O HETATM 2764 O HOH A 629 6.102 15.694 2.813 1.00 21.27 O HETATM 2765 O HOH A 630 -16.754 7.064 -10.106 1.00 19.13 O HETATM 2766 O HOH A 631 -10.844 -2.160 10.373 1.00 18.57 O HETATM 2767 O HOH A 632 -5.192 -14.383 8.853 1.00 22.37 O HETATM 2768 O HOH A 633 -16.727 -4.263 -2.701 1.00 18.14 O HETATM 2769 O HOH A 634 10.151 -0.095 -14.949 1.00 20.86 O HETATM 2770 O HOH A 635 -12.628 -11.437 23.971 1.00 25.45 O HETATM 2771 O HOH A 636 -2.447 11.573 -24.762 1.00 24.95 O HETATM 2772 O HOH A 637 20.998 10.947 9.385 1.00 21.28 O HETATM 2773 O HOH A 638 20.603 5.603 -10.328 1.00 23.46 O HETATM 2774 O HOH A 639 -4.405 -17.800 22.683 1.00 22.64 O HETATM 2775 O HOH A 640 16.100 -17.324 8.066 1.00 23.26 O HETATM 2776 O HOH A 641 -3.843 5.780 22.595 1.00 21.02 O HETATM 2777 O HOH A 642 -6.044 0.811 30.450 1.00 24.68 O HETATM 2778 O HOH A 643 -13.463 18.608 -6.841 1.00 23.97 O HETATM 2779 O HOH A 644 -7.620 17.044 -4.195 1.00 20.42 O HETATM 2780 O HOH A 645 -1.716 5.187 -20.524 1.00 23.60 O HETATM 2781 O HOH A 646 -15.046 -6.190 27.844 1.00 22.25 O HETATM 2782 O HOH A 647 -18.629 6.308 -11.650 1.00 23.77 O HETATM 2783 O HOH A 648 14.352 -20.194 27.693 1.00 26.88 O HETATM 2784 O HOH A 649 -13.308 -0.948 10.130 1.00 25.89 O HETATM 2785 O HOH A 650 7.602 -10.270 35.398 1.00 23.87 O HETATM 2786 O HOH A 651 -2.131 1.504 -18.024 1.00 20.53 O HETATM 2787 O HOH A 652 19.453 -13.452 19.856 1.00 29.64 O HETATM 2788 O HOH A 653 20.217 8.933 -5.975 1.00 20.71 O HETATM 2789 O HOH A 654 9.043 -24.052 25.792 1.00 22.16 O HETATM 2790 O HOH A 655 16.504 -16.194 26.800 1.00 23.07 O HETATM 2791 O HOH A 656 3.691 2.411 -18.044 1.00 24.58 O HETATM 2792 O HOH A 657 21.541 2.492 -11.507 1.00 24.53 O HETATM 2793 O HOH A 658 17.506 8.391 15.051 1.00 25.43 O HETATM 2794 O HOH A 659 8.879 -22.831 28.354 1.00 20.44 O HETATM 2795 O HOH A 660 21.955 -12.219 -2.883 1.00 26.09 O HETATM 2796 O HOH A 661 -5.985 -17.641 18.029 1.00 22.97 O HETATM 2797 O HOH A 662 19.340 -16.175 13.195 1.00 22.91 O HETATM 2798 O HOH A 663 2.513 19.041 -10.320 1.00 19.08 O HETATM 2799 O HOH A 664 -6.297 -3.802 -8.305 1.00 21.52 O HETATM 2800 O HOH A 665 2.714 -0.189 -16.549 1.00 27.27 O HETATM 2801 O HOH A 666 6.360 -23.722 29.270 1.00 22.19 O HETATM 2802 O HOH A 667 18.170 12.903 -5.988 1.00 23.25 O HETATM 2803 O HOH A 668 18.301 -7.099 -14.456 1.00 22.20 O HETATM 2804 O HOH A 669 11.325 21.120 -6.915 1.00 23.92 O HETATM 2805 O HOH A 670 -11.220 -7.427 -4.902 1.00 22.43 O HETATM 2806 O HOH A 671 -7.760 -4.026 -11.030 1.00 31.94 O HETATM 2807 O HOH A 672 -13.445 13.197 -16.779 1.00 24.82 O HETATM 2808 O HOH A 673 18.425 3.505 19.437 1.00 28.92 O HETATM 2809 O HOH A 674 -4.149 -13.135 0.985 1.00 25.31 O HETATM 2810 O HOH A 675 16.925 9.274 -15.908 1.00 24.07 O HETATM 2811 O HOH A 676 0.082 20.449 -4.754 1.00 18.63 O HETATM 2812 O HOH A 677 15.327 10.009 14.721 1.00 22.46 O HETATM 2813 O HOH A 678 11.883 -14.338 -0.847 1.00 25.30 O HETATM 2814 O HOH A 679 -19.433 14.692 -2.304 1.00 27.31 O HETATM 2815 O HOH A 680 -11.630 -3.181 -8.869 1.00 28.31 O HETATM 2816 O HOH A 681 27.879 -4.977 14.218 1.00 28.25 O HETATM 2817 O HOH A 682 16.425 1.944 13.239 1.00 30.86 O HETATM 2818 O HOH A 683 23.716 -9.346 -0.693 1.00 22.45 O HETATM 2819 O HOH A 684 -1.062 -19.214 21.020 1.00 28.29 O HETATM 2820 O HOH A 685 9.176 -6.948 36.522 1.00 29.10 O HETATM 2821 O HOH A 686 16.532 16.049 -5.246 1.00 26.20 O HETATM 2822 O HOH A 687 21.735 12.345 5.300 1.00 24.31 O HETATM 2823 O HOH A 688 -13.502 -2.052 0.327 1.00 26.73 O HETATM 2824 O HOH A 689 14.428 16.529 -6.716 1.00 26.61 O HETATM 2825 O HOH A 690 24.387 -15.041 8.526 1.00 25.41 O HETATM 2826 O HOH A 691 -13.113 11.810 -21.011 1.00 29.13 O HETATM 2827 O HOH A 692 -7.618 -9.428 -5.782 1.00 28.43 O HETATM 2828 O HOH A 693 16.585 -17.320 22.301 1.00 24.83 O HETATM 2829 O HOH A 694 9.114 18.681 3.692 1.00 27.63 O HETATM 2830 O HOH A 695 18.510 -10.159 26.289 1.00 30.04 O HETATM 2831 O HOH A 696 7.375 13.155 13.928 1.00 30.76 O HETATM 2832 O HOH A 697 20.322 -9.071 19.133 1.00 29.06 O HETATM 2833 O HOH A 698 -22.122 6.860 -4.267 1.00 24.69 O HETATM 2834 O HOH A 699 -17.660 -5.749 -0.580 1.00 25.81 O HETATM 2835 O HOH A 700 0.546 -4.281 34.139 1.00 25.90 O HETATM 2836 O HOH A 701 -10.187 -15.380 13.454 1.00 28.80 O HETATM 2837 O HOH A 702 -0.493 -18.028 18.609 1.00 29.04 O HETATM 2838 O HOH A 703 3.981 19.801 -8.509 1.00 30.11 O HETATM 2839 O HOH A 704 -2.272 9.044 -19.825 1.00 26.03 O HETATM 2840 O HOH A 705 -2.079 -3.039 35.353 1.00 24.26 O HETATM 2841 O HOH A 706 24.961 -7.609 -7.014 1.00 26.30 O HETATM 2842 O HOH A 707 -0.063 18.275 0.389 1.00 23.65 O HETATM 2843 O HOH A 708 1.561 14.951 -16.050 1.00 29.46 O HETATM 2844 O HOH A 709 8.021 21.985 -8.945 1.00 26.33 O HETATM 2845 O HOH A 710 4.246 -14.297 -4.391 1.00 26.11 O HETATM 2846 O HOH A 711 12.325 -10.806 29.101 1.00 22.29 O HETATM 2847 O HOH A 712 10.112 12.567 -20.071 1.00 26.04 O HETATM 2848 O HOH A 713 25.755 -13.727 13.338 1.00 27.24 O HETATM 2849 O HOH A 714 19.660 -2.975 21.798 1.00 23.17 O HETATM 2850 O HOH A 715 -2.991 -14.760 31.780 1.00 25.75 O HETATM 2851 O HOH A 716 -11.398 -7.014 0.118 1.00 27.97 O HETATM 2852 O HOH A 717 15.928 -0.494 -13.343 1.00 24.04 O HETATM 2853 O HOH A 718 -10.306 2.468 22.793 1.00 30.61 O HETATM 2854 O HOH A 719 6.203 7.347 35.015 1.00 23.45 O HETATM 2855 O HOH A 720 22.102 -12.526 -8.083 1.00 28.86 O HETATM 2856 O HOH A 721 -9.936 -12.016 24.699 1.00 27.99 O HETATM 2857 O HOH A 722 2.963 -9.280 -0.328 1.00 12.06 O HETATM 2858 O HOH A 723 15.678 2.129 -9.245 1.00 17.22 O HETATM 2859 O HOH A 724 -13.980 -3.177 -9.370 1.00 20.02 O HETATM 2860 O HOH A 725 -13.036 -5.491 -5.284 1.00 22.85 O HETATM 2861 O HOH A 726 -12.900 -2.958 -16.575 1.00 20.44 O HETATM 2862 O HOH A 727 18.949 10.944 -4.692 1.00 22.66 O HETATM 2863 O HOH A 728 -9.596 7.388 -19.506 1.00 25.58 O HETATM 2864 O HOH A 729 -19.245 8.342 -6.886 1.00 27.90 O HETATM 2865 O HOH A 730 1.392 -22.718 26.196 1.00 22.95 O HETATM 2866 O HOH A 731 4.258 -5.882 -6.930 1.00 23.82 O HETATM 2867 O HOH A 732 15.756 -13.796 27.710 1.00 26.80 O HETATM 2868 O HOH A 733 1.982 -9.782 -8.331 1.00 26.42 O HETATM 2869 O HOH A 734 4.833 18.664 -6.398 1.00 24.71 O HETATM 2870 O HOH A 735 16.402 16.255 -0.331 1.00 25.91 O HETATM 2871 O HOH A 736 20.326 -14.297 -3.172 1.00 29.38 O HETATM 2872 O HOH A 737 18.681 -16.122 21.006 1.00 30.08 O HETATM 2873 O HOH A 738 -0.940 4.652 28.458 1.00 28.25 O HETATM 2874 O HOH A 739 21.396 4.690 -12.636 1.00 28.71 O HETATM 2875 O HOH A 740 17.102 6.121 19.171 1.00 25.23 O HETATM 2876 O HOH A 741 8.570 8.428 35.828 1.00 25.94 O HETATM 2877 O HOH A 742 27.561 -8.985 13.952 1.00 27.92 O HETATM 2878 O HOH A 743 9.088 10.423 33.249 1.00 31.63 O HETATM 2879 O HOH A 744 -17.518 5.168 0.684 1.00 29.20 O HETATM 2880 O HOH A 745 25.408 8.314 2.541 1.00 27.08 O HETATM 2881 O HOH A 746 22.607 10.118 -0.274 1.00 28.17 O HETATM 2882 O HOH A 747 23.325 -13.463 16.424 1.00 26.95 O HETATM 2883 O HOH A 748 8.245 20.348 -17.012 1.00 24.29 O HETATM 2884 O HOH A 749 -9.367 -13.979 22.880 1.00 26.78 O HETATM 2885 O HOH A 750 13.852 -13.873 29.873 1.00 30.52 O HETATM 2886 O HOH A 751 1.543 17.621 2.217 1.00 28.12 O HETATM 2887 O HOH A 752 27.142 -11.069 11.205 1.00 25.18 O HETATM 2888 O HOH A 753 14.305 9.735 21.708 1.00 29.97 O HETATM 2889 O HOH A 754 4.424 9.622 22.702 1.00 27.64 O HETATM 2890 O HOH A 755 -21.466 7.165 -1.724 1.00 30.88 O CONECT 1857 2106 CONECT 2106 1857 CONECT 2397 2398 2402 CONECT 2398 2397 2399 CONECT 2399 2398 2400 CONECT 2400 2399 2401 CONECT 2401 2400 2402 2403 CONECT 2402 2397 2401 CONECT 2403 2401 2404 2420 CONECT 2404 2403 2405 2406 CONECT 2405 2404 CONECT 2406 2404 2407 CONECT 2407 2406 2408 CONECT 2408 2407 2409 CONECT 2409 2408 2410 2414 CONECT 2410 2409 2411 CONECT 2411 2410 2412 CONECT 2412 2411 2413 2419 CONECT 2413 2412 2414 2418 CONECT 2414 2409 2413 2415 CONECT 2415 2414 2416 CONECT 2416 2415 2417 CONECT 2417 2416 2418 CONECT 2418 2413 2417 CONECT 2419 2412 CONECT 2420 2403 CONECT 2421 2422 CONECT 2422 2421 2423 CONECT 2423 2422 2424 CONECT 2424 2423 2425 CONECT 2425 2424 2426 2430 CONECT 2426 2425 2427 CONECT 2427 2426 2428 CONECT 2428 2427 2429 2435 CONECT 2429 2428 2430 2434 CONECT 2430 2425 2429 2431 CONECT 2431 2430 2432 CONECT 2432 2431 2433 CONECT 2433 2432 2434 CONECT 2434 2429 2433 CONECT 2435 2428 CONECT 2436 2437 2438 CONECT 2437 2436 CONECT 2438 2436 2439 CONECT 2439 2438 2440 CONECT 2440 2439 2441 CONECT 2441 2440 2445 CONECT 2442 2443 CONECT 2443 2442 2444 CONECT 2444 2443 2445 CONECT 2445 2441 2444 CONECT 2446 2447 2448 CONECT 2447 2446 CONECT 2448 2446 2449 2450 CONECT 2449 2448 CONECT 2450 2448 2451 CONECT 2451 2450 CONECT 2452 2453 2454 2455 CONECT 2453 2452 CONECT 2454 2452 CONECT 2455 2452 CONECT 2456 2457 2458 CONECT 2457 2456 CONECT 2458 2456 2459 CONECT 2459 2458 2460 CONECT 2460 2459 2461 CONECT 2461 2460 2465 CONECT 2462 2463 CONECT 2463 2462 2464 CONECT 2464 2463 2465 CONECT 2465 2461 2464 END