USER MOD reduce.3.24.130724 H: found=0, std=0, add=2306, rem=0, adj=125 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE/HYDROLASE INHIBITOR 30-JUL-11 3T7Q TITLE ENDOTHIAPEPSIN IN COMPLEX WITH AN INHIBITOR BASED ON THE GEWALD TITLE 2 REACTION 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 3T7Q 0 JRNL AUTH H.KOESTER,A.HEINE,G.KLEBE JRNL TITL ENDOTHIAPEPSIN IN COMPLEX WITH AN INHIBITOR BASED ON THE JRNL TITL 2 GEWALD REACTION JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 1.30 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: 1.7_650) 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) : 1.30 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.45 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 94.2 REMARK 3 NUMBER OF REFLECTIONS : 75034 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.163 REMARK 3 R VALUE (WORKING SET) : 0.162 REMARK 3 FREE R VALUE : 0.174 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.120 REMARK 3 FREE R VALUE TEST SET COUNT : 3845 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 29.4538 - 3.8973 0.99 2834 166 0.1733 0.1798 REMARK 3 2 3.8973 - 3.0945 1.00 2832 141 0.1510 0.1432 REMARK 3 3 3.0945 - 2.7036 1.00 2810 150 0.1650 0.1675 REMARK 3 4 2.7036 - 2.4565 1.00 2809 146 0.1703 0.1732 REMARK 3 5 2.4565 - 2.2805 0.99 2773 159 0.1608 0.1930 REMARK 3 6 2.2805 - 2.1461 0.99 2780 170 0.1489 0.1438 REMARK 3 7 2.1461 - 2.0387 0.99 2776 143 0.1404 0.1711 REMARK 3 8 2.0387 - 1.9500 0.99 2818 136 0.1458 0.1582 REMARK 3 9 1.9500 - 1.8749 0.98 2729 152 0.1477 0.1697 REMARK 3 10 1.8749 - 1.8102 0.98 2767 147 0.1504 0.1698 REMARK 3 11 1.8102 - 1.7536 0.98 2736 136 0.1476 0.1511 REMARK 3 12 1.7536 - 1.7035 0.98 2754 146 0.1480 0.1613 REMARK 3 13 1.7035 - 1.6587 0.97 2701 142 0.1496 0.1750 REMARK 3 14 1.6587 - 1.6182 0.97 2684 158 0.1534 0.1770 REMARK 3 15 1.6182 - 1.5814 0.96 2704 150 0.1500 0.1743 REMARK 3 16 1.5814 - 1.5478 0.96 2661 154 0.1594 0.1893 REMARK 3 17 1.5478 - 1.5168 0.95 2664 136 0.1599 0.1809 REMARK 3 18 1.5168 - 1.4882 0.94 2650 139 0.1638 0.1812 REMARK 3 19 1.4882 - 1.4616 0.93 2559 149 0.1648 0.1882 REMARK 3 20 1.4616 - 1.4368 0.93 2640 133 0.1692 0.1803 REMARK 3 21 1.4368 - 1.4136 0.92 2565 137 0.1791 0.2018 REMARK 3 22 1.4136 - 1.3919 0.91 2562 113 0.1816 0.2103 REMARK 3 23 1.3919 - 1.3714 0.91 2543 137 0.1946 0.2269 REMARK 3 24 1.3714 - 1.3521 0.89 2445 153 0.2122 0.2399 REMARK 3 25 1.3521 - 1.3338 0.83 2327 123 0.2308 0.2477 REMARK 3 26 1.3338 - 1.3165 0.77 2140 126 0.2303 0.2436 REMARK 3 27 1.3165 - 1.3000 0.70 1926 103 0.2405 0.2700 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.20 REMARK 3 SHRINKAGE RADIUS : 0.95 REMARK 3 K_SOL : 0.37 REMARK 3 B_SOL : 59.01 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.120 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 16.690 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) : -1.05490 REMARK 3 B22 (A**2) : -0.33020 REMARK 3 B33 (A**2) : 1.38510 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -1.27170 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 2507 REMARK 3 ANGLE : 1.069 3443 REMARK 3 CHIRALITY : 0.069 408 REMARK 3 PLANARITY : 0.005 439 REMARK 3 DIHEDRAL : 10.872 821 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 3T7Q 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 RCSB067142. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 15-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 : 78609 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.300 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 : 3.300 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 6.30000 REMARK 200 FOR THE DATA SET : 20.9000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.30 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.32 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 2.40 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 41.60000 REMARK 200 FOR SHELL : 2.200 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 (%): 49.60 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.44 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M NH4AC, 0.1M ACETATE-BUFFER, 26% REMARK 280 PEG4000, 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 36.53500 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 ALA A 129 -168.53 -78.93 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 RB4 A 1001 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE RB4 A 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE DMS A 2001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE DMS A 4001 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 ACT A 1428 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3T6I RELATED DB: PDB REMARK 900 RELATED ID: 3T7P RELATED DB: PDB REMARK 900 RELATED ID: 3T7X RELATED DB: PDB DBREF 3T7Q 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 RB4 A1001 27 HET DMS A2001 4 HET DMS A4001 4 HET GOL A3002 6 HET ACT A1428 4 HETNAM RB4 ETHYL 2-({N-[2-(1H-INDOL-3-YL)ETHYL]GLYCYL}AMINO)-4- HETNAM 2 RB4 PHENYLTHIOPHENE-3-CARBOXYLATE HETNAM DMS DIMETHYL SULFOXIDE HETNAM GOL GLYCEROL HETNAM ACT ACETATE ION HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 2 RB4 C25 H25 N3 O3 S FORMUL 3 DMS 2(C2 H6 O S) FORMUL 5 GOL C3 H8 O3 FORMUL 6 ACT C2 H3 O2 1- FORMUL 7 HOH *420(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 GLU A 118 1 6 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 2.04 CISPEP 1 THR A 25 PRO A 26 0 -5.33 CISPEP 2 SER A 137 PRO A 138 0 6.81 SITE *** AC1 14 ASP A 33 ASP A 35 TYR A 79 GLY A 80 SITE *** AC1 14 ASP A 81 SER A 83 LEU A 125 GLY A 221 SITE *** AC1 14 THR A 222 TYR A 226 ILE A 300 HOH A 348 SITE *** AC1 14 HOH A 507 DMS A2001 SITE *** AC2 6 ASP A 81 GLY A 221 THR A 222 THR A 223 SITE *** AC2 6 HOH A 422 RB4 A1001 SITE *** AC3 4 SER A 233 ALA A 237 ALA A 242 HOH A 528 SITE *** AC4 7 VAL A 272 TYR A 277 ALA A 312 SER A 329 SITE *** AC4 7 LYS A 330 HOH A 465 HOH A 577 SITE *** AC5 5 GLY A 37 SER A 78 TYR A 79 HOH A 407 SITE *** AC5 5 HOH A 646 CRYST1 45.410 73.070 52.840 90.00 109.71 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 0.022022 0.000000 0.007889 0.00000 SCALE2 0.000000 0.013686 0.000000 0.00000 SCALE3 0.000000 0.000000 0.020103 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= 0.867 K(o=1.4,f=-0.65) USER MOD Set 1.2: A 324 THR OG1 : rot 180:sc= 0.503 USER MOD Set 2.1: A 297 SER OG : rot -178:sc= 1.59 USER MOD Set 2.2: A 303 ASN : amide:sc= 1.79 K(o=3.4,f=-2) USER MOD Set 3.1: A 245 SER OG : rot 140:sc= 0.241 USER MOD Set 3.2: A 247 SER OG : rot -9:sc= 1.04 USER MOD Set 4.1: A 223 THR OG1 : rot -81:sc= 1.29 USER MOD Set 4.2: A2001 DMS C1 :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 36 THR OG1 : rot 109:sc= 1.22 USER MOD Set 5.2: A 220 THR OG1 : rot 105:sc= 1.3 USER MOD Set 6.1: A 104 GLN : amide:sc= 0.061 K(o=3.4,f=-1.3!) USER MOD Set 6.2: A 147 ASN : amide:sc= 3.29 K(o=3.4,f=0.51) USER MOD Set 7.1: A 95 SER OG : rot 126:sc= 2.23 USER MOD Set 7.2: A 100 THR OG1 : rot -72:sc= 1.28 USER MOD Set 8.1: A 83 SER OG B: rot 110:sc= 1.53 USER MOD Set 8.2: A 115 SER OG : rot -175:sc= 2.15 USER MOD Set 9.1: A 25 THR OG1 : rot 93:sc= 1.78 USER MOD Set 9.2: A 64 SER OG : rot -164:sc= 1.19 USER MOD Set 9.3: A 66 THR OG1 : rot 84:sc= 1.96 USER MOD Set10.1: A 45 SER OG : rot -168:sc= 1.49 USER MOD Set10.2: A 48 THR OG1 : rot -29:sc= 1.42 USER MOD Set10.3: A 108 SER OG : rot -133:sc= 2.34 USER MOD Set11.1: A 22 GLN : amide:sc= 2.12 K(o=2.4,f=1.1) USER MOD Set11.2: A 29 THR OG1 : rot 170:sc= 0.317 USER MOD Set12.1: A 7 THR OG1 : rot 88:sc= -0.13 USER MOD Set12.2: A 19 THR OG1 : rot -159:sc= 1.25 USER MOD Set13.1: A 4 SER OG : rot 72:sc= 1.86 USER MOD Set13.2: A 170 ASN : amide:sc= 1.59 K(o=3.4,f=-1.1) USER MOD Single : A 1 SER N :NH3+ -166:sc= 2.42 (180deg=2.12) USER MOD Single : A 1 SER OG : rot -65:sc= 1.14 USER MOD Single : A 2 THR OG1 : rot 96:sc= 2.09 USER MOD Single : A 6 THR OG1 : rot -51:sc= 1.3 USER MOD Single : A 8 THR OG1 : rot 88:sc= 2.22 USER MOD Single : A 12 SER OG : rot -89:sc= 1.05 USER MOD Single : A 17 TYR OH : rot -15:sc= 1 USER MOD Single : A 28 GLN : amide:sc= 1.56 K(o=1.6,f=-5.2!) USER MOD Single : A 31 ASN : amide:sc= 1.68 K(o=1.7,f=0.4) USER MOD Single : A 38 SER OG : rot -109:sc= 2.38 USER MOD Single : A 39 SER OG : rot -163:sc= 0.574 USER MOD Single : A 46 SER OG : rot 171:sc= 0.362 USER MOD Single : A 49 THR OG1 : rot 73:sc= 1.7 USER MOD Single : A 51 SER OG : rot -113:sc= 0.0175 USER MOD Single : A 56 GLN : amide:sc= 1.32 K(o=1.3,f=-8.5!) USER MOD Single : A 57 THR OG1 : rot 132:sc= 2.31 USER MOD Single : A 59 TYR OH : rot -163:sc= 1.01 USER MOD Single : A 60 THR OG1 : rot 92:sc= 2.15 USER MOD Single : A 62 SER OG : rot -134:sc= 2.39 USER MOD Single : A 65 THR OG1 : rot 128:sc= 2.21 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 92:sc= 2.32 USER MOD Single : A 76 SER OG : rot 14:sc= 0.984 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot -178:sc= 0.785 USER MOD Single : A 83 SER OG A: rot 121:sc= 0.521 USER MOD Single : A 84 SER OG : rot -92:sc= 1.81 USER MOD Single : A 85 SER OG : rot -167:sc= 0.425 USER MOD Single : A 86 SER OG : rot 87:sc= 1.56 USER MOD Single : A 90 TYR OH : rot -178:sc= 0.946 USER MOD Single : A 91 THR OG1 : rot 160:sc= 2.09 USER MOD Single : A 93 THR OG1 : rot -162:sc= 2.08 USER MOD Single : A 102 THR OG1 : rot 17:sc= 0.896 USER MOD Single : A 110 LYS NZ :NH3+ 161:sc= 0.187 (180deg=0.0899) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 110:sc= 1.45 USER MOD Single : A 114 SER OG : rot 95:sc= 1.04 USER MOD Single : A 117 THR OG1 : rot -70:sc= 2.3 USER MOD Single : A 120 SER OG : rot -69:sc= 0 USER MOD Single : A 121 THR OG1 : rot -53:sc= 0.831 USER MOD Single : A 131 SER OG : rot 124:sc= 1.86 USER MOD Single : A 132 THR OG1 : rot -148:sc= 1.06 USER MOD Single : A 134 ASN : amide:sc= 1.19 K(o=1.2,f=-5.5!) USER MOD Single : A 135 THR OG1 : rot -67:sc= 0.897 USER MOD Single : A 137 SER OG : rot -91:sc= 0.852 USER MOD Single : A 139 THR OG1 : rot -79:sc= 0.728 USER MOD Single : A 140 GLN : amide:sc= 2.84 K(o=2.8,f=0.64) USER MOD Single : A 141 GLN : amide:sc= 2.38 K(o=2.4,f=-0.56) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot -168:sc= 1.46 USER MOD Single : A 151 SER OG : rot 79:sc= 1.02 USER MOD Single : A 154 SER OG : rot 76:sc= 0.777 USER MOD Single : A 158 THR OG1 : rot 92:sc= 2.15 USER MOD Single : A 163 TYR OH : rot -84:sc= 1.86 USER MOD Single : A 164 HIS : no HE2:sc= 0.304 X(o=0.3,f=0.005) USER MOD Single : A 168 THR OG1 : rot 93:sc= 2.97 USER MOD Single : A 169 TYR OH : rot -39:sc= 1.36 USER MOD Single : A 176 THR OG1 : rot 95:sc= 1.74 USER MOD Single : A 177 THR OG1 : rot -51:sc= 1.31 USER MOD Single : A 179 TYR OH : rot 171:sc= 1.39 USER MOD Single : A 180 THR OG1 : rot -157:sc= 1.79 USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD Single : A 184 THR OG1 : rot 110:sc= 2.53 USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD Single : A 186 THR OG1 : rot -83:sc= 2.96 USER MOD Single : A 189 SER OG : rot -156:sc= 1.33 USER MOD Single : A 190 THR OG1 : rot 85:sc= 2.02 USER MOD Single : A 192 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 78:sc= 0.278 USER MOD Single : A 199 SER OG : rot 51:sc= 1 USER MOD Single : A 200 THR OG1 : rot -171:sc= 0.954 USER MOD Single : A 202 TYR OH : rot 140:sc= 2.56 USER MOD Single : A 206 SER OG : rot 66:sc= 0.27 USER MOD Single : A 208 THR OG1 : rot 77:sc= 1.21 USER MOD Single : A 210 LYS NZ :NH3+ -132:sc= 0.0585 (180deg=0) USER MOD Single : A 211 SER OG A: rot 180:sc= 0 USER MOD Single : A 211 SER OG B: rot 34:sc= 0.0996 USER MOD Single : A 212 THR OG1 : rot -94:sc= 1.37 USER MOD Single : A 213 SER OG : rot 180:sc= 0 USER MOD Single : A 222 THR OG1 : rot 111:sc= 1.27 USER MOD Single : A 226 TYR OH : rot 15:sc= 2.2 USER MOD Single : A 230 THR OG1 : rot 173:sc= 1.34 USER MOD Single : A 233 SER OG : rot 29:sc= 1.04 USER MOD Single : A 235 TYR OH : rot 171:sc= 1.18 USER MOD Single : A 238 GLN : amide:sc= 1.21 K(o=1.2,f=-0.047) USER MOD Single : A 240 SER OG A: rot 109:sc= 0.00382 USER MOD Single : A 240 SER OG B: rot 180:sc= 0 USER MOD Single : A 244 SER OG : rot 123:sc= 2.29 USER MOD Single : A 246 SER OG : rot 4:sc= -0.0239 USER MOD Single : A 251 TYR OH : rot 141:sc= 2.63 USER MOD Single : A 256 SER OG : rot -102:sc= 1.3 USER MOD Single : A 258 THR OG1 : rot 101:sc= 1.32 USER MOD Single : A 261 SER OG : rot -161:sc= 2.13 USER MOD Single : A 263 THR OG1 : rot 175:sc= 2.09 USER MOD Single : A 268 SER OG : rot -8:sc= 1.53 USER MOD Single : A 277 TYR OH : rot 165:sc= 2.71 USER MOD Single : A 284 SER OG : rot 2:sc= 1.08 USER MOD Single : A 285 THR OG1 : rot 154:sc= 2.01 USER MOD Single : A 287 SER OG : rot 94:sc= 0.919 USER MOD Single : A 288 SER OG : rot -123:sc= 1.64 USER MOD Single : A 289 SER OG A: rot 65:sc= 1.46 USER MOD Single : A 289 SER OG B: rot -165:sc= 0.289 USER MOD Single : A 295 GLN : amide:sc= 2.5 K(o=2.5,f=-5.7!) USER MOD Single : A 296 SER OG : rot -173:sc= 1.26 USER MOD Single : A 311 LYS NZ :NH3+ 178:sc= 2.45 (180deg=2.44) USER MOD Single : A 321 THR OG1 : rot 180:sc= 0 USER MOD Single : A 322 THR OG1 : rot 97:sc= 0.559 USER MOD Single : A 329 SER OG : rot 77:sc= 1.96 USER MOD Single : A 330 LYS NZ :NH3+ -164:sc= 2.75 (180deg=2.32) USER MOD Single : A2001 DMS C2 :methyl 174:sc= 0 (180deg=-0.00659) USER MOD Single : A3002 GOL O1 : rot 65:sc= 2.04 USER MOD Single : A3002 GOL O2 : rot -133:sc= 1.77 USER MOD Single : A3002 GOL O3 : rot -34:sc= 1.01 USER MOD Single : A4001 DMS C1 :methyl -167:sc= -0.0683 (180deg=-0.149) USER MOD Single : A4001 DMS C2 :methyl -146:sc= -6.87! (180deg=-9.07!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 23.932 -12.592 11.427 1.00 12.27 N ATOM 2 CA SER A 1 22.641 -13.262 11.327 1.00 10.48 C ATOM 3 C SER A 1 21.776 -12.620 10.251 1.00 11.14 C ATOM 4 O SER A 1 22.036 -11.499 9.826 1.00 10.56 O ATOM 5 CB SER A 1 21.905 -13.191 12.661 1.00 12.01 C ATOM 6 OG SER A 1 21.649 -11.846 13.021 1.00 16.86 O ATOM 0 H1 SER A 1 24.491 -13.094 11.904 1.00 12.27 H new ATOM 0 H2 SER A 1 24.267 -12.469 10.612 1.00 12.27 H new ATOM 0 H3 SER A 1 23.827 -11.804 11.826 1.00 12.27 H new ATOM 0 HA SER A 1 22.806 -14.188 11.091 1.00 10.48 H new ATOM 0 HB2 SER A 1 21.069 -13.679 12.601 1.00 12.01 H new ATOM 0 HB3 SER A 1 22.435 -13.620 13.351 1.00 12.01 H new ATOM 0 HG SER A 1 22.377 -11.449 13.158 1.00 16.86 H new ATOM 7 N THR A 2 20.744 -13.343 9.829 1.00 9.11 N ATOM 8 CA THR A 2 19.733 -12.814 8.916 1.00 8.69 C ATOM 9 C THR A 2 18.366 -13.367 9.297 1.00 9.15 C ATOM 10 O THR A 2 18.259 -14.307 10.086 1.00 9.57 O ATOM 11 CB THR A 2 20.003 -13.210 7.456 1.00 9.68 C ATOM 12 OG1 THR A 2 19.938 -14.635 7.332 1.00 11.48 O ATOM 13 CG2 THR A 2 21.375 -12.712 6.988 1.00 11.10 C ATOM 0 H THR A 2 20.609 -14.159 10.065 1.00 9.11 H new ATOM 0 HA THR A 2 19.763 -11.847 8.990 1.00 8.69 H new ATOM 0 HB THR A 2 19.327 -12.796 6.896 1.00 9.68 H new ATOM 0 HG1 THR A 2 19.170 -14.859 7.076 1.00 11.48 H new ATOM 0 HG21 THR A 2 21.518 -12.976 6.066 1.00 11.10 H new ATOM 0 HG22 THR A 2 21.409 -11.745 7.056 1.00 11.10 H new ATOM 0 HG23 THR A 2 22.068 -13.100 7.546 1.00 11.10 H new ATOM 14 N GLY A 3 17.318 -12.774 8.736 1.00 8.34 N ATOM 15 CA GLY A 3 15.978 -13.334 8.811 1.00 8.60 C ATOM 16 C GLY A 3 15.261 -13.100 7.496 1.00 8.71 C ATOM 17 O GLY A 3 15.619 -12.200 6.731 1.00 8.03 O ATOM 0 H GLY A 3 17.366 -12.034 8.301 1.00 8.34 H new ATOM 0 HA2 GLY A 3 16.024 -14.284 9.001 1.00 8.60 H new ATOM 0 HA3 GLY A 3 15.485 -12.922 9.538 1.00 8.60 H new ATOM 18 N SER A 4 14.260 -13.926 7.219 1.00 7.92 N ATOM 19 CA SER A 4 13.485 -13.827 5.990 1.00 8.32 C ATOM 20 C SER A 4 12.089 -14.345 6.263 1.00 8.16 C ATOM 21 O SER A 4 11.927 -15.493 6.676 1.00 9.04 O ATOM 22 CB SER A 4 14.148 -14.647 4.880 1.00 8.92 C ATOM 23 OG SER A 4 13.422 -14.555 3.658 1.00 10.64 O ATOM 0 H SER A 4 14.010 -14.562 7.741 1.00 7.92 H new ATOM 0 HA SER A 4 13.443 -12.903 5.698 1.00 8.32 H new ATOM 0 HB2 SER A 4 15.056 -14.334 4.743 1.00 8.92 H new ATOM 0 HB3 SER A 4 14.207 -15.576 5.154 1.00 8.92 H new ATOM 0 HG SER A 4 13.530 -13.792 3.325 1.00 10.64 H new ATOM 24 N ALA A 5 11.079 -13.506 6.046 1.00 6.66 N ATOM 25 CA ALA A 5 9.708 -13.908 6.314 1.00 8.88 C ATOM 26 C ALA A 5 8.812 -13.481 5.170 1.00 7.22 C ATOM 27 O ALA A 5 8.985 -12.406 4.586 1.00 7.98 O ATOM 28 CB ALA A 5 9.211 -13.301 7.621 1.00 9.45 C ATOM 0 H ALA A 5 11.168 -12.705 5.746 1.00 6.66 H new ATOM 0 HA ALA A 5 9.682 -14.874 6.397 1.00 8.88 H new ATOM 0 HB1 ALA A 5 8.296 -13.581 7.781 1.00 9.45 H new ATOM 0 HB2 ALA A 5 9.773 -13.602 8.352 1.00 9.45 H new ATOM 0 HB3 ALA A 5 9.247 -12.333 7.563 1.00 9.45 H new ATOM 29 N THR A 6 7.836 -14.320 4.862 1.00 7.25 N ATOM 30 CA THR A 6 6.841 -14.005 3.853 1.00 7.65 C ATOM 31 C THR A 6 5.785 -13.073 4.428 1.00 8.01 C ATOM 32 O THR A 6 5.345 -13.252 5.572 1.00 8.31 O ATOM 33 CB THR A 6 6.179 -15.292 3.353 1.00 7.18 C ATOM 34 OG1 THR A 6 7.181 -16.094 2.729 1.00 8.64 O ATOM 35 CG2 THR A 6 5.047 -15.000 2.382 1.00 8.78 C ATOM 0 H THR A 6 7.732 -15.089 5.233 1.00 7.25 H new ATOM 0 HA THR A 6 7.280 -13.562 3.110 1.00 7.65 H new ATOM 0 HB THR A 6 5.788 -15.764 4.105 1.00 7.18 H new ATOM 0 HG1 THR A 6 7.598 -15.633 2.164 1.00 8.64 H new ATOM 0 HG21 THR A 6 4.651 -15.835 2.086 1.00 8.78 H new ATOM 0 HG22 THR A 6 4.372 -14.461 2.824 1.00 8.78 H new ATOM 0 HG23 THR A 6 5.394 -14.518 1.615 1.00 8.78 H new ATOM 36 N THR A 7 5.396 -12.070 3.638 1.00 6.58 N ATOM 37 CA THR A 7 4.332 -11.148 4.010 1.00 7.67 C ATOM 38 C THR A 7 3.164 -11.320 3.035 1.00 7.58 C ATOM 39 O THR A 7 3.379 -11.475 1.831 1.00 8.59 O ATOM 40 CB THR A 7 4.841 -9.686 4.076 1.00 7.37 C ATOM 41 OG1 THR A 7 3.842 -8.860 4.680 1.00 9.32 O ATOM 42 CG2 THR A 7 5.181 -9.135 2.701 1.00 9.79 C ATOM 0 H THR A 7 5.746 -11.908 2.869 1.00 6.58 H new ATOM 0 HA THR A 7 4.020 -11.357 4.904 1.00 7.67 H new ATOM 0 HB THR A 7 5.653 -9.683 4.607 1.00 7.37 H new ATOM 0 HG1 THR A 7 3.944 -8.860 5.514 1.00 9.32 H new ATOM 0 HG21 THR A 7 5.494 -8.221 2.787 1.00 9.79 H new ATOM 0 HG22 THR A 7 5.876 -9.678 2.297 1.00 9.79 H new ATOM 0 HG23 THR A 7 4.390 -9.154 2.140 1.00 9.79 H new ATOM 43 N THR A 8 1.942 -11.317 3.560 1.00 7.64 N ATOM 44 CA THR A 8 0.769 -11.759 2.800 1.00 8.07 C ATOM 45 C THR A 8 -0.327 -10.696 2.866 1.00 8.43 C ATOM 46 O THR A 8 -0.646 -10.216 3.953 1.00 8.49 O ATOM 47 CB THR A 8 0.224 -13.066 3.406 1.00 8.86 C ATOM 48 OG1 THR A 8 1.245 -14.077 3.367 1.00 10.83 O ATOM 49 CG2 THR A 8 -0.993 -13.559 2.638 1.00 12.53 C ATOM 0 H THR A 8 1.767 -11.061 4.362 1.00 7.64 H new ATOM 0 HA THR A 8 1.031 -11.903 1.877 1.00 8.07 H new ATOM 0 HB THR A 8 -0.038 -12.889 4.323 1.00 8.86 H new ATOM 0 HG1 THR A 8 1.718 -14.025 4.060 1.00 10.83 H new ATOM 0 HG21 THR A 8 -1.317 -14.381 3.038 1.00 12.53 H new ATOM 0 HG22 THR A 8 -1.691 -12.887 2.672 1.00 12.53 H new ATOM 0 HG23 THR A 8 -0.748 -13.724 1.714 1.00 12.53 H new ATOM 50 N PRO A 9 -0.913 -10.310 1.711 1.00 8.07 N ATOM 51 CA PRO A 9 -2.020 -9.345 1.783 1.00 8.68 C ATOM 52 C PRO A 9 -3.190 -9.881 2.615 1.00 8.84 C ATOM 53 O PRO A 9 -3.498 -11.069 2.566 1.00 9.80 O ATOM 54 CB PRO A 9 -2.439 -9.149 0.317 1.00 8.92 C ATOM 55 CG PRO A 9 -1.763 -10.231 -0.454 1.00 15.83 C ATOM 56 CD PRO A 9 -0.585 -10.709 0.330 1.00 9.66 C ATOM 0 HA PRO A 9 -1.754 -8.519 2.215 1.00 8.68 H new ATOM 0 HB2 PRO A 9 -3.403 -9.205 0.221 1.00 8.92 H new ATOM 0 HB3 PRO A 9 -2.172 -8.274 -0.006 1.00 8.92 H new ATOM 0 HG2 PRO A 9 -2.378 -10.963 -0.617 1.00 15.83 H new ATOM 0 HG3 PRO A 9 -1.479 -9.900 -1.321 1.00 15.83 H new ATOM 0 HD2 PRO A 9 -0.469 -11.669 0.253 1.00 9.66 H new ATOM 0 HD3 PRO A 9 0.239 -10.298 0.025 1.00 9.66 H new ATOM 57 N ILE A 10 -3.834 -9.006 3.380 1.00 9.09 N ATOM 58 CA ILE A 10 -4.929 -9.439 4.247 1.00 9.51 C ATOM 59 C ILE A 10 -6.246 -9.642 3.504 1.00 10.27 C ATOM 60 O ILE A 10 -7.169 -10.274 4.025 1.00 12.72 O ATOM 61 CB ILE A 10 -5.173 -8.459 5.399 1.00 10.08 C ATOM 62 CG1 ILE A 10 -5.645 -7.099 4.866 1.00 10.22 C ATOM 63 CG2 ILE A 10 -3.919 -8.319 6.243 1.00 10.11 C ATOM 64 CD1 ILE A 10 -6.241 -6.194 5.943 1.00 11.86 C ATOM 0 H ILE A 10 -3.656 -8.165 3.413 1.00 9.09 H new ATOM 0 HA ILE A 10 -4.637 -10.295 4.597 1.00 9.51 H new ATOM 0 HB ILE A 10 -5.878 -8.811 5.964 1.00 10.08 H new ATOM 0 HG12 ILE A 10 -4.895 -6.645 4.451 1.00 10.22 H new ATOM 0 HG13 ILE A 10 -6.308 -7.244 4.173 1.00 10.22 H new ATOM 0 HG21 ILE A 10 -4.085 -7.697 6.969 1.00 10.11 H new ATOM 0 HG22 ILE A 10 -3.676 -9.184 6.609 1.00 10.11 H new ATOM 0 HG23 ILE A 10 -3.193 -7.986 5.692 1.00 10.11 H new ATOM 0 HD11 ILE A 10 -6.518 -5.355 5.544 1.00 11.86 H new ATOM 0 HD12 ILE A 10 -7.009 -6.630 6.344 1.00 11.86 H new ATOM 0 HD13 ILE A 10 -5.574 -6.022 6.626 1.00 11.86 H new ATOM 65 N ASP A 11 -6.337 -9.117 2.286 1.00 9.13 N ATOM 66 CA ASP A 11 -7.571 -9.212 1.508 1.00 9.80 C ATOM 67 C ASP A 11 -7.260 -9.036 0.027 1.00 10.40 C ATOM 68 O ASP A 11 -6.096 -8.853 -0.351 1.00 9.96 O ATOM 69 CB ASP A 11 -8.639 -8.228 2.014 1.00 11.00 C ATOM 70 CG ASP A 11 -8.233 -6.768 1.865 1.00 12.51 C ATOM 71 OD1 ASP A 11 -8.782 -5.925 2.617 1.00 13.90 O ATOM 72 OD2 ASP A 11 -7.376 -6.452 1.006 1.00 12.29 O ATOM 0 H ASP A 11 -5.696 -8.701 1.891 1.00 9.13 H new ATOM 0 HA ASP A 11 -7.952 -10.096 1.627 1.00 9.80 H new ATOM 0 HB2 ASP A 11 -9.465 -8.379 1.528 1.00 11.00 H new ATOM 0 HB3 ASP A 11 -8.823 -8.412 2.948 1.00 11.00 H new ATOM 73 N SER A 12 -8.294 -9.092 -0.812 1.00 10.99 N ATOM 74 CA SER A 12 -8.132 -9.075 -2.262 1.00 11.57 C ATOM 75 C SER A 12 -7.678 -7.728 -2.828 1.00 12.77 C ATOM 76 O SER A 12 -7.352 -7.634 -4.015 1.00 15.28 O ATOM 77 CB SER A 12 -9.437 -9.491 -2.945 1.00 13.72 C ATOM 78 OG SER A 12 -10.446 -8.538 -2.679 1.00 16.43 O ATOM 0 H SER A 12 -9.113 -9.141 -0.553 1.00 10.99 H new ATOM 0 HA SER A 12 -7.423 -9.710 -2.451 1.00 11.57 H new ATOM 0 HB2 SER A 12 -9.299 -9.569 -3.902 1.00 13.72 H new ATOM 0 HB3 SER A 12 -9.714 -10.364 -2.626 1.00 13.72 H new ATOM 0 HG SER A 12 -10.851 -8.748 -1.973 1.00 16.43 H new ATOM 79 N LEU A 13 -7.654 -6.699 -1.988 1.00 10.29 N ATOM 80 CA LEU A 13 -7.290 -5.353 -2.422 1.00 11.19 C ATOM 81 C LEU A 13 -5.895 -4.937 -1.954 1.00 11.38 C ATOM 82 O LEU A 13 -5.468 -3.817 -2.215 1.00 11.64 O ATOM 83 CB LEU A 13 -8.296 -4.341 -1.876 1.00 13.99 C ATOM 84 CG LEU A 13 -9.767 -4.458 -2.264 1.00 15.94 C ATOM 85 CD1 LEU A 13 -10.556 -3.379 -1.547 1.00 18.78 C ATOM 86 CD2 LEU A 13 -9.924 -4.334 -3.771 1.00 15.79 C ATOM 0 H LEU A 13 -7.848 -6.760 -1.152 1.00 10.29 H new ATOM 0 HA LEU A 13 -7.295 -5.366 -3.392 1.00 11.19 H new ATOM 0 HB2 LEU A 13 -8.247 -4.376 -0.908 1.00 13.99 H new ATOM 0 HB3 LEU A 13 -7.994 -3.459 -2.143 1.00 13.99 H new ATOM 0 HG LEU A 13 -10.107 -5.327 -2.000 1.00 15.94 H new ATOM 0 HD11 LEU A 13 -11.493 -3.448 -1.789 1.00 18.78 H new ATOM 0 HD12 LEU A 13 -10.461 -3.492 -0.588 1.00 18.78 H new ATOM 0 HD13 LEU A 13 -10.219 -2.507 -1.804 1.00 18.78 H new ATOM 0 HD21 LEU A 13 -10.862 -4.410 -4.006 1.00 15.79 H new ATOM 0 HD22 LEU A 13 -9.587 -3.472 -4.062 1.00 15.79 H new ATOM 0 HD23 LEU A 13 -9.424 -5.041 -4.208 1.00 15.79 H new ATOM 87 N ASP A 14 -5.185 -5.821 -1.258 1.00 9.77 N ATOM 88 CA ASP A 14 -3.902 -5.465 -0.635 1.00 10.15 C ATOM 89 C ASP A 14 -4.073 -4.295 0.345 1.00 9.81 C ATOM 90 O ASP A 14 -3.269 -3.365 0.358 1.00 10.82 O ATOM 91 CB ASP A 14 -2.838 -5.077 -1.678 1.00 10.22 C ATOM 92 CG ASP A 14 -2.498 -6.192 -2.644 1.00 10.53 C ATOM 93 OD1 ASP A 14 -2.871 -7.356 -2.402 1.00 11.78 O ATOM 94 OD2 ASP A 14 -1.830 -5.898 -3.657 1.00 10.59 O ATOM 0 H ASP A 14 -5.426 -6.637 -1.132 1.00 9.77 H new ATOM 0 HA ASP A 14 -3.602 -6.256 -0.160 1.00 10.15 H new ATOM 0 HB2 ASP A 14 -3.154 -4.310 -2.180 1.00 10.22 H new ATOM 0 HB3 ASP A 14 -2.030 -4.801 -1.217 1.00 10.22 H new ATOM 95 N ASP A 15 -5.122 -4.322 1.154 1.00 10.16 N ATOM 96 CA ASP A 15 -5.342 -3.223 2.087 1.00 9.77 C ATOM 97 C ASP A 15 -4.223 -3.106 3.123 1.00 12.25 C ATOM 98 O ASP A 15 -3.908 -2.015 3.608 1.00 13.83 O ATOM 99 CB ASP A 15 -6.709 -3.335 2.762 1.00 13.78 C ATOM 100 CG ASP A 15 -7.836 -2.835 1.873 1.00 17.40 C ATOM 101 OD1 ASP A 15 -7.672 -1.766 1.241 1.00 18.08 O ATOM 102 OD2 ASP A 15 -8.882 -3.514 1.794 1.00 15.44 O ATOM 0 H ASP A 15 -5.708 -4.951 1.181 1.00 10.16 H new ATOM 0 HA ASP A 15 -5.329 -2.406 1.565 1.00 9.77 H new ATOM 0 HB2 ASP A 15 -6.875 -4.261 3.000 1.00 13.78 H new ATOM 0 HB3 ASP A 15 -6.702 -2.826 3.588 1.00 13.78 H new ATOM 103 N ALA A 16 -3.617 -4.239 3.446 1.00 9.70 N ATOM 104 CA ALA A 16 -2.463 -4.278 4.330 1.00 10.91 C ATOM 105 C ALA A 16 -1.813 -5.628 4.159 1.00 8.45 C ATOM 106 O ALA A 16 -2.357 -6.504 3.488 1.00 9.91 O ATOM 107 CB ALA A 16 -2.868 -4.047 5.789 1.00 11.11 C ATOM 0 H ALA A 16 -3.865 -5.010 3.157 1.00 9.70 H new ATOM 0 HA ALA A 16 -1.843 -3.568 4.101 1.00 10.91 H new ATOM 0 HB1 ALA A 16 -2.079 -4.079 6.353 1.00 11.11 H new ATOM 0 HB2 ALA A 16 -3.291 -3.178 5.874 1.00 11.11 H new ATOM 0 HB3 ALA A 16 -3.490 -4.738 6.065 1.00 11.11 H new ATOM 108 N TYR A 17 -0.647 -5.798 4.768 1.00 8.28 N ATOM 109 CA TYR A 17 0.111 -7.036 4.673 1.00 9.23 C ATOM 110 C TYR A 17 0.427 -7.533 6.074 1.00 7.91 C ATOM 111 O TYR A 17 0.756 -6.733 6.956 1.00 9.00 O ATOM 112 CB TYR A 17 1.412 -6.803 3.901 1.00 10.04 C ATOM 113 CG TYR A 17 1.196 -6.386 2.465 1.00 8.60 C ATOM 114 CD1 TYR A 17 1.323 -7.302 1.431 1.00 9.94 C ATOM 115 CD2 TYR A 17 0.872 -5.078 2.145 1.00 9.91 C ATOM 116 CE1 TYR A 17 1.120 -6.923 0.103 1.00 9.73 C ATOM 117 CE2 TYR A 17 0.663 -4.691 0.828 1.00 9.95 C ATOM 118 CZ TYR A 17 0.798 -5.615 -0.183 1.00 8.97 C ATOM 119 OH TYR A 17 0.590 -5.227 -1.492 1.00 9.83 O ATOM 0 H TYR A 17 -0.271 -5.194 5.251 1.00 8.28 H new ATOM 0 HA TYR A 17 -0.415 -7.699 4.200 1.00 9.23 H new ATOM 0 HB2 TYR A 17 1.930 -6.120 4.354 1.00 10.04 H new ATOM 0 HB3 TYR A 17 1.940 -7.617 3.918 1.00 10.04 H new ATOM 0 HD1 TYR A 17 1.547 -8.183 1.626 1.00 9.94 H new ATOM 0 HD2 TYR A 17 0.793 -4.448 2.824 1.00 9.91 H new ATOM 0 HE1 TYR A 17 1.201 -7.547 -0.581 1.00 9.73 H new ATOM 0 HE2 TYR A 17 0.433 -3.812 0.630 1.00 9.95 H new ATOM 0 HH TYR A 17 0.888 -5.817 -2.010 1.00 9.83 H new ATOM 120 N ILE A 18 0.335 -8.844 6.277 1.00 7.51 N ATOM 121 CA ILE A 18 0.665 -9.446 7.567 1.00 8.07 C ATOM 122 C ILE A 18 1.818 -10.425 7.458 1.00 7.01 C ATOM 123 O ILE A 18 1.948 -11.154 6.468 1.00 8.65 O ATOM 124 CB ILE A 18 -0.538 -10.150 8.229 1.00 6.98 C ATOM 125 CG1 ILE A 18 -1.274 -11.076 7.252 1.00 8.81 C ATOM 126 CG2 ILE A 18 -1.473 -9.114 8.810 1.00 9.27 C ATOM 127 CD1 ILE A 18 -2.342 -11.927 7.939 1.00 9.71 C ATOM 0 H ILE A 18 0.082 -9.406 5.677 1.00 7.51 H new ATOM 0 HA ILE A 18 0.929 -8.704 8.133 1.00 8.07 H new ATOM 0 HB ILE A 18 -0.204 -10.714 8.944 1.00 6.98 H new ATOM 0 HG12 ILE A 18 -1.689 -10.542 6.556 1.00 8.81 H new ATOM 0 HG13 ILE A 18 -0.631 -11.658 6.818 1.00 8.81 H new ATOM 0 HG21 ILE A 18 -2.229 -9.557 9.226 1.00 9.27 H new ATOM 0 HG22 ILE A 18 -1.001 -8.588 9.475 1.00 9.27 H new ATOM 0 HG23 ILE A 18 -1.790 -8.531 8.103 1.00 9.27 H new ATOM 0 HD11 ILE A 18 -2.777 -12.493 7.282 1.00 9.71 H new ATOM 0 HD12 ILE A 18 -1.927 -12.481 8.618 1.00 9.71 H new ATOM 0 HD13 ILE A 18 -3.001 -11.348 8.353 1.00 9.71 H new ATOM 128 N THR A 19 2.643 -10.440 8.499 1.00 6.71 N ATOM 129 CA THR A 19 3.861 -11.235 8.546 1.00 6.97 C ATOM 130 C THR A 19 3.868 -11.981 9.871 1.00 7.42 C ATOM 131 O THR A 19 3.648 -11.371 10.912 1.00 7.97 O ATOM 132 CB THR A 19 5.094 -10.316 8.451 1.00 7.58 C ATOM 133 OG1 THR A 19 4.964 -9.471 7.298 1.00 7.86 O ATOM 134 CG2 THR A 19 6.378 -11.127 8.338 1.00 9.15 C ATOM 0 H THR A 19 2.506 -9.978 9.212 1.00 6.71 H new ATOM 0 HA THR A 19 3.892 -11.858 7.803 1.00 6.97 H new ATOM 0 HB THR A 19 5.141 -9.781 9.259 1.00 7.58 H new ATOM 0 HG1 THR A 19 5.720 -9.180 7.077 1.00 7.86 H new ATOM 0 HG21 THR A 19 7.137 -10.526 8.280 1.00 9.15 H new ATOM 0 HG22 THR A 19 6.474 -11.693 9.120 1.00 9.15 H new ATOM 0 HG23 THR A 19 6.343 -11.680 7.542 1.00 9.15 H new ATOM 135 N PRO A 20 4.094 -13.307 9.843 1.00 7.37 N ATOM 136 CA PRO A 20 4.084 -14.055 11.106 1.00 6.74 C ATOM 137 C PRO A 20 5.315 -13.722 11.942 1.00 6.87 C ATOM 138 O PRO A 20 6.427 -13.610 11.408 1.00 7.19 O ATOM 139 CB PRO A 20 4.120 -15.519 10.652 1.00 8.28 C ATOM 140 CG PRO A 20 4.799 -15.475 9.324 1.00 8.01 C ATOM 141 CD PRO A 20 4.359 -14.179 8.682 1.00 7.99 C ATOM 0 HA PRO A 20 3.317 -13.847 11.663 1.00 6.74 H new ATOM 0 HB2 PRO A 20 4.608 -16.073 11.281 1.00 8.28 H new ATOM 0 HB3 PRO A 20 3.227 -15.890 10.581 1.00 8.28 H new ATOM 0 HG2 PRO A 20 5.763 -15.504 9.425 1.00 8.01 H new ATOM 0 HG3 PRO A 20 4.548 -16.237 8.779 1.00 8.01 H new ATOM 0 HD2 PRO A 20 5.048 -13.811 8.106 1.00 7.99 H new ATOM 0 HD3 PRO A 20 3.567 -14.300 8.135 1.00 7.99 H new ATOM 142 N VAL A 21 5.090 -13.564 13.246 1.00 7.38 N ATOM 143 CA VAL A 21 6.114 -13.200 14.211 1.00 7.87 C ATOM 144 C VAL A 21 5.973 -14.115 15.419 1.00 7.38 C ATOM 145 O VAL A 21 4.866 -14.288 15.951 1.00 7.73 O ATOM 146 CB VAL A 21 5.934 -11.735 14.660 1.00 6.63 C ATOM 147 CG1 VAL A 21 6.954 -11.365 15.733 1.00 9.41 C ATOM 148 CG2 VAL A 21 6.046 -10.802 13.456 1.00 8.57 C ATOM 0 H VAL A 21 4.313 -13.670 13.599 1.00 7.38 H new ATOM 0 HA VAL A 21 6.991 -13.294 13.807 1.00 7.87 H new ATOM 0 HB VAL A 21 5.050 -11.636 15.047 1.00 6.63 H new ATOM 0 HG11 VAL A 21 6.823 -10.442 16.000 1.00 9.41 H new ATOM 0 HG12 VAL A 21 6.838 -11.943 16.503 1.00 9.41 H new ATOM 0 HG13 VAL A 21 7.850 -11.474 15.379 1.00 9.41 H new ATOM 0 HG21 VAL A 21 5.932 -9.884 13.746 1.00 8.57 H new ATOM 0 HG22 VAL A 21 6.919 -10.905 13.047 1.00 8.57 H new ATOM 0 HG23 VAL A 21 5.358 -11.024 12.809 1.00 8.57 H new ATOM 149 N GLN A 22 7.088 -14.708 15.839 1.00 6.62 N ATOM 150 CA GLN A 22 7.099 -15.572 17.019 1.00 6.92 C ATOM 151 C GLN A 22 7.434 -14.769 18.264 1.00 7.84 C ATOM 152 O GLN A 22 8.475 -14.110 18.311 1.00 9.07 O ATOM 153 CB GLN A 22 8.112 -16.705 16.844 1.00 8.16 C ATOM 154 CG GLN A 22 7.627 -17.847 15.940 1.00 8.28 C ATOM 155 CD GLN A 22 7.491 -17.465 14.478 1.00 7.66 C ATOM 156 OE1 GLN A 22 8.399 -16.886 13.885 1.00 8.09 O ATOM 157 NE2 GLN A 22 6.354 -17.803 13.888 1.00 8.15 N ATOM 0 H GLN A 22 7.852 -14.623 15.453 1.00 6.62 H new ATOM 0 HA GLN A 22 6.214 -15.955 17.122 1.00 6.92 H new ATOM 0 HB2 GLN A 22 8.931 -16.339 16.475 1.00 8.16 H new ATOM 0 HB3 GLN A 22 8.331 -17.067 17.717 1.00 8.16 H new ATOM 0 HG2 GLN A 22 8.246 -18.590 16.014 1.00 8.28 H new ATOM 0 HG3 GLN A 22 6.768 -18.160 16.264 1.00 8.28 H new ATOM 0 HE21 GLN A 22 5.741 -18.208 14.335 1.00 8.15 H new ATOM 0 HE22 GLN A 22 6.229 -17.618 13.058 1.00 8.15 H new ATOM 158 N ILE A 23 6.561 -14.828 19.264 1.00 8.42 N ATOM 159 CA ILE A 23 6.787 -14.100 20.511 1.00 8.87 C ATOM 160 C ILE A 23 6.742 -15.054 21.695 1.00 8.60 C ATOM 161 O ILE A 23 5.803 -15.828 21.833 1.00 9.59 O ATOM 162 CB ILE A 23 5.726 -13.002 20.720 1.00 9.42 C ATOM 163 CG1 ILE A 23 5.615 -12.137 19.463 1.00 8.15 C ATOM 164 CG2 ILE A 23 6.036 -12.159 21.971 1.00 10.66 C ATOM 165 CD1 ILE A 23 4.515 -11.086 19.540 1.00 11.25 C ATOM 0 H ILE A 23 5.832 -15.283 19.242 1.00 8.42 H new ATOM 0 HA ILE A 23 7.662 -13.686 20.450 1.00 8.87 H new ATOM 0 HB ILE A 23 4.866 -13.423 20.873 1.00 9.42 H new ATOM 0 HG12 ILE A 23 6.464 -11.695 19.308 1.00 8.15 H new ATOM 0 HG13 ILE A 23 5.451 -12.711 18.698 1.00 8.15 H new ATOM 0 HG21 ILE A 23 5.355 -11.477 22.079 1.00 10.66 H new ATOM 0 HG22 ILE A 23 6.046 -12.732 22.753 1.00 10.66 H new ATOM 0 HG23 ILE A 23 6.903 -11.736 21.870 1.00 10.66 H new ATOM 0 HD11 ILE A 23 4.498 -10.574 18.716 1.00 11.25 H new ATOM 0 HD12 ILE A 23 3.658 -11.523 19.667 1.00 11.25 H new ATOM 0 HD13 ILE A 23 4.688 -10.491 20.286 1.00 11.25 H new ATOM 166 N GLY A 24 7.749 -14.997 22.558 1.00 9.74 N ATOM 167 CA GLY A 24 7.708 -15.768 23.789 1.00 10.09 C ATOM 168 C GLY A 24 8.223 -17.195 23.718 1.00 11.17 C ATOM 169 O GLY A 24 8.678 -17.671 22.677 1.00 11.22 O ATOM 0 H GLY A 24 8.458 -14.522 22.450 1.00 9.74 H new ATOM 0 HA2 GLY A 24 8.223 -15.294 24.461 1.00 10.09 H new ATOM 0 HA3 GLY A 24 6.790 -15.793 24.100 1.00 10.09 H new ATOM 170 N THR A 25 8.148 -17.880 24.860 1.00 10.75 N ATOM 171 CA THR A 25 8.629 -19.249 25.007 1.00 11.37 C ATOM 172 C THR A 25 7.610 -20.044 25.821 1.00 12.78 C ATOM 173 O THR A 25 7.340 -19.703 26.970 1.00 13.01 O ATOM 174 CB THR A 25 9.968 -19.271 25.768 1.00 12.84 C ATOM 175 OG1 THR A 25 10.898 -18.370 25.151 1.00 12.77 O ATOM 176 CG2 THR A 25 10.555 -20.674 25.776 1.00 14.40 C ATOM 0 H THR A 25 7.810 -17.555 25.581 1.00 10.75 H new ATOM 0 HA THR A 25 8.751 -19.634 24.125 1.00 11.37 H new ATOM 0 HB THR A 25 9.804 -18.992 26.682 1.00 12.84 H new ATOM 0 HG1 THR A 25 10.854 -17.620 25.528 1.00 12.77 H new ATOM 0 HG21 THR A 25 11.397 -20.670 26.258 1.00 14.40 H new ATOM 0 HG22 THR A 25 9.936 -21.281 26.211 1.00 14.40 H new ATOM 0 HG23 THR A 25 10.707 -20.967 24.864 1.00 14.40 H new ATOM 177 N PRO A 26 7.001 -21.080 25.226 1.00 11.77 N ATOM 178 CA PRO A 26 7.122 -21.485 23.822 1.00 10.86 C ATOM 179 C PRO A 26 6.569 -20.393 22.911 1.00 10.42 C ATOM 180 O PRO A 26 5.838 -19.504 23.370 1.00 11.22 O ATOM 181 CB PRO A 26 6.263 -22.751 23.748 1.00 14.83 C ATOM 182 CG PRO A 26 5.277 -22.596 24.851 1.00 14.75 C ATOM 183 CD PRO A 26 6.012 -21.894 25.951 1.00 12.79 C ATOM 0 HA PRO A 26 8.037 -21.635 23.538 1.00 10.86 H new ATOM 0 HB2 PRO A 26 5.822 -22.829 22.888 1.00 14.83 H new ATOM 0 HB3 PRO A 26 6.801 -23.550 23.864 1.00 14.83 H new ATOM 0 HG2 PRO A 26 4.508 -22.081 24.561 1.00 14.75 H new ATOM 0 HG3 PRO A 26 4.946 -23.458 25.147 1.00 14.75 H new ATOM 0 HD2 PRO A 26 5.418 -21.344 26.486 1.00 12.79 H new ATOM 0 HD3 PRO A 26 6.438 -22.522 26.555 1.00 12.79 H new ATOM 184 N ALA A 27 6.917 -20.450 21.631 1.00 10.62 N ATOM 185 CA ALA A 27 6.509 -19.416 20.689 1.00 10.13 C ATOM 186 C ALA A 27 4.994 -19.260 20.614 1.00 10.75 C ATOM 187 O ALA A 27 4.252 -20.242 20.575 1.00 10.17 O ATOM 188 CB ALA A 27 7.066 -19.713 19.302 1.00 10.80 C ATOM 0 H ALA A 27 7.390 -21.081 21.287 1.00 10.62 H new ATOM 0 HA ALA A 27 6.872 -18.578 21.016 1.00 10.13 H new ATOM 0 HB1 ALA A 27 6.787 -19.018 18.685 1.00 10.80 H new ATOM 0 HB2 ALA A 27 8.035 -19.740 19.341 1.00 10.80 H new ATOM 0 HB3 ALA A 27 6.731 -20.570 18.995 1.00 10.80 H new ATOM 189 N GLN A 28 4.550 -18.009 20.602 1.00 9.10 N ATOM 190 CA GLN A 28 3.188 -17.664 20.235 1.00 9.26 C ATOM 191 C GLN A 28 3.301 -16.887 18.934 1.00 9.58 C ATOM 192 O GLN A 28 3.942 -15.835 18.880 1.00 10.07 O ATOM 193 CB GLN A 28 2.550 -16.795 21.315 1.00 9.39 C ATOM 194 CG GLN A 28 2.533 -17.456 22.684 1.00 10.42 C ATOM 195 CD GLN A 28 1.924 -16.580 23.757 1.00 9.71 C ATOM 196 OE1 GLN A 28 0.970 -15.849 23.511 1.00 10.66 O ATOM 197 NE2 GLN A 28 2.477 -16.659 24.969 1.00 11.04 N ATOM 0 H GLN A 28 5.038 -17.331 20.809 1.00 9.10 H new ATOM 0 HA GLN A 28 2.632 -18.453 20.137 1.00 9.26 H new ATOM 0 HB2 GLN A 28 3.033 -15.956 21.374 1.00 9.39 H new ATOM 0 HB3 GLN A 28 1.640 -16.581 21.054 1.00 9.39 H new ATOM 0 HG2 GLN A 28 2.035 -18.286 22.630 1.00 10.42 H new ATOM 0 HG3 GLN A 28 3.441 -17.686 22.938 1.00 10.42 H new ATOM 0 HE21 GLN A 28 3.145 -17.183 25.103 1.00 11.04 H new ATOM 0 HE22 GLN A 28 2.165 -16.186 25.616 1.00 11.04 H new ATOM 198 N THR A 29 2.712 -17.416 17.870 1.00 8.46 N ATOM 199 CA THR A 29 2.830 -16.783 16.565 1.00 6.95 C ATOM 200 C THR A 29 1.653 -15.856 16.328 1.00 7.06 C ATOM 201 O THR A 29 0.499 -16.279 16.368 1.00 8.63 O ATOM 202 CB THR A 29 2.926 -17.828 15.432 1.00 7.50 C ATOM 203 OG1 THR A 29 4.092 -18.636 15.629 1.00 8.90 O ATOM 204 CG2 THR A 29 3.023 -17.133 14.073 1.00 7.53 C ATOM 0 H THR A 29 2.242 -18.136 17.882 1.00 8.46 H new ATOM 0 HA THR A 29 3.651 -16.266 16.558 1.00 6.95 H new ATOM 0 HB THR A 29 2.130 -18.382 15.449 1.00 7.50 H new ATOM 0 HG1 THR A 29 4.074 -19.288 15.100 1.00 8.90 H new ATOM 0 HG21 THR A 29 3.083 -17.800 13.372 1.00 7.53 H new ATOM 0 HG22 THR A 29 2.234 -16.586 13.932 1.00 7.53 H new ATOM 0 HG23 THR A 29 3.814 -16.571 14.052 1.00 7.53 H new ATOM 205 N LEU A 30 1.966 -14.582 16.126 1.00 7.09 N ATOM 206 CA LEU A 30 0.981 -13.571 15.777 1.00 7.23 C ATOM 207 C LEU A 30 1.299 -13.000 14.408 1.00 7.74 C ATOM 208 O LEU A 30 2.458 -12.922 14.006 1.00 8.58 O ATOM 209 CB LEU A 30 0.961 -12.433 16.806 1.00 8.08 C ATOM 210 CG LEU A 30 0.101 -12.634 18.060 1.00 9.57 C ATOM 211 CD1 LEU A 30 0.603 -13.777 18.945 1.00 10.48 C ATOM 212 CD2 LEU A 30 0.006 -11.318 18.852 1.00 10.45 C ATOM 0 H LEU A 30 2.768 -14.278 16.189 1.00 7.09 H new ATOM 0 HA LEU A 30 0.108 -13.993 15.769 1.00 7.23 H new ATOM 0 HB2 LEU A 30 1.874 -12.270 17.091 1.00 8.08 H new ATOM 0 HB3 LEU A 30 0.655 -11.629 16.358 1.00 8.08 H new ATOM 0 HG LEU A 30 -0.786 -12.891 17.764 1.00 9.57 H new ATOM 0 HD11 LEU A 30 0.027 -13.862 19.721 1.00 10.48 H new ATOM 0 HD12 LEU A 30 0.591 -14.606 18.441 1.00 10.48 H new ATOM 0 HD13 LEU A 30 1.509 -13.588 19.234 1.00 10.48 H new ATOM 0 HD21 LEU A 30 -0.539 -11.455 19.643 1.00 10.45 H new ATOM 0 HD22 LEU A 30 0.895 -11.035 19.118 1.00 10.45 H new ATOM 0 HD23 LEU A 30 -0.398 -10.634 18.296 1.00 10.45 H new ATOM 213 N ASN A 31 0.256 -12.601 13.693 1.00 7.59 N ATOM 214 CA ASN A 31 0.422 -11.998 12.384 1.00 8.01 C ATOM 215 C ASN A 31 0.395 -10.486 12.486 1.00 6.93 C ATOM 216 O ASN A 31 -0.647 -9.891 12.754 1.00 8.02 O ATOM 217 CB ASN A 31 -0.655 -12.514 11.445 1.00 8.09 C ATOM 218 CG ASN A 31 -0.538 -14.000 11.218 1.00 7.56 C ATOM 219 OD1 ASN A 31 0.562 -14.553 11.214 1.00 9.26 O ATOM 220 ND2 ASN A 31 -1.671 -14.658 11.039 1.00 9.22 N ATOM 0 H ASN A 31 -0.561 -12.672 13.952 1.00 7.59 H new ATOM 0 HA ASN A 31 1.287 -12.247 12.023 1.00 8.01 H new ATOM 0 HB2 ASN A 31 -1.529 -12.311 11.813 1.00 8.09 H new ATOM 0 HB3 ASN A 31 -0.591 -12.051 10.595 1.00 8.09 H new ATOM 0 HD21 ASN A 31 -1.659 -15.509 10.913 1.00 9.22 H new ATOM 0 HD22 ASN A 31 -2.420 -14.235 11.049 1.00 9.22 H new ATOM 221 N LEU A 32 1.558 -9.872 12.288 1.00 6.58 N ATOM 222 CA LEU A 32 1.718 -8.447 12.537 1.00 6.71 C ATOM 223 C LEU A 32 1.844 -7.659 11.242 1.00 6.90 C ATOM 224 O LEU A 32 2.337 -8.158 10.222 1.00 7.11 O ATOM 225 CB LEU A 32 2.939 -8.186 13.435 1.00 6.56 C ATOM 226 CG LEU A 32 2.934 -8.931 14.776 1.00 7.65 C ATOM 227 CD1 LEU A 32 4.099 -8.486 15.665 1.00 9.76 C ATOM 228 CD2 LEU A 32 1.617 -8.751 15.522 1.00 8.53 C ATOM 0 H LEU A 32 2.269 -10.267 12.008 1.00 6.58 H new ATOM 0 HA LEU A 32 0.918 -8.143 12.994 1.00 6.71 H new ATOM 0 HB2 LEU A 32 3.740 -8.433 12.947 1.00 6.56 H new ATOM 0 HB3 LEU A 32 2.996 -7.234 13.610 1.00 6.56 H new ATOM 0 HG LEU A 32 3.039 -9.873 14.570 1.00 7.65 H new ATOM 0 HD11 LEU A 32 4.070 -8.972 16.504 1.00 9.76 H new ATOM 0 HD12 LEU A 32 4.938 -8.669 15.214 1.00 9.76 H new ATOM 0 HD13 LEU A 32 4.027 -7.535 15.841 1.00 9.76 H new ATOM 0 HD21 LEU A 32 1.652 -9.235 16.362 1.00 8.53 H new ATOM 0 HD22 LEU A 32 1.471 -7.808 15.698 1.00 8.53 H new ATOM 0 HD23 LEU A 32 0.889 -9.095 14.981 1.00 8.53 H new ATOM 229 N ASP A 33 1.391 -6.415 11.302 1.00 6.85 N ATOM 230 CA ASP A 33 1.502 -5.474 10.197 1.00 6.48 C ATOM 231 C ASP A 33 2.828 -4.727 10.352 1.00 8.28 C ATOM 232 O ASP A 33 2.964 -3.877 11.242 1.00 6.98 O ATOM 233 CB ASP A 33 0.317 -4.507 10.291 1.00 7.72 C ATOM 234 CG ASP A 33 0.214 -3.570 9.120 1.00 8.36 C ATOM 235 OD1 ASP A 33 1.184 -3.416 8.355 1.00 9.36 O ATOM 236 OD2 ASP A 33 -0.874 -2.964 8.991 1.00 11.09 O ATOM 0 H ASP A 33 1.004 -6.088 11.997 1.00 6.85 H new ATOM 0 HA ASP A 33 1.486 -5.917 9.334 1.00 6.48 H new ATOM 0 HB2 ASP A 33 -0.504 -5.019 10.360 1.00 7.72 H new ATOM 0 HB3 ASP A 33 0.397 -3.987 11.106 1.00 7.72 H new ATOM 237 N PHE A 34 3.808 -5.061 9.513 1.00 6.38 N ATOM 238 CA PHE A 34 5.113 -4.387 9.548 1.00 6.65 C ATOM 239 C PHE A 34 4.976 -2.967 8.998 1.00 6.41 C ATOM 240 O PHE A 34 4.561 -2.767 7.849 1.00 7.93 O ATOM 241 CB PHE A 34 6.156 -5.157 8.726 1.00 7.19 C ATOM 242 CG PHE A 34 6.696 -6.399 9.397 1.00 6.34 C ATOM 243 CD1 PHE A 34 7.931 -6.911 9.013 1.00 7.24 C ATOM 244 CD2 PHE A 34 5.986 -7.058 10.392 1.00 7.46 C ATOM 245 CE1 PHE A 34 8.453 -8.054 9.605 1.00 8.38 C ATOM 246 CE2 PHE A 34 6.506 -8.203 10.992 1.00 7.90 C ATOM 247 CZ PHE A 34 7.751 -8.700 10.593 1.00 8.08 C ATOM 0 H PHE A 34 3.740 -5.675 8.915 1.00 6.38 H new ATOM 0 HA PHE A 34 5.412 -4.355 10.470 1.00 6.65 H new ATOM 0 HB2 PHE A 34 5.760 -5.409 7.877 1.00 7.19 H new ATOM 0 HB3 PHE A 34 6.897 -4.563 8.528 1.00 7.19 H new ATOM 0 HD1 PHE A 34 8.416 -6.480 8.347 1.00 7.24 H new ATOM 0 HD2 PHE A 34 5.157 -6.733 10.660 1.00 7.46 H new ATOM 0 HE1 PHE A 34 9.279 -8.382 9.332 1.00 8.38 H new ATOM 0 HE2 PHE A 34 6.025 -8.637 11.659 1.00 7.90 H new ATOM 0 HZ PHE A 34 8.101 -9.463 10.994 1.00 8.08 H new ATOM 248 N ASP A 35 5.357 -1.983 9.803 1.00 7.07 N ATOM 249 CA ASP A 35 5.019 -0.594 9.526 1.00 8.28 C ATOM 250 C ASP A 35 6.256 0.296 9.585 1.00 6.06 C ATOM 251 O ASP A 35 6.701 0.664 10.669 1.00 7.11 O ATOM 252 CB ASP A 35 3.972 -0.118 10.545 1.00 7.72 C ATOM 253 CG ASP A 35 3.556 1.322 10.329 1.00 9.99 C ATOM 254 OD1 ASP A 35 3.884 1.887 9.263 1.00 9.56 O ATOM 255 OD2 ASP A 35 2.892 1.886 11.227 1.00 11.98 O ATOM 0 H ASP A 35 5.816 -2.100 10.521 1.00 7.07 H new ATOM 0 HA ASP A 35 4.655 -0.533 8.629 1.00 8.28 H new ATOM 0 HB2 ASP A 35 3.189 -0.688 10.489 1.00 7.72 H new ATOM 0 HB3 ASP A 35 4.331 -0.216 11.441 1.00 7.72 H new ATOM 256 N THR A 36 6.817 0.649 8.431 1.00 6.25 N ATOM 257 CA THR A 36 8.003 1.504 8.413 1.00 6.72 C ATOM 258 C THR A 36 7.677 2.964 8.721 1.00 7.46 C ATOM 259 O THR A 36 8.584 3.800 8.731 1.00 7.69 O ATOM 260 CB THR A 36 8.781 1.409 7.089 1.00 6.86 C ATOM 261 OG1 THR A 36 7.935 1.819 6.005 1.00 7.62 O ATOM 262 CG2 THR A 36 9.244 -0.019 6.830 1.00 8.12 C ATOM 0 H THR A 36 6.532 0.408 7.656 1.00 6.25 H new ATOM 0 HA THR A 36 8.572 1.165 9.122 1.00 6.72 H new ATOM 0 HB THR A 36 9.557 1.987 7.153 1.00 6.86 H new ATOM 0 HG1 THR A 36 8.193 2.564 5.714 1.00 7.62 H new ATOM 0 HG21 THR A 36 9.731 -0.054 5.992 1.00 8.12 H new ATOM 0 HG22 THR A 36 9.823 -0.308 7.553 1.00 8.12 H new ATOM 0 HG23 THR A 36 8.473 -0.605 6.780 1.00 8.12 H new ATOM 263 N GLY A 37 6.404 3.258 8.989 1.00 7.76 N ATOM 264 CA GLY A 37 5.986 4.579 9.413 1.00 8.91 C ATOM 265 C GLY A 37 5.709 4.744 10.903 1.00 9.02 C ATOM 266 O GLY A 37 5.243 5.802 11.331 1.00 11.26 O ATOM 0 H GLY A 37 5.761 2.690 8.928 1.00 7.76 H new ATOM 0 HA2 GLY A 37 6.673 5.214 9.157 1.00 8.91 H new ATOM 0 HA3 GLY A 37 5.183 4.818 8.924 1.00 8.91 H new ATOM 267 N SER A 38 5.995 3.724 11.706 1.00 7.85 N ATOM 268 CA SER A 38 5.855 3.853 13.154 1.00 8.90 C ATOM 269 C SER A 38 6.894 2.985 13.842 1.00 7.58 C ATOM 270 O SER A 38 7.628 2.257 13.176 1.00 7.55 O ATOM 271 CB SER A 38 4.438 3.496 13.609 1.00 9.55 C ATOM 272 OG SER A 38 4.164 2.115 13.451 1.00 9.40 O ATOM 0 H SER A 38 6.269 2.955 11.436 1.00 7.85 H new ATOM 0 HA SER A 38 6.006 4.778 13.404 1.00 8.90 H new ATOM 0 HB2 SER A 38 4.326 3.743 14.540 1.00 9.55 H new ATOM 0 HB3 SER A 38 3.795 4.013 13.099 1.00 9.55 H new ATOM 0 HG SER A 38 3.621 2.007 12.819 1.00 9.40 H new ATOM 273 N SER A 39 6.965 3.071 15.169 1.00 8.01 N ATOM 274 CA SER A 39 8.112 2.519 15.887 1.00 6.64 C ATOM 275 C SER A 39 7.736 1.769 17.150 1.00 8.13 C ATOM 276 O SER A 39 8.564 1.598 18.050 1.00 8.42 O ATOM 277 CB SER A 39 9.109 3.632 16.191 1.00 8.51 C ATOM 278 OG SER A 39 9.448 4.280 14.980 1.00 8.82 O ATOM 0 H SER A 39 6.368 3.440 15.667 1.00 8.01 H new ATOM 0 HA SER A 39 8.520 1.859 15.305 1.00 6.64 H new ATOM 0 HB2 SER A 39 8.724 4.267 16.816 1.00 8.51 H new ATOM 0 HB3 SER A 39 9.903 3.267 16.611 1.00 8.51 H new ATOM 0 HG SER A 39 10.151 4.727 15.088 1.00 8.82 H new ATOM 279 N ASP A 40 6.491 1.307 17.208 1.00 8.40 N ATOM 280 CA ASP A 40 6.016 0.502 18.326 1.00 8.74 C ATOM 281 C ASP A 40 5.694 -0.913 17.846 1.00 8.63 C ATOM 282 O ASP A 40 5.078 -1.095 16.788 1.00 9.58 O ATOM 283 CB ASP A 40 4.764 1.134 18.957 1.00 9.10 C ATOM 284 CG ASP A 40 5.067 2.368 19.792 1.00 9.89 C ATOM 285 OD1 ASP A 40 5.751 3.290 19.307 1.00 9.62 O ATOM 286 OD2 ASP A 40 4.606 2.410 20.948 1.00 11.10 O ATOM 0 H ASP A 40 5.899 1.452 16.601 1.00 8.40 H new ATOM 0 HA ASP A 40 6.715 0.464 18.997 1.00 8.74 H new ATOM 0 HB2 ASP A 40 4.141 1.373 18.253 1.00 9.10 H new ATOM 0 HB3 ASP A 40 4.323 0.474 19.515 1.00 9.10 H new ATOM 287 N LEU A 41 6.117 -1.910 18.611 1.00 8.15 N ATOM 288 CA LEU A 41 5.696 -3.284 18.375 1.00 8.08 C ATOM 289 C LEU A 41 4.623 -3.553 19.415 1.00 9.07 C ATOM 290 O LEU A 41 4.927 -3.710 20.607 1.00 8.34 O ATOM 291 CB LEU A 41 6.874 -4.250 18.551 1.00 8.98 C ATOM 292 CG LEU A 41 6.685 -5.700 18.072 1.00 8.24 C ATOM 293 CD1 LEU A 41 8.003 -6.460 18.198 1.00 10.48 C ATOM 294 CD2 LEU A 41 5.571 -6.461 18.790 1.00 10.09 C ATOM 0 H LEU A 41 6.652 -1.811 19.277 1.00 8.15 H new ATOM 0 HA LEU A 41 5.367 -3.412 17.472 1.00 8.08 H new ATOM 0 HB2 LEU A 41 7.638 -3.878 18.083 1.00 8.98 H new ATOM 0 HB3 LEU A 41 7.103 -4.274 19.493 1.00 8.98 H new ATOM 0 HG LEU A 41 6.409 -5.643 17.144 1.00 8.24 H new ATOM 0 HD11 LEU A 41 7.880 -7.373 17.895 1.00 10.48 H new ATOM 0 HD12 LEU A 41 8.679 -6.028 17.654 1.00 10.48 H new ATOM 0 HD13 LEU A 41 8.288 -6.463 19.125 1.00 10.48 H new ATOM 0 HD21 LEU A 41 5.513 -7.362 18.435 1.00 10.09 H new ATOM 0 HD22 LEU A 41 5.765 -6.500 19.740 1.00 10.09 H new ATOM 0 HD23 LEU A 41 4.726 -6.005 18.652 1.00 10.09 H new ATOM 295 N TRP A 42 3.366 -3.554 18.986 1.00 7.40 N ATOM 296 CA TRP A 42 2.262 -3.776 19.916 1.00 8.39 C ATOM 297 C TRP A 42 1.375 -4.903 19.424 1.00 7.65 C ATOM 298 O TRP A 42 1.292 -5.164 18.212 1.00 8.20 O ATOM 299 CB TRP A 42 1.458 -2.490 20.179 1.00 8.98 C ATOM 300 CG TRP A 42 0.559 -2.006 19.058 1.00 9.06 C ATOM 301 CD1 TRP A 42 0.834 -1.019 18.152 1.00 8.69 C ATOM 302 CD2 TRP A 42 -0.772 -2.459 18.766 1.00 8.59 C ATOM 303 NE1 TRP A 42 -0.242 -0.841 17.306 1.00 9.89 N ATOM 304 CE2 TRP A 42 -1.234 -1.715 17.664 1.00 9.12 C ATOM 305 CE3 TRP A 42 -1.618 -3.419 19.334 1.00 9.77 C ATOM 306 CZ2 TRP A 42 -2.503 -1.907 17.113 1.00 10.53 C ATOM 307 CZ3 TRP A 42 -2.874 -3.614 18.781 1.00 10.69 C ATOM 308 CH2 TRP A 42 -3.303 -2.860 17.686 1.00 12.00 C ATOM 0 H TRP A 42 3.131 -3.429 18.168 1.00 7.40 H new ATOM 0 HA TRP A 42 2.641 -4.040 20.769 1.00 8.39 H new ATOM 0 HB2 TRP A 42 0.910 -2.632 20.967 1.00 8.98 H new ATOM 0 HB3 TRP A 42 2.084 -1.780 20.393 1.00 8.98 H new ATOM 0 HD1 TRP A 42 1.629 -0.538 18.112 1.00 8.69 H new ATOM 0 HE1 TRP A 42 -0.283 -0.274 16.660 1.00 9.89 H new ATOM 0 HE3 TRP A 42 -1.342 -3.917 20.069 1.00 9.77 H new ATOM 0 HZ2 TRP A 42 -2.794 -1.407 16.385 1.00 10.53 H new ATOM 0 HZ3 TRP A 42 -3.440 -4.257 19.144 1.00 10.69 H new ATOM 0 HH2 TRP A 42 -4.152 -3.009 17.338 1.00 12.00 H new ATOM 309 N VAL A 43 0.745 -5.594 20.367 1.00 7.78 N ATOM 310 CA VAL A 43 -0.037 -6.783 20.058 1.00 8.83 C ATOM 311 C VAL A 43 -1.350 -6.819 20.823 1.00 9.61 C ATOM 312 O VAL A 43 -1.440 -6.334 21.957 1.00 10.60 O ATOM 313 CB VAL A 43 0.761 -8.060 20.380 1.00 8.09 C ATOM 314 CG1 VAL A 43 1.978 -8.157 19.469 1.00 10.03 C ATOM 315 CG2 VAL A 43 1.186 -8.091 21.856 1.00 8.76 C ATOM 0 H VAL A 43 0.759 -5.387 21.202 1.00 7.78 H new ATOM 0 HA VAL A 43 -0.234 -6.746 19.109 1.00 8.83 H new ATOM 0 HB VAL A 43 0.188 -8.826 20.222 1.00 8.09 H new ATOM 0 HG11 VAL A 43 2.475 -8.963 19.678 1.00 10.03 H new ATOM 0 HG12 VAL A 43 1.688 -8.187 18.544 1.00 10.03 H new ATOM 0 HG13 VAL A 43 2.547 -7.383 19.605 1.00 10.03 H new ATOM 0 HG21 VAL A 43 1.686 -8.904 22.032 1.00 8.76 H new ATOM 0 HG22 VAL A 43 1.743 -7.321 22.049 1.00 8.76 H new ATOM 0 HG23 VAL A 43 0.398 -8.068 22.421 1.00 8.76 H new ATOM 316 N PHE A 44 -2.376 -7.373 20.189 1.00 7.97 N ATOM 317 CA PHE A 44 -3.549 -7.847 20.916 1.00 8.95 C ATOM 318 C PHE A 44 -3.072 -8.858 21.948 1.00 9.77 C ATOM 319 O PHE A 44 -2.151 -9.646 21.685 1.00 9.34 O ATOM 320 CB PHE A 44 -4.535 -8.517 19.963 1.00 8.91 C ATOM 321 CG PHE A 44 -5.418 -7.557 19.212 1.00 9.44 C ATOM 322 CD1 PHE A 44 -4.948 -6.863 18.105 1.00 8.97 C ATOM 323 CD2 PHE A 44 -6.736 -7.379 19.593 1.00 11.13 C ATOM 324 CE1 PHE A 44 -5.778 -5.997 17.406 1.00 10.74 C ATOM 325 CE2 PHE A 44 -7.567 -6.517 18.898 1.00 10.29 C ATOM 326 CZ PHE A 44 -7.089 -5.826 17.806 1.00 11.30 C ATOM 0 H PHE A 44 -2.414 -7.484 19.337 1.00 7.97 H new ATOM 0 HA PHE A 44 -4.000 -7.101 21.342 1.00 8.95 H new ATOM 0 HB2 PHE A 44 -4.039 -9.052 19.324 1.00 8.91 H new ATOM 0 HB3 PHE A 44 -5.094 -9.127 20.469 1.00 8.91 H new ATOM 0 HD1 PHE A 44 -4.068 -6.980 17.829 1.00 8.97 H new ATOM 0 HD2 PHE A 44 -7.068 -7.845 20.326 1.00 11.13 H new ATOM 0 HE1 PHE A 44 -5.452 -5.533 16.669 1.00 10.74 H new ATOM 0 HE2 PHE A 44 -8.450 -6.404 19.169 1.00 10.29 H new ATOM 0 HZ PHE A 44 -7.647 -5.246 17.340 1.00 11.30 H new ATOM 327 N SER A 45 -3.691 -8.852 23.123 1.00 11.18 N ATOM 328 CA SER A 45 -3.182 -9.667 24.209 1.00 10.40 C ATOM 329 C SER A 45 -4.290 -10.136 25.135 1.00 9.79 C ATOM 330 O SER A 45 -5.453 -9.768 24.982 1.00 11.43 O ATOM 331 CB SER A 45 -2.163 -8.874 25.024 1.00 12.10 C ATOM 332 OG SER A 45 -2.830 -7.900 25.814 1.00 15.36 O ATOM 0 H SER A 45 -4.394 -8.391 23.307 1.00 11.18 H new ATOM 0 HA SER A 45 -2.765 -10.447 23.811 1.00 10.40 H new ATOM 0 HB2 SER A 45 -1.656 -9.473 25.594 1.00 12.10 H new ATOM 0 HB3 SER A 45 -1.528 -8.442 24.431 1.00 12.10 H new ATOM 0 HG SER A 45 -2.267 -7.363 26.132 1.00 15.36 H new ATOM 333 N SER A 46 -3.902 -10.931 26.125 1.00 12.03 N ATOM 334 CA SER A 46 -4.830 -11.382 27.153 1.00 13.74 C ATOM 335 C SER A 46 -5.310 -10.215 28.017 1.00 15.27 C ATOM 336 O SER A 46 -6.249 -10.365 28.801 1.00 16.76 O ATOM 337 CB SER A 46 -4.168 -12.447 28.020 1.00 16.08 C ATOM 338 OG SER A 46 -2.942 -11.975 28.545 1.00 15.30 O ATOM 0 H SER A 46 -3.098 -11.223 26.219 1.00 12.03 H new ATOM 0 HA SER A 46 -5.606 -11.765 26.715 1.00 13.74 H new ATOM 0 HB2 SER A 46 -4.762 -12.694 28.746 1.00 16.08 H new ATOM 0 HB3 SER A 46 -4.013 -13.248 27.495 1.00 16.08 H new ATOM 0 HG SER A 46 -2.656 -12.517 29.120 1.00 15.30 H new ATOM 339 N GLU A 47 -4.667 -9.060 27.864 1.00 13.27 N ATOM 340 CA GLU A 47 -5.025 -7.851 28.607 1.00 13.39 C ATOM 341 C GLU A 47 -5.977 -6.935 27.843 1.00 14.77 C ATOM 342 O GLU A 47 -6.497 -5.971 28.401 1.00 16.31 O ATOM 343 CB GLU A 47 -3.764 -7.074 28.981 1.00 13.95 C ATOM 344 CG GLU A 47 -2.798 -7.863 29.835 1.00 16.30 C ATOM 345 CD GLU A 47 -1.549 -7.083 30.187 1.00 20.23 C ATOM 346 OE1 GLU A 47 -1.142 -6.211 29.390 1.00 18.72 O ATOM 347 OE2 GLU A 47 -0.971 -7.340 31.264 1.00 22.78 O ATOM 0 H GLU A 47 -4.007 -8.954 27.323 1.00 13.27 H new ATOM 0 HA GLU A 47 -5.491 -8.146 29.405 1.00 13.39 H new ATOM 0 HB2 GLU A 47 -3.313 -6.795 28.169 1.00 13.95 H new ATOM 0 HB3 GLU A 47 -4.019 -6.267 29.456 1.00 13.95 H new ATOM 0 HG2 GLU A 47 -3.244 -8.136 30.652 1.00 16.30 H new ATOM 0 HG3 GLU A 47 -2.546 -8.673 29.365 1.00 16.30 H new ATOM 348 N THR A 48 -6.201 -7.226 26.566 1.00 12.56 N ATOM 349 CA THR A 48 -7.035 -6.364 25.737 1.00 12.05 C ATOM 350 C THR A 48 -8.502 -6.461 26.153 1.00 13.65 C ATOM 351 O THR A 48 -9.043 -7.560 26.288 1.00 16.05 O ATOM 352 CB THR A 48 -6.892 -6.706 24.238 1.00 13.07 C ATOM 353 OG1 THR A 48 -5.505 -6.714 23.878 1.00 11.80 O ATOM 354 CG2 THR A 48 -7.623 -5.681 23.383 1.00 13.40 C ATOM 0 H THR A 48 -5.881 -7.914 26.162 1.00 12.56 H new ATOM 0 HA THR A 48 -6.728 -5.454 25.872 1.00 12.05 H new ATOM 0 HB THR A 48 -7.281 -7.581 24.083 1.00 13.07 H new ATOM 0 HG1 THR A 48 -5.083 -6.184 24.375 1.00 11.80 H new ATOM 0 HG21 THR A 48 -7.523 -5.911 22.446 1.00 13.40 H new ATOM 0 HG22 THR A 48 -8.565 -5.677 23.616 1.00 13.40 H new ATOM 0 HG23 THR A 48 -7.248 -4.801 23.541 1.00 13.40 H new ATOM 355 N THR A 49 -9.129 -5.305 26.362 1.00 15.00 N ATOM 356 CA THR A 49 -10.557 -5.229 26.669 1.00 18.65 C ATOM 357 C THR A 49 -11.318 -6.228 25.810 1.00 19.10 C ATOM 358 O THR A 49 -11.247 -6.173 24.588 1.00 16.13 O ATOM 359 CB THR A 49 -11.103 -3.815 26.399 1.00 20.01 C ATOM 360 OG1 THR A 49 -10.357 -2.855 27.160 1.00 22.57 O ATOM 361 CG2 THR A 49 -12.572 -3.719 26.777 1.00 18.46 C ATOM 0 H THR A 49 -8.737 -4.540 26.330 1.00 15.00 H new ATOM 0 HA THR A 49 -10.677 -5.437 27.609 1.00 18.65 H new ATOM 0 HB THR A 49 -11.012 -3.630 25.451 1.00 20.01 H new ATOM 0 HG1 THR A 49 -9.596 -2.756 26.818 1.00 22.57 H new ATOM 0 HG21 THR A 49 -12.894 -2.822 26.599 1.00 18.46 H new ATOM 0 HG22 THR A 49 -13.083 -4.356 26.253 1.00 18.46 H new ATOM 0 HG23 THR A 49 -12.677 -3.919 27.720 1.00 18.46 H new ATOM 362 N ALA A 50 -12.042 -7.137 26.455 1.00 19.14 N ATOM 363 CA ALA A 50 -12.691 -8.251 25.767 1.00 20.04 C ATOM 364 C ALA A 50 -13.568 -7.827 24.591 1.00 19.35 C ATOM 365 O ALA A 50 -13.540 -8.448 23.527 1.00 20.51 O ATOM 366 CB ALA A 50 -13.502 -9.081 26.759 1.00 25.07 C ATOM 0 H ALA A 50 -12.172 -7.126 27.305 1.00 19.14 H new ATOM 0 HA ALA A 50 -11.977 -8.787 25.388 1.00 20.04 H new ATOM 0 HB1 ALA A 50 -13.928 -9.817 26.293 1.00 25.07 H new ATOM 0 HB2 ALA A 50 -12.913 -9.431 27.446 1.00 25.07 H new ATOM 0 HB3 ALA A 50 -14.181 -8.523 27.170 1.00 25.07 H new ATOM 367 N SER A 51 -14.353 -6.775 24.785 1.00 21.38 N ATOM 368 CA SER A 51 -15.273 -6.314 23.754 1.00 23.28 C ATOM 369 C SER A 51 -14.551 -5.751 22.532 1.00 22.96 C ATOM 370 O SER A 51 -15.164 -5.519 21.489 1.00 19.83 O ATOM 371 CB SER A 51 -16.217 -5.256 24.327 1.00 21.14 C ATOM 372 OG SER A 51 -15.493 -4.138 24.805 1.00 25.98 O ATOM 0 H SER A 51 -14.368 -6.312 25.510 1.00 21.38 H new ATOM 0 HA SER A 51 -15.779 -7.088 23.461 1.00 23.28 H new ATOM 0 HB2 SER A 51 -16.843 -4.972 23.643 1.00 21.14 H new ATOM 0 HB3 SER A 51 -16.739 -5.640 25.048 1.00 21.14 H new ATOM 0 HG SER A 51 -15.567 -4.092 25.640 1.00 25.98 H new ATOM 373 N GLU A 52 -13.246 -5.534 22.667 1.00 16.30 N ATOM 374 CA GLU A 52 -12.449 -4.939 21.594 1.00 16.10 C ATOM 375 C GLU A 52 -11.625 -5.979 20.834 1.00 14.90 C ATOM 376 O GLU A 52 -10.855 -5.630 19.934 1.00 16.54 O ATOM 377 CB GLU A 52 -11.559 -3.817 22.142 1.00 16.67 C ATOM 378 CG GLU A 52 -12.368 -2.628 22.659 1.00 18.41 C ATOM 379 CD GLU A 52 -11.520 -1.514 23.253 1.00 22.16 C ATOM 380 OE1 GLU A 52 -10.305 -1.715 23.481 1.00 18.39 O ATOM 381 OE2 GLU A 52 -12.084 -0.424 23.496 1.00 24.40 O ATOM 0 H GLU A 52 -12.799 -5.725 23.376 1.00 16.30 H new ATOM 0 HA GLU A 52 -13.069 -4.556 20.954 1.00 16.10 H new ATOM 0 HB2 GLU A 52 -11.008 -4.166 22.860 1.00 16.67 H new ATOM 0 HB3 GLU A 52 -10.957 -3.516 21.444 1.00 16.67 H new ATOM 0 HG2 GLU A 52 -12.896 -2.266 21.930 1.00 18.41 H new ATOM 0 HG3 GLU A 52 -12.992 -2.941 23.333 1.00 18.41 H new ATOM 382 N VAL A 53 -11.791 -7.244 21.204 1.00 15.07 N ATOM 383 CA VAL A 53 -11.163 -8.350 20.488 1.00 15.95 C ATOM 384 C VAL A 53 -12.232 -9.084 19.688 1.00 17.41 C ATOM 385 O VAL A 53 -13.248 -9.509 20.243 1.00 20.40 O ATOM 386 CB VAL A 53 -10.500 -9.345 21.451 1.00 15.76 C ATOM 387 CG1 VAL A 53 -9.779 -10.452 20.671 1.00 16.13 C ATOM 388 CG2 VAL A 53 -9.539 -8.615 22.374 1.00 18.05 C ATOM 0 H VAL A 53 -12.270 -7.486 21.876 1.00 15.07 H new ATOM 0 HA VAL A 53 -10.477 -7.985 19.907 1.00 15.95 H new ATOM 0 HB VAL A 53 -11.188 -9.762 21.993 1.00 15.76 H new ATOM 0 HG11 VAL A 53 -9.366 -11.071 21.294 1.00 16.13 H new ATOM 0 HG12 VAL A 53 -10.419 -10.928 20.119 1.00 16.13 H new ATOM 0 HG13 VAL A 53 -9.095 -10.058 20.107 1.00 16.13 H new ATOM 0 HG21 VAL A 53 -9.125 -9.251 22.979 1.00 18.05 H new ATOM 0 HG22 VAL A 53 -8.853 -8.177 21.846 1.00 18.05 H new ATOM 0 HG23 VAL A 53 -10.025 -7.951 22.887 1.00 18.05 H new ATOM 389 N ASP A 54 -12.003 -9.233 18.387 1.00 14.39 N ATOM 390 CA ASP A 54 -12.960 -9.897 17.508 1.00 17.64 C ATOM 391 C ASP A 54 -12.242 -10.756 16.462 1.00 16.32 C ATOM 392 O ASP A 54 -12.144 -10.384 15.294 1.00 16.85 O ATOM 393 CB ASP A 54 -13.871 -8.862 16.834 1.00 21.27 C ATOM 394 CG ASP A 54 -14.983 -9.500 16.013 1.00 22.68 C ATOM 395 OD1 ASP A 54 -15.181 -10.727 16.117 1.00 22.62 O ATOM 396 OD2 ASP A 54 -15.663 -8.763 15.266 1.00 31.74 O ATOM 0 H ASP A 54 -11.293 -8.954 17.991 1.00 14.39 H new ATOM 0 HA ASP A 54 -13.510 -10.487 18.047 1.00 17.64 H new ATOM 0 HB2 ASP A 54 -14.263 -8.291 17.513 1.00 21.27 H new ATOM 0 HB3 ASP A 54 -13.336 -8.292 16.259 1.00 21.27 H new ATOM 397 N GLY A 55 -11.721 -11.894 16.900 1.00 14.73 N ATOM 398 CA GLY A 55 -11.097 -12.841 15.993 1.00 14.78 C ATOM 399 C GLY A 55 -9.579 -12.826 15.934 1.00 13.07 C ATOM 400 O GLY A 55 -8.982 -13.732 15.352 1.00 13.88 O ATOM 0 H GLY A 55 -11.720 -12.137 17.725 1.00 14.73 H new ATOM 0 HA2 GLY A 55 -11.382 -13.734 16.243 1.00 14.78 H new ATOM 0 HA3 GLY A 55 -11.437 -12.675 15.100 1.00 14.78 H new ATOM 401 N GLN A 56 -8.951 -11.802 16.515 1.00 11.28 N ATOM 402 CA GLN A 56 -7.491 -11.715 16.528 1.00 11.46 C ATOM 403 C GLN A 56 -6.866 -12.809 17.382 1.00 11.52 C ATOM 404 O GLN A 56 -7.472 -13.306 18.335 1.00 13.22 O ATOM 405 CB GLN A 56 -7.014 -10.348 17.039 1.00 9.40 C ATOM 406 CG GLN A 56 -7.369 -9.166 16.140 1.00 10.27 C ATOM 407 CD GLN A 56 -8.799 -8.686 16.334 1.00 11.33 C ATOM 408 OE1 GLN A 56 -9.493 -9.115 17.261 1.00 12.51 O ATOM 409 NE2 GLN A 56 -9.245 -7.800 15.456 1.00 12.80 N ATOM 0 H GLN A 56 -9.352 -11.149 16.906 1.00 11.28 H new ATOM 0 HA GLN A 56 -7.203 -11.831 15.609 1.00 11.46 H new ATOM 0 HB2 GLN A 56 -7.395 -10.195 17.918 1.00 9.40 H new ATOM 0 HB3 GLN A 56 -6.051 -10.376 17.148 1.00 9.40 H new ATOM 0 HG2 GLN A 56 -6.759 -8.433 16.320 1.00 10.27 H new ATOM 0 HG3 GLN A 56 -7.241 -9.420 15.213 1.00 10.27 H new ATOM 0 HE21 GLN A 56 -8.731 -7.525 14.824 1.00 12.80 H new ATOM 0 HE22 GLN A 56 -10.048 -7.500 15.518 1.00 12.80 H new ATOM 410 N THR A 57 -5.647 -13.195 17.030 1.00 10.63 N ATOM 411 CA THR A 57 -4.852 -14.038 17.904 1.00 9.54 C ATOM 412 C THR A 57 -4.186 -13.137 18.933 1.00 10.03 C ATOM 413 O THR A 57 -3.671 -12.076 18.576 1.00 11.41 O ATOM 414 CB THR A 57 -3.789 -14.783 17.100 1.00 10.47 C ATOM 415 OG1 THR A 57 -4.440 -15.696 16.200 1.00 12.21 O ATOM 416 CG2 THR A 57 -2.837 -15.554 18.017 1.00 12.94 C ATOM 0 H THR A 57 -5.264 -12.979 16.291 1.00 10.63 H new ATOM 0 HA THR A 57 -5.416 -14.697 18.339 1.00 9.54 H new ATOM 0 HB THR A 57 -3.265 -14.136 16.603 1.00 10.47 H new ATOM 0 HG1 THR A 57 -4.113 -15.613 15.431 1.00 12.21 H new ATOM 0 HG21 THR A 57 -2.174 -16.016 17.480 1.00 12.94 H new ATOM 0 HG22 THR A 57 -2.392 -14.935 18.616 1.00 12.94 H new ATOM 0 HG23 THR A 57 -3.340 -16.201 18.536 1.00 12.94 H new ATOM 417 N ILE A 58 -4.211 -13.554 20.198 1.00 10.33 N ATOM 418 CA ILE A 58 -3.667 -12.752 21.287 1.00 11.10 C ATOM 419 C ILE A 58 -2.375 -13.322 21.857 1.00 11.44 C ATOM 420 O ILE A 58 -2.149 -14.531 21.844 1.00 12.60 O ATOM 421 CB ILE A 58 -4.687 -12.579 22.437 1.00 12.12 C ATOM 422 CG1 ILE A 58 -5.019 -13.930 23.079 1.00 15.55 C ATOM 423 CG2 ILE A 58 -5.948 -11.882 21.935 1.00 13.63 C ATOM 424 CD1 ILE A 58 -5.849 -13.813 24.357 1.00 17.23 C ATOM 0 H ILE A 58 -4.543 -14.307 20.446 1.00 10.33 H new ATOM 0 HA ILE A 58 -3.471 -11.888 20.893 1.00 11.10 H new ATOM 0 HB ILE A 58 -4.286 -12.018 23.120 1.00 12.12 H new ATOM 0 HG12 ILE A 58 -5.502 -14.474 22.438 1.00 15.55 H new ATOM 0 HG13 ILE A 58 -4.192 -14.396 23.281 1.00 15.55 H new ATOM 0 HG21 ILE A 58 -6.576 -11.782 22.667 1.00 13.63 H new ATOM 0 HG22 ILE A 58 -5.717 -11.007 21.586 1.00 13.63 H new ATOM 0 HG23 ILE A 58 -6.354 -12.414 21.232 1.00 13.63 H new ATOM 0 HD11 ILE A 58 -6.024 -14.699 24.712 1.00 17.23 H new ATOM 0 HD12 ILE A 58 -5.360 -13.293 25.014 1.00 17.23 H new ATOM 0 HD13 ILE A 58 -6.690 -13.373 24.158 1.00 17.23 H new ATOM 425 N TYR A 59 -1.518 -12.416 22.319 1.00 10.18 N ATOM 426 CA TYR A 59 -0.344 -12.755 23.102 1.00 9.80 C ATOM 427 C TYR A 59 -0.737 -12.857 24.569 1.00 11.28 C ATOM 428 O TYR A 59 -1.372 -11.946 25.111 1.00 11.39 O ATOM 429 CB TYR A 59 0.694 -11.657 22.904 1.00 10.03 C ATOM 430 CG TYR A 59 1.901 -11.675 23.819 1.00 9.05 C ATOM 431 CD1 TYR A 59 2.207 -10.572 24.605 1.00 10.94 C ATOM 432 CD2 TYR A 59 2.765 -12.762 23.857 1.00 9.31 C ATOM 433 CE1 TYR A 59 3.318 -10.553 25.417 1.00 9.11 C ATOM 434 CE2 TYR A 59 3.894 -12.750 24.675 1.00 10.58 C ATOM 435 CZ TYR A 59 4.163 -11.632 25.446 1.00 8.57 C ATOM 436 OH TYR A 59 5.278 -11.596 26.263 1.00 10.89 O ATOM 0 H TYR A 59 -1.608 -11.572 22.181 1.00 10.18 H new ATOM 0 HA TYR A 59 0.026 -13.606 22.820 1.00 9.80 H new ATOM 0 HB2 TYR A 59 1.010 -11.703 21.988 1.00 10.03 H new ATOM 0 HB3 TYR A 59 0.250 -10.801 23.008 1.00 10.03 H new ATOM 0 HD1 TYR A 59 1.648 -9.829 24.582 1.00 10.94 H new ATOM 0 HD2 TYR A 59 2.588 -13.508 23.330 1.00 9.31 H new ATOM 0 HE1 TYR A 59 3.495 -9.809 25.946 1.00 9.11 H new ATOM 0 HE2 TYR A 59 4.461 -13.486 24.702 1.00 10.58 H new ATOM 0 HH TYR A 59 5.819 -12.194 26.026 1.00 10.89 H new ATOM 437 N THR A 60 -0.370 -13.970 25.196 1.00 10.32 N ATOM 438 CA THR A 60 -0.623 -14.174 26.620 1.00 12.26 C ATOM 439 C THR A 60 0.716 -14.259 27.363 1.00 12.10 C ATOM 440 O THR A 60 1.339 -15.316 27.414 1.00 11.72 O ATOM 441 CB THR A 60 -1.428 -15.467 26.858 1.00 12.87 C ATOM 442 OG1 THR A 60 -2.657 -15.417 26.126 1.00 14.30 O ATOM 443 CG2 THR A 60 -1.725 -15.660 28.348 1.00 13.93 C ATOM 0 H THR A 60 0.031 -14.626 24.811 1.00 10.32 H new ATOM 0 HA THR A 60 -1.143 -13.426 26.953 1.00 12.26 H new ATOM 0 HB THR A 60 -0.896 -16.217 26.550 1.00 12.87 H new ATOM 0 HG1 THR A 60 -2.549 -15.770 25.371 1.00 14.30 H new ATOM 0 HG21 THR A 60 -2.231 -16.478 28.474 1.00 13.93 H new ATOM 0 HG22 THR A 60 -0.891 -15.718 28.840 1.00 13.93 H new ATOM 0 HG23 THR A 60 -2.241 -14.907 28.675 1.00 13.93 H new ATOM 444 N PRO A 61 1.173 -13.137 27.936 1.00 11.91 N ATOM 445 CA PRO A 61 2.513 -13.176 28.531 1.00 12.28 C ATOM 446 C PRO A 61 2.643 -14.156 29.692 1.00 12.20 C ATOM 447 O PRO A 61 3.727 -14.677 29.903 1.00 13.07 O ATOM 448 CB PRO A 61 2.750 -11.731 28.995 1.00 14.40 C ATOM 449 CG PRO A 61 1.410 -11.085 29.019 1.00 15.11 C ATOM 450 CD PRO A 61 0.560 -11.800 27.999 1.00 14.39 C ATOM 0 HA PRO A 61 3.169 -13.492 27.891 1.00 12.28 H new ATOM 0 HB2 PRO A 61 3.161 -11.711 29.873 1.00 14.40 H new ATOM 0 HB3 PRO A 61 3.349 -11.266 28.391 1.00 14.40 H new ATOM 0 HG2 PRO A 61 1.014 -11.149 29.902 1.00 15.11 H new ATOM 0 HG3 PRO A 61 1.480 -10.141 28.807 1.00 15.11 H new ATOM 0 HD2 PRO A 61 -0.369 -11.844 28.273 1.00 14.39 H new ATOM 0 HD3 PRO A 61 0.581 -11.354 27.138 1.00 14.39 H new ATOM 451 N SER A 62 1.558 -14.418 30.412 1.00 13.89 N ATOM 452 CA SER A 62 1.628 -15.353 31.534 1.00 14.03 C ATOM 453 C SER A 62 1.988 -16.770 31.080 1.00 14.50 C ATOM 454 O SER A 62 2.416 -17.591 31.890 1.00 17.77 O ATOM 455 CB SER A 62 0.319 -15.368 32.322 1.00 16.48 C ATOM 456 OG SER A 62 -0.746 -15.882 31.545 1.00 18.95 O ATOM 0 H SER A 62 0.783 -14.073 30.273 1.00 13.89 H new ATOM 0 HA SER A 62 2.338 -15.039 32.115 1.00 14.03 H new ATOM 0 HB2 SER A 62 0.427 -15.906 33.122 1.00 16.48 H new ATOM 0 HB3 SER A 62 0.104 -14.468 32.613 1.00 16.48 H new ATOM 0 HG SER A 62 -1.419 -15.387 31.630 1.00 18.95 H new ATOM 457 N LYS A 63 1.817 -17.052 29.789 1.00 12.24 N ATOM 458 CA LYS A 63 2.132 -18.368 29.227 1.00 12.75 C ATOM 459 C LYS A 63 3.547 -18.443 28.646 1.00 11.45 C ATOM 460 O LYS A 63 3.961 -19.493 28.145 1.00 14.01 O ATOM 461 CB LYS A 63 1.111 -18.749 28.165 1.00 14.98 C ATOM 0 H LYS A 63 1.516 -16.488 29.214 1.00 12.24 H new ATOM 0 HA LYS A 63 2.092 -19.001 29.961 1.00 12.75 H new ATOM 462 N SER A 64 4.285 -17.339 28.715 1.00 11.38 N ATOM 463 CA SER A 64 5.643 -17.278 28.193 1.00 10.75 C ATOM 464 C SER A 64 6.651 -17.231 29.326 1.00 13.29 C ATOM 465 O SER A 64 6.634 -16.310 30.137 1.00 13.02 O ATOM 466 CB SER A 64 5.818 -16.039 27.318 1.00 10.97 C ATOM 467 OG SER A 64 7.165 -15.911 26.911 1.00 11.26 O ATOM 0 H SER A 64 4.010 -16.604 29.067 1.00 11.38 H new ATOM 0 HA SER A 64 5.796 -18.076 27.663 1.00 10.75 H new ATOM 0 HB2 SER A 64 5.243 -16.102 26.539 1.00 10.97 H new ATOM 0 HB3 SER A 64 5.546 -15.248 27.809 1.00 10.97 H new ATOM 0 HG SER A 64 7.297 -15.135 26.618 1.00 11.26 H new ATOM 468 N THR A 65 7.547 -18.211 29.366 1.00 12.56 N ATOM 469 CA THR A 65 8.517 -18.301 30.453 1.00 12.13 C ATOM 470 C THR A 65 9.590 -17.222 30.377 1.00 13.65 C ATOM 471 O THR A 65 10.315 -17.001 31.345 1.00 17.05 O ATOM 472 CB THR A 65 9.188 -19.686 30.509 1.00 15.16 C ATOM 473 OG1 THR A 65 9.773 -19.984 29.238 1.00 16.68 O ATOM 474 CG2 THR A 65 8.165 -20.756 30.859 1.00 17.48 C ATOM 0 H THR A 65 7.611 -18.833 28.775 1.00 12.56 H new ATOM 0 HA THR A 65 8.007 -18.162 31.266 1.00 12.13 H new ATOM 0 HB THR A 65 9.876 -19.674 31.193 1.00 15.16 H new ATOM 0 HG1 THR A 65 10.578 -20.201 29.344 1.00 16.68 H new ATOM 0 HG21 THR A 65 8.600 -21.622 30.891 1.00 17.48 H new ATOM 0 HG22 THR A 65 7.774 -20.559 31.725 1.00 17.48 H new ATOM 0 HG23 THR A 65 7.467 -20.770 30.185 1.00 17.48 H new ATOM 475 N THR A 66 9.683 -16.548 29.232 1.00 13.09 N ATOM 476 CA THR A 66 10.683 -15.509 29.024 1.00 12.02 C ATOM 477 C THR A 66 10.092 -14.092 29.105 1.00 9.99 C ATOM 478 O THR A 66 10.815 -13.103 28.981 1.00 12.82 O ATOM 479 CB THR A 66 11.415 -15.695 27.671 1.00 11.76 C ATOM 480 OG1 THR A 66 10.465 -16.030 26.653 1.00 12.56 O ATOM 481 CG2 THR A 66 12.439 -16.822 27.762 1.00 13.40 C ATOM 0 H THR A 66 9.168 -16.682 28.556 1.00 13.09 H new ATOM 0 HA THR A 66 11.322 -15.604 29.748 1.00 12.02 H new ATOM 0 HB THR A 66 11.867 -14.865 27.455 1.00 11.76 H new ATOM 0 HG1 THR A 66 10.123 -15.327 26.347 1.00 12.56 H new ATOM 0 HG21 THR A 66 12.886 -16.923 26.907 1.00 13.40 H new ATOM 0 HG22 THR A 66 13.094 -16.610 28.446 1.00 13.40 H new ATOM 0 HG23 THR A 66 11.989 -17.650 27.991 1.00 13.40 H new ATOM 482 N ALA A 67 8.779 -13.994 29.295 1.00 10.48 N ATOM 483 CA ALA A 67 8.129 -12.686 29.422 1.00 12.30 C ATOM 484 C ALA A 67 8.406 -12.047 30.783 1.00 13.59 C ATOM 485 O ALA A 67 8.345 -12.712 31.816 1.00 15.24 O ATOM 486 CB ALA A 67 6.639 -12.810 29.204 1.00 10.95 C ATOM 0 H ALA A 67 8.247 -14.667 29.353 1.00 10.48 H new ATOM 0 HA ALA A 67 8.504 -12.109 28.738 1.00 12.30 H new ATOM 0 HB1 ALA A 67 6.225 -11.937 29.291 1.00 10.95 H new ATOM 0 HB2 ALA A 67 6.470 -13.160 28.315 1.00 10.95 H new ATOM 0 HB3 ALA A 67 6.264 -13.413 29.865 1.00 10.95 H new ATOM 487 N LYS A 68 8.715 -10.757 30.773 1.00 10.96 N ATOM 488 CA LYS A 68 8.922 -10.007 32.001 1.00 12.85 C ATOM 489 C LYS A 68 8.182 -8.681 31.892 1.00 10.87 C ATOM 490 O LYS A 68 8.343 -7.948 30.912 1.00 12.27 O ATOM 491 CB LYS A 68 10.400 -9.767 32.222 1.00 14.97 C ATOM 0 H LYS A 68 8.810 -10.293 30.055 1.00 10.96 H new ATOM 0 HA LYS A 68 8.581 -10.511 32.756 1.00 12.85 H new ATOM 492 N LEU A 69 7.359 -8.363 32.882 1.00 11.56 N ATOM 493 CA LEU A 69 6.703 -7.064 32.882 1.00 11.20 C ATOM 494 C LEU A 69 7.769 -5.978 32.950 1.00 11.69 C ATOM 495 O LEU A 69 8.684 -6.049 33.771 1.00 12.37 O ATOM 496 CB LEU A 69 5.749 -6.941 34.069 1.00 13.87 C ATOM 497 CG LEU A 69 5.020 -5.603 34.171 1.00 14.53 C ATOM 498 CD1 LEU A 69 3.969 -5.495 33.086 1.00 16.03 C ATOM 499 CD2 LEU A 69 4.388 -5.450 35.555 1.00 19.91 C ATOM 0 H LEU A 69 7.170 -8.872 33.549 1.00 11.56 H new ATOM 0 HA LEU A 69 6.183 -6.966 32.069 1.00 11.20 H new ATOM 0 HB2 LEU A 69 5.090 -7.650 34.012 1.00 13.87 H new ATOM 0 HB3 LEU A 69 6.251 -7.085 34.887 1.00 13.87 H new ATOM 0 HG LEU A 69 5.661 -4.886 34.047 1.00 14.53 H new ATOM 0 HD11 LEU A 69 3.513 -4.642 33.161 1.00 16.03 H new ATOM 0 HD12 LEU A 69 4.394 -5.559 32.216 1.00 16.03 H new ATOM 0 HD13 LEU A 69 3.326 -6.215 33.185 1.00 16.03 H new ATOM 0 HD21 LEU A 69 3.928 -4.598 35.609 1.00 19.91 H new ATOM 0 HD22 LEU A 69 3.754 -6.169 35.703 1.00 19.91 H new ATOM 0 HD23 LEU A 69 5.081 -5.486 36.233 1.00 19.91 H new ATOM 500 N LEU A 70 7.669 -4.978 32.083 1.00 10.01 N ATOM 501 CA LEU A 70 8.566 -3.831 32.163 1.00 9.62 C ATOM 502 C LEU A 70 7.910 -2.844 33.120 1.00 10.41 C ATOM 503 O LEU A 70 6.984 -2.115 32.754 1.00 10.95 O ATOM 504 CB LEU A 70 8.784 -3.204 30.787 1.00 11.71 C ATOM 505 CG LEU A 70 9.829 -2.089 30.737 1.00 11.18 C ATOM 506 CD1 LEU A 70 11.208 -2.576 31.202 1.00 12.62 C ATOM 507 CD2 LEU A 70 9.901 -1.518 29.337 1.00 11.76 C ATOM 0 H LEU A 70 7.093 -4.943 31.445 1.00 10.01 H new ATOM 0 HA LEU A 70 9.444 -4.095 32.481 1.00 9.62 H new ATOM 0 HB2 LEU A 70 9.047 -3.902 30.167 1.00 11.71 H new ATOM 0 HB3 LEU A 70 7.938 -2.849 30.472 1.00 11.71 H new ATOM 0 HG LEU A 70 9.555 -1.391 31.352 1.00 11.18 H new ATOM 0 HD11 LEU A 70 11.842 -1.844 31.157 1.00 12.62 H new ATOM 0 HD12 LEU A 70 11.148 -2.895 32.116 1.00 12.62 H new ATOM 0 HD13 LEU A 70 11.507 -3.298 30.628 1.00 12.62 H new ATOM 0 HD21 LEU A 70 10.565 -0.811 29.309 1.00 11.76 H new ATOM 0 HD22 LEU A 70 10.149 -2.219 28.714 1.00 11.76 H new ATOM 0 HD23 LEU A 70 9.035 -1.158 29.089 1.00 11.76 H new ATOM 508 N SER A 71 8.391 -2.847 34.362 1.00 10.34 N ATOM 509 CA SER A 71 7.682 -2.184 35.446 1.00 11.35 C ATOM 510 C SER A 71 7.485 -0.699 35.208 1.00 9.23 C ATOM 511 O SER A 71 8.447 0.015 34.954 1.00 10.90 O ATOM 512 CB SER A 71 8.436 -2.388 36.754 1.00 15.40 C ATOM 513 OG SER A 71 7.682 -1.875 37.838 1.00 22.22 O ATOM 0 H SER A 71 9.126 -3.228 34.595 1.00 10.34 H new ATOM 0 HA SER A 71 6.801 -2.587 35.491 1.00 11.35 H new ATOM 0 HB2 SER A 71 8.610 -3.332 36.891 1.00 15.40 H new ATOM 0 HB3 SER A 71 9.297 -1.944 36.711 1.00 15.40 H new ATOM 0 HG SER A 71 8.105 -1.993 38.554 1.00 22.22 H new ATOM 514 N GLY A 72 6.236 -0.255 35.296 1.00 9.39 N ATOM 515 CA GLY A 72 5.903 1.152 35.223 1.00 10.69 C ATOM 516 C GLY A 72 5.744 1.684 33.820 1.00 10.13 C ATOM 517 O GLY A 72 5.336 2.819 33.631 1.00 12.75 O ATOM 0 H GLY A 72 5.555 -0.770 35.401 1.00 9.39 H new ATOM 0 HA2 GLY A 72 5.078 1.303 35.710 1.00 10.69 H new ATOM 0 HA3 GLY A 72 6.595 1.661 35.673 1.00 10.69 H new ATOM 518 N ALA A 73 6.065 0.861 32.829 1.00 11.34 N ATOM 519 CA ALA A 73 6.038 1.320 31.445 1.00 11.32 C ATOM 520 C ALA A 73 4.644 1.252 30.832 1.00 10.70 C ATOM 521 O ALA A 73 3.933 0.263 30.984 1.00 13.00 O ATOM 522 CB ALA A 73 7.023 0.510 30.607 1.00 11.30 C ATOM 0 H ALA A 73 6.299 0.040 32.934 1.00 11.34 H new ATOM 0 HA ALA A 73 6.301 2.254 31.447 1.00 11.32 H new ATOM 0 HB1 ALA A 73 6.999 0.821 29.689 1.00 11.30 H new ATOM 0 HB2 ALA A 73 7.919 0.621 30.962 1.00 11.30 H new ATOM 0 HB3 ALA A 73 6.778 -0.428 30.637 1.00 11.30 H new ATOM 523 N THR A 74 4.264 2.318 30.142 1.00 11.20 N ATOM 524 CA THR A 74 3.013 2.331 29.401 1.00 10.30 C ATOM 525 C THR A 74 3.261 2.879 28.008 1.00 11.01 C ATOM 526 O THR A 74 4.313 3.449 27.723 1.00 11.91 O ATOM 527 CB THR A 74 1.939 3.194 30.103 1.00 12.11 C ATOM 528 OG1 THR A 74 2.395 4.545 30.212 1.00 13.95 O ATOM 529 CG2 THR A 74 1.624 2.640 31.489 1.00 16.33 C ATOM 0 H THR A 74 4.718 3.046 30.090 1.00 11.20 H new ATOM 0 HA THR A 74 2.683 1.420 29.355 1.00 10.30 H new ATOM 0 HB THR A 74 1.129 3.170 29.570 1.00 12.11 H new ATOM 0 HG1 THR A 74 2.133 4.984 29.545 1.00 13.95 H new ATOM 0 HG21 THR A 74 0.950 3.193 31.913 1.00 16.33 H new ATOM 0 HG22 THR A 74 1.292 1.732 31.407 1.00 16.33 H new ATOM 0 HG23 THR A 74 2.430 2.642 32.029 1.00 16.33 H new ATOM 530 N TRP A 75 2.275 2.711 27.138 1.00 11.25 N ATOM 531 CA TRP A 75 2.381 3.219 25.784 1.00 11.00 C ATOM 532 C TRP A 75 1.007 3.634 25.285 1.00 8.77 C ATOM 533 O TRP A 75 -0.022 3.149 25.756 1.00 11.44 O ATOM 534 CB TRP A 75 2.985 2.164 24.857 1.00 9.40 C ATOM 535 CG TRP A 75 2.145 0.945 24.736 1.00 10.47 C ATOM 536 CD1 TRP A 75 2.069 -0.095 25.616 1.00 9.94 C ATOM 537 CD2 TRP A 75 1.234 0.640 23.677 1.00 8.75 C ATOM 538 NE1 TRP A 75 1.177 -1.035 25.166 1.00 10.49 N ATOM 539 CE2 TRP A 75 0.657 -0.609 23.970 1.00 9.75 C ATOM 540 CE3 TRP A 75 0.869 1.292 22.494 1.00 10.11 C ATOM 541 CZ2 TRP A 75 -0.277 -1.215 23.134 1.00 10.62 C ATOM 542 CZ3 TRP A 75 -0.058 0.685 21.664 1.00 9.59 C ATOM 543 CH2 TRP A 75 -0.623 -0.551 21.990 1.00 10.54 C ATOM 0 H TRP A 75 1.537 2.305 27.314 1.00 11.25 H new ATOM 0 HA TRP A 75 2.967 3.992 25.785 1.00 11.00 H new ATOM 0 HB2 TRP A 75 3.113 2.550 23.977 1.00 9.40 H new ATOM 0 HB3 TRP A 75 3.862 1.914 25.188 1.00 9.40 H new ATOM 0 HD1 TRP A 75 2.553 -0.158 26.408 1.00 9.94 H new ATOM 0 HE1 TRP A 75 0.977 -1.769 25.567 1.00 10.49 H new ATOM 0 HE3 TRP A 75 1.241 2.115 22.270 1.00 10.11 H new ATOM 0 HZ2 TRP A 75 -0.651 -2.040 23.346 1.00 10.62 H new ATOM 0 HZ3 TRP A 75 -0.309 1.108 20.875 1.00 9.59 H new ATOM 0 HH2 TRP A 75 -1.248 -0.930 21.416 1.00 10.54 H new ATOM 544 N SER A 76 1.019 4.534 24.315 1.00 9.84 N ATOM 545 CA SER A 76 -0.202 5.051 23.725 1.00 11.02 C ATOM 546 C SER A 76 0.157 5.671 22.395 1.00 11.07 C ATOM 547 O SER A 76 1.020 6.540 22.314 1.00 12.98 O ATOM 548 CB SER A 76 -0.833 6.097 24.643 1.00 13.49 C ATOM 549 OG SER A 76 -2.057 6.566 24.092 1.00 15.39 O ATOM 0 H SER A 76 1.739 4.863 23.979 1.00 9.84 H new ATOM 0 HA SER A 76 -0.846 4.336 23.602 1.00 11.02 H new ATOM 0 HB2 SER A 76 -0.992 5.713 25.519 1.00 13.49 H new ATOM 0 HB3 SER A 76 -0.221 6.840 24.766 1.00 13.49 H new ATOM 0 HG SER A 76 -2.300 6.054 23.472 1.00 15.39 H new ATOM 550 N ILE A 77 -0.507 5.209 21.343 1.00 11.80 N ATOM 551 CA ILE A 77 -0.184 5.675 20.004 1.00 11.23 C ATOM 552 C ILE A 77 -1.446 6.069 19.248 1.00 12.27 C ATOM 553 O ILE A 77 -2.502 5.455 19.419 1.00 14.29 O ATOM 554 CB ILE A 77 0.619 4.592 19.235 1.00 13.09 C ATOM 555 CG1 ILE A 77 1.265 5.156 17.970 1.00 12.85 C ATOM 556 CG2 ILE A 77 -0.251 3.377 18.936 1.00 15.87 C ATOM 557 CD1 ILE A 77 2.403 4.299 17.453 1.00 13.82 C ATOM 0 H ILE A 77 -1.142 4.631 21.383 1.00 11.80 H new ATOM 0 HA ILE A 77 0.372 6.466 20.078 1.00 11.23 H new ATOM 0 HB ILE A 77 1.343 4.299 19.810 1.00 13.09 H new ATOM 0 HG12 ILE A 77 0.590 5.240 17.278 1.00 12.85 H new ATOM 0 HG13 ILE A 77 1.597 6.049 18.153 1.00 12.85 H new ATOM 0 HG21 ILE A 77 0.271 2.715 18.456 1.00 15.87 H new ATOM 0 HG22 ILE A 77 -0.570 2.995 19.768 1.00 15.87 H new ATOM 0 HG23 ILE A 77 -1.008 3.647 18.393 1.00 15.87 H new ATOM 0 HD11 ILE A 77 2.774 4.702 16.653 1.00 13.82 H new ATOM 0 HD12 ILE A 77 3.093 4.233 18.132 1.00 13.82 H new ATOM 0 HD13 ILE A 77 2.071 3.412 17.243 1.00 13.82 H new ATOM 558 N SER A 78 -1.327 7.119 18.446 1.00 15.08 N ATOM 559 CA SER A 78 -2.405 7.566 17.575 1.00 18.07 C ATOM 560 C SER A 78 -1.830 7.662 16.176 1.00 17.93 C ATOM 561 O SER A 78 -0.817 8.327 15.964 1.00 20.41 O ATOM 562 CB SER A 78 -2.913 8.941 18.009 1.00 22.65 C ATOM 563 OG SER A 78 -3.258 8.956 19.384 1.00 32.51 O ATOM 0 H SER A 78 -0.613 7.596 18.391 1.00 15.08 H new ATOM 0 HA SER A 78 -3.150 6.946 17.614 1.00 18.07 H new ATOM 0 HB2 SER A 78 -2.230 9.608 17.838 1.00 22.65 H new ATOM 0 HB3 SER A 78 -3.687 9.184 17.477 1.00 22.65 H new ATOM 0 HG SER A 78 -3.532 9.721 19.596 1.00 32.51 H new ATOM 564 N TYR A 79 -2.469 6.996 15.224 1.00 16.45 N ATOM 565 CA TYR A 79 -1.967 6.959 13.855 1.00 16.78 C ATOM 566 C TYR A 79 -2.633 8.028 12.988 1.00 20.23 C ATOM 567 O TYR A 79 -3.674 8.570 13.352 1.00 19.10 O ATOM 568 CB TYR A 79 -2.167 5.562 13.264 1.00 16.02 C ATOM 569 CG TYR A 79 -1.400 4.473 13.996 1.00 13.86 C ATOM 570 CD1 TYR A 79 -2.041 3.614 14.882 1.00 12.54 C ATOM 571 CD2 TYR A 79 -0.034 4.305 13.792 1.00 13.98 C ATOM 572 CE1 TYR A 79 -1.342 2.616 15.551 1.00 10.92 C ATOM 573 CE2 TYR A 79 0.675 3.312 14.457 1.00 11.68 C ATOM 574 CZ TYR A 79 0.013 2.468 15.329 1.00 11.39 C ATOM 575 OH TYR A 79 0.699 1.479 16.001 1.00 12.10 O ATOM 0 H TYR A 79 -3.198 6.557 15.349 1.00 16.45 H new ATOM 0 HA TYR A 79 -1.017 7.156 13.870 1.00 16.78 H new ATOM 0 HB2 TYR A 79 -3.113 5.346 13.278 1.00 16.02 H new ATOM 0 HB3 TYR A 79 -1.892 5.571 12.334 1.00 16.02 H new ATOM 0 HD1 TYR A 79 -2.954 3.709 15.030 1.00 12.54 H new ATOM 0 HD2 TYR A 79 0.412 4.867 13.200 1.00 13.98 H new ATOM 0 HE1 TYR A 79 -1.784 2.052 16.144 1.00 10.92 H new ATOM 0 HE2 TYR A 79 1.589 3.216 14.316 1.00 11.68 H new ATOM 0 HH TYR A 79 1.513 1.514 15.797 1.00 12.10 H new ATOM 576 N GLY A 80 -2.026 8.326 11.844 1.00 23.90 N ATOM 577 CA GLY A 80 -2.508 9.389 10.980 1.00 26.35 C ATOM 578 C GLY A 80 -3.927 9.208 10.473 1.00 26.12 C ATOM 579 O GLY A 80 -4.588 10.183 10.102 1.00 26.15 O ATOM 0 H GLY A 80 -1.328 7.919 11.551 1.00 23.90 H new ATOM 0 HA2 GLY A 80 -2.456 10.229 11.463 1.00 26.35 H new ATOM 0 HA3 GLY A 80 -1.913 9.463 10.217 1.00 26.35 H new ATOM 580 N ASP A 81 -4.396 7.962 10.450 1.00 24.15 N ATOM 581 CA ASP A 81 -5.737 7.647 9.962 1.00 25.45 C ATOM 582 C ASP A 81 -6.785 7.759 11.063 1.00 25.40 C ATOM 583 O ASP A 81 -7.966 7.498 10.834 1.00 27.41 O ATOM 584 CB ASP A 81 -5.780 6.235 9.394 1.00 25.39 C ATOM 585 CG ASP A 81 -5.813 5.182 10.480 1.00 24.90 C ATOM 586 OD1 ASP A 81 -5.155 5.391 11.521 1.00 23.79 O ATOM 587 OD2 ASP A 81 -6.505 4.162 10.303 1.00 28.45 O ATOM 0 H ASP A 81 -3.948 7.278 10.716 1.00 24.15 H new ATOM 0 HA ASP A 81 -5.942 8.294 9.269 1.00 25.45 H new ATOM 0 HB2 ASP A 81 -6.563 6.139 8.829 1.00 25.39 H new ATOM 0 HB3 ASP A 81 -5.004 6.091 8.830 1.00 25.39 H new ATOM 588 N GLY A 82 -6.355 8.129 12.263 1.00 20.84 N ATOM 589 CA GLY A 82 -7.285 8.318 13.359 1.00 19.12 C ATOM 590 C GLY A 82 -7.436 7.127 14.287 1.00 16.33 C ATOM 591 O GLY A 82 -8.140 7.219 15.290 1.00 17.35 O ATOM 0 H GLY A 82 -5.531 8.275 12.460 1.00 20.84 H new ATOM 0 HA2 GLY A 82 -6.997 9.083 13.881 1.00 19.12 H new ATOM 0 HA3 GLY A 82 -8.156 8.537 12.992 1.00 19.12 H new ATOM 592 N SER A 83 -6.793 6.006 13.962 1.00 16.31 N ATOM 593 CA ASER A 83 -6.860 4.832 14.828 0.70 16.22 C ATOM 594 CA BSER A 83 -6.837 4.819 14.807 0.30 16.21 C ATOM 595 C SER A 83 -5.858 4.962 15.970 1.00 12.92 C ATOM 596 O SER A 83 -4.978 5.813 15.938 1.00 14.90 O ATOM 597 CB ASER A 83 -6.634 3.533 14.044 0.70 15.79 C ATOM 598 CB BSER A 83 -6.507 3.575 13.982 0.30 15.84 C ATOM 599 OG ASER A 83 -5.290 3.392 13.620 0.70 15.03 O ATOM 600 OG BSER A 83 -7.274 3.544 12.789 0.30 13.83 O ATOM 0 H ASER A 83 -6.318 5.906 13.252 0.70 16.31 H new ATOM 0 H BSER A 83 -6.322 5.915 13.248 0.30 16.31 H new ATOM 0 HA ASER A 83 -7.754 4.787 15.201 0.70 16.21 H new ATOM 0 HA BSER A 83 -7.732 4.724 15.168 0.30 16.21 H new ATOM 0 HB2ASER A 83 -6.878 2.776 14.599 0.70 15.84 H new ATOM 0 HB2BSER A 83 -5.562 3.568 13.764 0.30 15.84 H new ATOM 0 HB3ASER A 83 -7.219 3.518 13.270 0.70 15.84 H new ATOM 0 HB3BSER A 83 -6.684 2.778 14.506 0.30 15.84 H new ATOM 0 HG ASER A 83 -4.966 2.688 13.944 0.70 13.83 H new ATOM 0 HG BSER A 83 -6.772 3.679 12.129 0.30 13.83 H new ATOM 601 N SER A 84 -6.016 4.124 16.986 1.00 12.88 N ATOM 602 CA SER A 84 -5.179 4.235 18.175 1.00 11.71 C ATOM 603 C SER A 84 -5.201 2.964 19.002 1.00 11.80 C ATOM 604 O SER A 84 -6.067 2.101 18.840 1.00 13.64 O ATOM 605 CB SER A 84 -5.650 5.402 19.042 1.00 14.24 C ATOM 606 OG SER A 84 -6.979 5.185 19.485 1.00 15.26 O ATOM 0 H SER A 84 -6.596 3.489 17.009 1.00 12.88 H new ATOM 0 HA SER A 84 -4.270 4.388 17.874 1.00 11.71 H new ATOM 0 HB2 SER A 84 -5.061 5.503 19.806 1.00 14.24 H new ATOM 0 HB3 SER A 84 -5.603 6.228 18.536 1.00 14.24 H new ATOM 0 HG SER A 84 -7.516 5.531 18.940 1.00 15.26 H new ATOM 607 N SER A 85 -4.223 2.867 19.897 1.00 11.45 N ATOM 608 CA SER A 85 -4.148 1.772 20.844 1.00 10.91 C ATOM 609 C SER A 85 -3.239 2.184 22.000 1.00 10.21 C ATOM 610 O SER A 85 -2.489 3.150 21.885 1.00 11.39 O ATOM 611 CB SER A 85 -3.622 0.512 20.154 1.00 11.59 C ATOM 612 OG SER A 85 -2.430 0.786 19.438 1.00 11.89 O ATOM 0 H SER A 85 -3.584 3.438 19.969 1.00 11.45 H new ATOM 0 HA SER A 85 -5.032 1.571 21.190 1.00 10.91 H new ATOM 0 HB2 SER A 85 -3.455 -0.177 20.816 1.00 11.59 H new ATOM 0 HB3 SER A 85 -4.295 0.166 19.548 1.00 11.59 H new ATOM 0 HG SER A 85 -2.257 0.144 18.925 1.00 11.89 H new ATOM 613 N SER A 86 -3.335 1.471 23.115 1.00 10.70 N ATOM 614 CA SER A 86 -2.528 1.787 24.291 1.00 10.16 C ATOM 615 C SER A 86 -2.488 0.597 25.242 1.00 9.19 C ATOM 616 O SER A 86 -3.328 -0.295 25.180 1.00 12.26 O ATOM 617 CB SER A 86 -3.107 3.001 25.019 1.00 10.52 C ATOM 618 OG SER A 86 -4.423 2.724 25.488 1.00 14.63 O ATOM 0 H SER A 86 -3.862 0.798 23.213 1.00 10.70 H new ATOM 0 HA SER A 86 -1.626 1.990 23.997 1.00 10.16 H new ATOM 0 HB2 SER A 86 -2.536 3.239 25.766 1.00 10.52 H new ATOM 0 HB3 SER A 86 -3.125 3.765 24.421 1.00 10.52 H new ATOM 0 HG SER A 86 -4.381 2.363 26.245 1.00 14.63 H new ATOM 619 N GLY A 87 -1.515 0.596 26.148 1.00 10.38 N ATOM 620 CA GLY A 87 -1.452 -0.442 27.157 1.00 11.91 C ATOM 621 C GLY A 87 -0.187 -0.419 27.989 1.00 10.43 C ATOM 622 O GLY A 87 0.371 0.642 28.264 1.00 11.40 O ATOM 0 H GLY A 87 -0.889 1.184 26.192 1.00 10.38 H new ATOM 0 HA2 GLY A 87 -2.217 -0.353 27.747 1.00 11.91 H new ATOM 0 HA3 GLY A 87 -1.527 -1.306 26.723 1.00 11.91 H new ATOM 623 N ASP A 88 0.258 -1.602 28.391 1.00 10.33 N ATOM 624 CA ASP A 88 1.489 -1.735 29.166 1.00 11.42 C ATOM 625 C ASP A 88 2.535 -2.520 28.378 1.00 11.18 C ATOM 626 O ASP A 88 2.337 -2.791 27.190 1.00 11.41 O ATOM 627 CB ASP A 88 1.240 -2.331 30.560 1.00 14.47 C ATOM 628 CG ASP A 88 0.418 -3.594 30.527 1.00 20.26 C ATOM 629 OD1 ASP A 88 0.376 -4.271 29.480 1.00 15.75 O ATOM 630 OD2 ASP A 88 -0.190 -3.915 31.571 1.00 26.38 O ATOM 0 H ASP A 88 -0.140 -2.346 28.225 1.00 10.33 H new ATOM 0 HA ASP A 88 1.840 -0.844 29.319 1.00 11.42 H new ATOM 0 HB2 ASP A 88 2.093 -2.518 30.983 1.00 14.47 H new ATOM 0 HB3 ASP A 88 0.789 -1.673 31.111 1.00 14.47 H new ATOM 631 N VAL A 89 3.644 -2.872 29.014 1.00 10.61 N ATOM 632 CA VAL A 89 4.794 -3.354 28.257 1.00 10.97 C ATOM 633 C VAL A 89 5.467 -4.540 28.923 1.00 10.68 C ATOM 634 O VAL A 89 5.681 -4.543 30.134 1.00 10.98 O ATOM 635 CB VAL A 89 5.859 -2.237 28.055 1.00 9.65 C ATOM 636 CG1 VAL A 89 6.965 -2.720 27.121 1.00 10.89 C ATOM 637 CG2 VAL A 89 5.218 -0.975 27.510 1.00 9.92 C ATOM 0 H VAL A 89 3.753 -2.841 29.867 1.00 10.61 H new ATOM 0 HA VAL A 89 4.441 -3.631 27.397 1.00 10.97 H new ATOM 0 HB VAL A 89 6.251 -2.030 28.918 1.00 9.65 H new ATOM 0 HG11 VAL A 89 7.621 -2.015 27.004 1.00 10.89 H new ATOM 0 HG12 VAL A 89 7.395 -3.501 27.504 1.00 10.89 H new ATOM 0 HG13 VAL A 89 6.583 -2.952 26.260 1.00 10.89 H new ATOM 0 HG21 VAL A 89 5.897 -0.292 27.391 1.00 9.92 H new ATOM 0 HG22 VAL A 89 4.800 -1.167 26.656 1.00 9.92 H new ATOM 0 HG23 VAL A 89 4.546 -0.658 28.134 1.00 9.92 H new ATOM 638 N TYR A 90 5.803 -5.537 28.115 1.00 10.11 N ATOM 639 CA TYR A 90 6.623 -6.661 28.532 1.00 10.27 C ATOM 640 C TYR A 90 7.890 -6.666 27.701 1.00 10.99 C ATOM 641 O TYR A 90 7.942 -6.061 26.629 1.00 12.78 O ATOM 642 CB TYR A 90 5.870 -7.980 28.318 1.00 11.68 C ATOM 643 CG TYR A 90 4.686 -8.132 29.235 1.00 11.68 C ATOM 644 CD1 TYR A 90 4.784 -8.872 30.403 1.00 13.55 C ATOM 645 CD2 TYR A 90 3.484 -7.500 28.955 1.00 13.92 C ATOM 646 CE1 TYR A 90 3.710 -8.996 31.256 1.00 15.73 C ATOM 647 CE2 TYR A 90 2.406 -7.617 29.800 1.00 14.62 C ATOM 648 CZ TYR A 90 2.528 -8.364 30.952 1.00 17.99 C ATOM 649 OH TYR A 90 1.451 -8.483 31.798 1.00 21.19 O ATOM 0 H TYR A 90 5.555 -5.578 27.293 1.00 10.11 H new ATOM 0 HA TYR A 90 6.835 -6.575 29.475 1.00 10.27 H new ATOM 0 HB2 TYR A 90 5.569 -8.030 27.397 1.00 11.68 H new ATOM 0 HB3 TYR A 90 6.479 -8.722 28.458 1.00 11.68 H new ATOM 0 HD1 TYR A 90 5.587 -9.291 30.614 1.00 13.55 H new ATOM 0 HD2 TYR A 90 3.406 -6.988 28.182 1.00 13.92 H new ATOM 0 HE1 TYR A 90 3.784 -9.503 32.032 1.00 15.73 H new ATOM 0 HE2 TYR A 90 1.602 -7.196 29.596 1.00 14.62 H new ATOM 0 HH TYR A 90 0.794 -8.070 31.476 1.00 21.19 H new ATOM 650 N THR A 91 8.932 -7.311 28.195 1.00 10.74 N ATOM 651 CA THR A 91 10.022 -7.695 27.315 1.00 10.79 C ATOM 652 C THR A 91 9.936 -9.199 27.116 1.00 9.86 C ATOM 653 O THR A 91 9.511 -9.929 28.013 1.00 10.83 O ATOM 654 CB THR A 91 11.403 -7.282 27.854 1.00 13.75 C ATOM 655 OG1 THR A 91 11.601 -7.843 29.155 1.00 15.37 O ATOM 656 CG2 THR A 91 11.488 -5.769 27.939 1.00 13.88 C ATOM 0 H THR A 91 9.029 -7.533 29.020 1.00 10.74 H new ATOM 0 HA THR A 91 9.929 -7.227 26.470 1.00 10.79 H new ATOM 0 HB THR A 91 12.090 -7.611 27.253 1.00 13.75 H new ATOM 0 HG1 THR A 91 12.422 -7.864 29.329 1.00 15.37 H new ATOM 0 HG21 THR A 91 12.359 -5.512 28.279 1.00 13.88 H new ATOM 0 HG22 THR A 91 11.361 -5.387 27.056 1.00 13.88 H new ATOM 0 HG23 THR A 91 10.798 -5.439 28.536 1.00 13.88 H new ATOM 657 N ASP A 92 10.296 -9.664 25.924 1.00 9.93 N ATOM 658 CA ASP A 92 10.225 -11.090 25.626 1.00 9.76 C ATOM 659 C ASP A 92 11.062 -11.349 24.388 1.00 8.55 C ATOM 660 O ASP A 92 11.545 -10.409 23.742 1.00 10.13 O ATOM 661 CB ASP A 92 8.768 -11.521 25.398 1.00 9.79 C ATOM 662 CG ASP A 92 8.517 -12.987 25.744 1.00 10.40 C ATOM 663 OD1 ASP A 92 7.339 -13.344 25.967 1.00 9.84 O ATOM 664 OD2 ASP A 92 9.487 -13.779 25.790 1.00 10.60 O ATOM 0 H ASP A 92 10.582 -9.174 25.278 1.00 9.93 H new ATOM 0 HA ASP A 92 10.566 -11.607 26.372 1.00 9.76 H new ATOM 0 HB2 ASP A 92 8.183 -10.963 25.934 1.00 9.79 H new ATOM 0 HB3 ASP A 92 8.533 -11.368 24.469 1.00 9.79 H new ATOM 665 N THR A 93 11.232 -12.624 24.068 1.00 9.22 N ATOM 666 CA THR A 93 11.979 -13.042 22.894 1.00 8.91 C ATOM 667 C THR A 93 11.071 -12.952 21.673 1.00 8.86 C ATOM 668 O THR A 93 9.950 -13.473 21.686 1.00 10.87 O ATOM 669 CB THR A 93 12.475 -14.469 23.078 1.00 10.62 C ATOM 670 OG1 THR A 93 13.317 -14.503 24.237 1.00 13.08 O ATOM 671 CG2 THR A 93 13.269 -14.924 21.864 1.00 11.49 C ATOM 0 H THR A 93 10.914 -13.276 24.530 1.00 9.22 H new ATOM 0 HA THR A 93 12.747 -12.463 22.769 1.00 8.91 H new ATOM 0 HB THR A 93 11.716 -15.064 23.185 1.00 10.62 H new ATOM 0 HG1 THR A 93 13.787 -15.199 24.222 1.00 13.08 H new ATOM 0 HG21 THR A 93 13.576 -15.834 22.000 1.00 11.49 H new ATOM 0 HG22 THR A 93 12.705 -14.888 21.076 1.00 11.49 H new ATOM 0 HG23 THR A 93 14.034 -14.340 21.740 1.00 11.49 H new ATOM 672 N VAL A 94 11.544 -12.271 20.631 1.00 8.78 N ATOM 673 CA VAL A 94 10.778 -12.074 19.403 1.00 8.32 C ATOM 674 C VAL A 94 11.616 -12.541 18.219 1.00 8.21 C ATOM 675 O VAL A 94 12.781 -12.164 18.097 1.00 8.65 O ATOM 676 CB VAL A 94 10.397 -10.595 19.230 1.00 8.40 C ATOM 677 CG1 VAL A 94 9.760 -10.341 17.867 1.00 9.62 C ATOM 678 CG2 VAL A 94 9.445 -10.183 20.335 1.00 9.24 C ATOM 0 H VAL A 94 12.324 -11.908 20.617 1.00 8.78 H new ATOM 0 HA VAL A 94 9.958 -12.591 19.451 1.00 8.32 H new ATOM 0 HB VAL A 94 11.207 -10.063 19.282 1.00 8.40 H new ATOM 0 HG11 VAL A 94 9.531 -9.402 17.787 1.00 9.62 H new ATOM 0 HG12 VAL A 94 10.387 -10.581 17.167 1.00 9.62 H new ATOM 0 HG13 VAL A 94 8.957 -10.878 17.780 1.00 9.62 H new ATOM 0 HG21 VAL A 94 9.205 -9.250 20.225 1.00 9.24 H new ATOM 0 HG22 VAL A 94 8.644 -10.729 20.293 1.00 9.24 H new ATOM 0 HG23 VAL A 94 9.875 -10.306 21.196 1.00 9.24 H new ATOM 679 N SER A 95 11.034 -13.377 17.363 1.00 8.36 N ATOM 680 CA SER A 95 11.723 -13.880 16.175 1.00 8.00 C ATOM 681 C SER A 95 10.916 -13.595 14.917 1.00 7.57 C ATOM 682 O SER A 95 9.694 -13.771 14.892 1.00 8.94 O ATOM 683 CB SER A 95 11.981 -15.383 16.291 1.00 9.27 C ATOM 684 OG SER A 95 12.848 -15.655 17.376 1.00 11.30 O ATOM 0 H SER A 95 10.230 -13.669 17.453 1.00 8.36 H new ATOM 0 HA SER A 95 12.574 -13.419 16.112 1.00 8.00 H new ATOM 0 HB2 SER A 95 11.141 -15.852 16.416 1.00 9.27 H new ATOM 0 HB3 SER A 95 12.371 -15.714 15.467 1.00 9.27 H new ATOM 0 HG SER A 95 12.493 -16.223 17.883 1.00 11.30 H new ATOM 685 N VAL A 96 11.613 -13.149 13.879 1.00 7.82 N ATOM 686 CA VAL A 96 11.010 -12.909 12.574 1.00 7.53 C ATOM 687 C VAL A 96 11.814 -13.685 11.546 1.00 7.62 C ATOM 688 O VAL A 96 12.995 -13.398 11.318 1.00 9.00 O ATOM 689 CB VAL A 96 11.032 -11.419 12.199 1.00 7.92 C ATOM 690 CG1 VAL A 96 10.471 -11.223 10.802 1.00 10.74 C ATOM 691 CG2 VAL A 96 10.263 -10.605 13.219 1.00 9.55 C ATOM 0 H VAL A 96 12.455 -12.976 13.912 1.00 7.82 H new ATOM 0 HA VAL A 96 10.083 -13.194 12.599 1.00 7.53 H new ATOM 0 HB VAL A 96 11.950 -11.107 12.202 1.00 7.92 H new ATOM 0 HG11 VAL A 96 10.489 -10.280 10.575 1.00 10.74 H new ATOM 0 HG12 VAL A 96 11.008 -11.719 10.165 1.00 10.74 H new ATOM 0 HG13 VAL A 96 9.556 -11.545 10.772 1.00 10.74 H new ATOM 0 HG21 VAL A 96 10.286 -9.668 12.969 1.00 9.55 H new ATOM 0 HG22 VAL A 96 9.342 -10.909 13.248 1.00 9.55 H new ATOM 0 HG23 VAL A 96 10.668 -10.716 14.094 1.00 9.55 H new ATOM 692 N GLY A 97 11.183 -14.675 10.929 1.00 8.54 N ATOM 693 CA GLY A 97 11.818 -15.410 9.857 1.00 10.07 C ATOM 694 C GLY A 97 13.171 -15.974 10.234 1.00 9.77 C ATOM 695 O GLY A 97 14.076 -15.975 9.406 1.00 10.43 O ATOM 0 H GLY A 97 10.385 -14.934 11.119 1.00 8.54 H new ATOM 0 HA2 GLY A 97 11.237 -16.137 9.584 1.00 10.07 H new ATOM 0 HA3 GLY A 97 11.921 -14.825 9.090 1.00 10.07 H new ATOM 696 N GLY A 98 13.319 -16.454 11.467 1.00 9.95 N ATOM 697 CA GLY A 98 14.581 -17.051 11.890 1.00 11.45 C ATOM 698 C GLY A 98 15.557 -16.128 12.604 1.00 12.60 C ATOM 699 O GLY A 98 16.561 -16.588 13.165 1.00 13.82 O ATOM 0 H GLY A 98 12.705 -16.443 12.069 1.00 9.95 H new ATOM 0 HA2 GLY A 98 14.383 -17.798 12.477 1.00 11.45 H new ATOM 0 HA3 GLY A 98 15.023 -17.415 11.107 1.00 11.45 H new ATOM 700 N LEU A 99 15.278 -14.829 12.578 1.00 9.92 N ATOM 701 CA LEU A 99 16.089 -13.840 13.280 1.00 8.89 C ATOM 702 C LEU A 99 15.500 -13.553 14.654 1.00 8.34 C ATOM 703 O LEU A 99 14.343 -13.155 14.758 1.00 9.48 O ATOM 704 CB LEU A 99 16.147 -12.548 12.465 1.00 9.60 C ATOM 705 CG LEU A 99 16.763 -11.325 13.146 1.00 10.07 C ATOM 706 CD1 LEU A 99 18.238 -11.542 13.410 1.00 11.70 C ATOM 707 CD2 LEU A 99 16.556 -10.088 12.284 1.00 10.36 C ATOM 0 H LEU A 99 14.610 -14.495 12.151 1.00 9.92 H new ATOM 0 HA LEU A 99 16.986 -14.193 13.391 1.00 8.89 H new ATOM 0 HB2 LEU A 99 16.648 -12.726 11.654 1.00 9.60 H new ATOM 0 HB3 LEU A 99 15.243 -12.320 12.196 1.00 9.60 H new ATOM 0 HG LEU A 99 16.320 -11.192 13.999 1.00 10.07 H new ATOM 0 HD11 LEU A 99 18.609 -10.756 13.841 1.00 11.70 H new ATOM 0 HD12 LEU A 99 18.354 -12.312 13.988 1.00 11.70 H new ATOM 0 HD13 LEU A 99 18.698 -11.696 12.570 1.00 11.70 H new ATOM 0 HD21 LEU A 99 16.949 -9.318 12.723 1.00 10.36 H new ATOM 0 HD22 LEU A 99 16.980 -10.220 11.422 1.00 10.36 H new ATOM 0 HD23 LEU A 99 15.606 -9.937 12.157 1.00 10.36 H new ATOM 708 N THR A 100 16.297 -13.734 15.704 1.00 9.62 N ATOM 709 CA THR A 100 15.806 -13.641 17.075 1.00 11.06 C ATOM 710 C THR A 100 16.398 -12.467 17.837 1.00 11.12 C ATOM 711 O THR A 100 17.617 -12.255 17.825 1.00 11.71 O ATOM 712 CB THR A 100 16.121 -14.940 17.848 1.00 11.36 C ATOM 713 OG1 THR A 100 15.475 -16.041 17.202 1.00 12.72 O ATOM 714 CG2 THR A 100 15.650 -14.856 19.300 1.00 11.92 C ATOM 0 H THR A 100 17.136 -13.914 15.641 1.00 9.62 H new ATOM 0 HA THR A 100 14.848 -13.505 17.011 1.00 11.06 H new ATOM 0 HB THR A 100 17.083 -15.066 17.850 1.00 11.36 H new ATOM 0 HG1 THR A 100 14.647 -16.000 17.339 1.00 12.72 H new ATOM 0 HG21 THR A 100 15.862 -15.685 19.758 1.00 11.92 H new ATOM 0 HG22 THR A 100 16.098 -14.119 19.744 1.00 11.92 H new ATOM 0 HG23 THR A 100 14.691 -14.711 19.321 1.00 11.92 H new ATOM 715 N VAL A 101 15.525 -11.706 18.492 1.00 9.76 N ATOM 716 CA VAL A 101 15.927 -10.661 19.428 1.00 12.24 C ATOM 717 C VAL A 101 15.430 -11.023 20.820 1.00 11.73 C ATOM 718 O VAL A 101 14.245 -11.269 21.015 1.00 12.14 O ATOM 719 CB VAL A 101 15.333 -9.293 19.029 1.00 9.64 C ATOM 720 CG1 VAL A 101 15.534 -8.269 20.132 1.00 13.57 C ATOM 721 CG2 VAL A 101 15.946 -8.819 17.717 1.00 12.39 C ATOM 0 H VAL A 101 14.673 -11.783 18.404 1.00 9.76 H new ATOM 0 HA VAL A 101 16.895 -10.594 19.413 1.00 12.24 H new ATOM 0 HB VAL A 101 14.377 -9.396 18.900 1.00 9.64 H new ATOM 0 HG11 VAL A 101 15.153 -7.420 19.859 1.00 13.57 H new ATOM 0 HG12 VAL A 101 15.095 -8.574 20.941 1.00 13.57 H new ATOM 0 HG13 VAL A 101 16.483 -8.158 20.302 1.00 13.57 H new ATOM 0 HG21 VAL A 101 15.567 -7.960 17.474 1.00 12.39 H new ATOM 0 HG22 VAL A 101 16.906 -8.731 17.822 1.00 12.39 H new ATOM 0 HG23 VAL A 101 15.755 -9.465 17.019 1.00 12.39 H new ATOM 722 N THR A 102 16.339 -11.070 21.786 1.00 11.88 N ATOM 723 CA THR A 102 15.936 -11.235 23.179 1.00 12.47 C ATOM 724 C THR A 102 15.734 -9.877 23.834 1.00 10.62 C ATOM 725 O THR A 102 16.360 -8.897 23.449 1.00 12.80 O ATOM 726 CB THR A 102 16.956 -12.069 23.984 1.00 13.78 C ATOM 727 OG1 THR A 102 18.251 -11.460 23.914 1.00 15.28 O ATOM 728 CG2 THR A 102 17.038 -13.484 23.431 1.00 15.45 C ATOM 0 H THR A 102 17.187 -11.009 21.659 1.00 11.88 H new ATOM 0 HA THR A 102 15.097 -11.721 23.182 1.00 12.47 H new ATOM 0 HB THR A 102 16.662 -12.104 24.908 1.00 13.78 H new ATOM 0 HG1 THR A 102 18.173 -10.665 23.655 1.00 15.28 H new ATOM 0 HG21 THR A 102 17.682 -13.996 23.945 1.00 15.45 H new ATOM 0 HG22 THR A 102 16.167 -13.906 23.492 1.00 15.45 H new ATOM 0 HG23 THR A 102 17.318 -13.453 22.503 1.00 15.45 H new ATOM 729 N GLY A 103 14.832 -9.818 24.804 1.00 11.34 N ATOM 730 CA GLY A 103 14.567 -8.578 25.510 1.00 13.16 C ATOM 731 C GLY A 103 13.888 -7.500 24.675 1.00 10.80 C ATOM 732 O GLY A 103 13.999 -6.313 24.977 1.00 12.49 O ATOM 0 H GLY A 103 14.362 -10.488 25.068 1.00 11.34 H new ATOM 0 HA2 GLY A 103 14.010 -8.772 26.280 1.00 13.16 H new ATOM 0 HA3 GLY A 103 15.406 -8.227 25.848 1.00 13.16 H new ATOM 733 N GLN A 104 13.171 -7.904 23.632 1.00 10.01 N ATOM 734 CA GLN A 104 12.399 -6.958 22.837 1.00 9.30 C ATOM 735 C GLN A 104 11.199 -6.429 23.616 1.00 8.39 C ATOM 736 O GLN A 104 10.473 -7.197 24.246 1.00 8.91 O ATOM 737 CB GLN A 104 11.924 -7.632 21.544 1.00 9.33 C ATOM 738 CG GLN A 104 10.954 -6.789 20.717 1.00 10.29 C ATOM 739 CD GLN A 104 11.617 -5.561 20.124 1.00 8.23 C ATOM 740 OE1 GLN A 104 12.734 -5.635 19.615 1.00 10.35 O ATOM 741 NE2 GLN A 104 10.946 -4.419 20.215 1.00 9.71 N ATOM 0 H GLN A 104 13.118 -8.721 23.369 1.00 10.01 H new ATOM 0 HA GLN A 104 12.973 -6.206 22.621 1.00 9.30 H new ATOM 0 HB2 GLN A 104 12.698 -7.844 20.999 1.00 9.33 H new ATOM 0 HB3 GLN A 104 11.496 -8.473 21.768 1.00 9.33 H new ATOM 0 HG2 GLN A 104 10.586 -7.332 20.002 1.00 10.29 H new ATOM 0 HG3 GLN A 104 10.211 -6.514 21.276 1.00 10.29 H new ATOM 0 HE21 GLN A 104 10.166 -4.406 20.578 1.00 9.71 H new ATOM 0 HE22 GLN A 104 11.291 -3.692 19.911 1.00 9.71 H new ATOM 742 N ALA A 105 10.973 -5.122 23.549 1.00 9.27 N ATOM 743 CA ALA A 105 9.762 -4.551 24.120 1.00 8.23 C ATOM 744 C ALA A 105 8.551 -4.952 23.290 1.00 8.40 C ATOM 745 O ALA A 105 8.453 -4.629 22.095 1.00 9.08 O ATOM 746 CB ALA A 105 9.861 -3.038 24.209 1.00 9.82 C ATOM 0 H ALA A 105 11.503 -4.554 23.181 1.00 9.27 H new ATOM 0 HA ALA A 105 9.658 -4.899 25.019 1.00 8.23 H new ATOM 0 HB1 ALA A 105 9.044 -2.682 24.592 1.00 9.82 H new ATOM 0 HB2 ALA A 105 10.613 -2.795 24.771 1.00 9.82 H new ATOM 0 HB3 ALA A 105 9.989 -2.669 23.321 1.00 9.82 H new ATOM 747 N VAL A 106 7.641 -5.674 23.932 1.00 7.93 N ATOM 748 CA VAL A 106 6.385 -6.099 23.331 1.00 7.70 C ATOM 749 C VAL A 106 5.277 -5.344 24.053 1.00 8.44 C ATOM 750 O VAL A 106 5.027 -5.554 25.252 1.00 9.60 O ATOM 751 CB VAL A 106 6.186 -7.622 23.461 1.00 8.83 C ATOM 752 CG1 VAL A 106 4.836 -8.034 22.890 1.00 9.50 C ATOM 753 CG2 VAL A 106 7.314 -8.358 22.746 1.00 11.23 C ATOM 0 H VAL A 106 7.739 -5.936 24.745 1.00 7.93 H new ATOM 0 HA VAL A 106 6.379 -5.903 22.381 1.00 7.70 H new ATOM 0 HB VAL A 106 6.204 -7.860 24.401 1.00 8.83 H new ATOM 0 HG11 VAL A 106 4.726 -8.994 22.979 1.00 9.50 H new ATOM 0 HG12 VAL A 106 4.128 -7.581 23.374 1.00 9.50 H new ATOM 0 HG13 VAL A 106 4.793 -7.790 21.952 1.00 9.50 H new ATOM 0 HG21 VAL A 106 7.182 -9.315 22.832 1.00 11.23 H new ATOM 0 HG22 VAL A 106 7.315 -8.115 21.807 1.00 11.23 H new ATOM 0 HG23 VAL A 106 8.164 -8.112 23.144 1.00 11.23 H new ATOM 754 N GLU A 107 4.631 -4.442 23.332 1.00 8.51 N ATOM 755 CA GLU A 107 3.654 -3.548 23.926 1.00 8.73 C ATOM 756 C GLU A 107 2.288 -4.218 23.882 1.00 9.46 C ATOM 757 O GLU A 107 1.742 -4.478 22.811 1.00 11.14 O ATOM 758 CB GLU A 107 3.682 -2.209 23.194 1.00 8.11 C ATOM 759 CG GLU A 107 5.073 -1.578 23.251 1.00 10.66 C ATOM 760 CD GLU A 107 5.219 -0.368 22.378 1.00 9.02 C ATOM 761 OE1 GLU A 107 6.323 -0.156 21.828 1.00 9.86 O ATOM 762 OE2 GLU A 107 4.231 0.380 22.243 1.00 10.30 O ATOM 0 H GLU A 107 4.746 -4.331 22.487 1.00 8.51 H new ATOM 0 HA GLU A 107 3.863 -3.367 24.856 1.00 8.73 H new ATOM 0 HB2 GLU A 107 3.420 -2.337 22.269 1.00 8.11 H new ATOM 0 HB3 GLU A 107 3.034 -1.606 23.591 1.00 8.11 H new ATOM 0 HG2 GLU A 107 5.271 -1.332 24.168 1.00 10.66 H new ATOM 0 HG3 GLU A 107 5.731 -2.240 22.987 1.00 10.66 H new ATOM 763 N SER A 108 1.762 -4.536 25.056 1.00 10.18 N ATOM 764 CA SER A 108 0.520 -5.282 25.184 1.00 10.91 C ATOM 765 C SER A 108 -0.658 -4.330 25.238 1.00 10.41 C ATOM 766 O SER A 108 -0.719 -3.457 26.101 1.00 12.54 O ATOM 767 CB SER A 108 0.579 -6.117 26.462 1.00 12.85 C ATOM 768 OG SER A 108 -0.691 -6.661 26.778 1.00 14.80 O ATOM 0 H SER A 108 2.120 -4.323 25.808 1.00 10.18 H new ATOM 0 HA SER A 108 0.407 -5.864 24.416 1.00 10.91 H new ATOM 0 HB2 SER A 108 1.223 -6.834 26.353 1.00 12.85 H new ATOM 0 HB3 SER A 108 0.890 -5.566 27.197 1.00 12.85 H new ATOM 0 HG SER A 108 -0.856 -6.534 27.592 1.00 14.80 H new ATOM 769 N ALA A 109 -1.592 -4.490 24.309 1.00 9.86 N ATOM 770 CA ALA A 109 -2.721 -3.575 24.241 1.00 11.61 C ATOM 771 C ALA A 109 -3.744 -3.838 25.335 1.00 12.17 C ATOM 772 O ALA A 109 -4.176 -4.971 25.535 1.00 13.30 O ATOM 773 CB ALA A 109 -3.391 -3.644 22.871 1.00 10.76 C ATOM 0 H ALA A 109 -1.591 -5.113 23.716 1.00 9.86 H new ATOM 0 HA ALA A 109 -2.367 -2.682 24.379 1.00 11.61 H new ATOM 0 HB1 ALA A 109 -4.140 -3.028 22.845 1.00 10.76 H new ATOM 0 HB2 ALA A 109 -2.750 -3.402 22.185 1.00 10.76 H new ATOM 0 HB3 ALA A 109 -3.709 -4.546 22.711 1.00 10.76 H new ATOM 774 N LYS A 110 -4.125 -2.780 26.045 1.00 11.05 N ATOM 775 CA LYS A 110 -5.285 -2.853 26.918 1.00 13.08 C ATOM 776 C LYS A 110 -6.501 -2.288 26.189 1.00 11.38 C ATOM 777 O LYS A 110 -7.630 -2.714 26.432 1.00 14.67 O ATOM 778 CB LYS A 110 -5.034 -2.100 28.224 1.00 14.33 C ATOM 779 CG LYS A 110 -3.970 -2.737 29.099 1.00 17.12 C ATOM 780 CD LYS A 110 -3.701 -1.891 30.334 1.00 22.16 C ATOM 781 CE LYS A 110 -4.103 -2.618 31.610 1.00 31.78 C ATOM 782 NZ LYS A 110 -3.227 -3.791 31.883 1.00 37.84 N ATOM 0 H LYS A 110 -3.727 -2.018 26.034 1.00 11.05 H new ATOM 0 HA LYS A 110 -5.453 -3.781 27.145 1.00 13.08 H new ATOM 0 HB2 LYS A 110 -4.770 -1.190 28.018 1.00 14.33 H new ATOM 0 HB3 LYS A 110 -5.864 -2.048 28.723 1.00 14.33 H new ATOM 0 HG2 LYS A 110 -4.256 -3.624 29.367 1.00 17.12 H new ATOM 0 HG3 LYS A 110 -3.150 -2.844 28.591 1.00 17.12 H new ATOM 0 HD2 LYS A 110 -2.759 -1.665 30.373 1.00 22.16 H new ATOM 0 HD3 LYS A 110 -4.191 -1.056 30.268 1.00 22.16 H new ATOM 0 HE2 LYS A 110 -4.061 -2.003 32.359 1.00 31.78 H new ATOM 0 HE3 LYS A 110 -5.024 -2.913 31.537 1.00 31.78 H new ATOM 0 HZ1 LYS A 110 -3.298 -4.022 32.740 1.00 37.84 H new ATOM 0 HZ2 LYS A 110 -3.477 -4.474 31.370 1.00 37.84 H new ATOM 0 HZ3 LYS A 110 -2.382 -3.579 31.702 1.00 37.84 H new ATOM 783 N LYS A 111 -6.262 -1.350 25.278 1.00 12.34 N ATOM 784 CA LYS A 111 -7.325 -0.730 24.495 1.00 16.56 C ATOM 785 C LYS A 111 -6.887 -0.622 23.044 1.00 12.29 C ATOM 786 O LYS A 111 -5.724 -0.322 22.771 1.00 12.78 O ATOM 787 CB LYS A 111 -7.627 0.683 25.006 1.00 16.49 C ATOM 788 CG LYS A 111 -8.087 0.772 26.452 1.00 19.49 C ATOM 789 CD LYS A 111 -8.386 2.219 26.825 1.00 26.12 C ATOM 790 CE LYS A 111 -8.852 2.342 28.265 1.00 31.45 C ATOM 791 NZ LYS A 111 -9.145 3.760 28.625 1.00 35.60 N ATOM 0 H LYS A 111 -5.475 -1.054 25.096 1.00 12.34 H new ATOM 0 HA LYS A 111 -8.120 -1.280 24.577 1.00 16.56 H new ATOM 0 HB2 LYS A 111 -6.829 1.225 24.903 1.00 16.49 H new ATOM 0 HB3 LYS A 111 -8.311 1.075 24.441 1.00 16.49 H new ATOM 0 HG2 LYS A 111 -8.880 0.228 26.579 1.00 19.49 H new ATOM 0 HG3 LYS A 111 -7.401 0.416 27.038 1.00 19.49 H new ATOM 0 HD2 LYS A 111 -7.590 2.758 26.695 1.00 26.12 H new ATOM 0 HD3 LYS A 111 -9.068 2.572 26.232 1.00 26.12 H new ATOM 0 HE2 LYS A 111 -9.647 1.803 28.396 1.00 31.45 H new ATOM 0 HE3 LYS A 111 -8.170 1.991 28.858 1.00 31.45 H new ATOM 0 HZ1 LYS A 111 -9.415 3.802 29.472 1.00 35.60 H new ATOM 0 HZ2 LYS A 111 -8.409 4.250 28.524 1.00 35.60 H new ATOM 0 HZ3 LYS A 111 -9.786 4.075 28.094 1.00 35.60 H new ATOM 792 N VAL A 112 -7.818 -0.867 22.122 1.00 12.38 N ATOM 793 CA VAL A 112 -7.591 -0.614 20.702 1.00 12.50 C ATOM 794 C VAL A 112 -8.824 0.077 20.115 1.00 12.68 C ATOM 795 O VAL A 112 -9.943 -0.144 20.584 1.00 15.49 O ATOM 796 CB VAL A 112 -7.290 -1.918 19.903 1.00 12.00 C ATOM 797 CG1 VAL A 112 -6.079 -2.652 20.479 1.00 13.29 C ATOM 798 CG2 VAL A 112 -8.514 -2.835 19.874 1.00 14.05 C ATOM 0 H VAL A 112 -8.597 -1.184 22.303 1.00 12.38 H new ATOM 0 HA VAL A 112 -6.809 -0.045 20.624 1.00 12.50 H new ATOM 0 HB VAL A 112 -7.079 -1.663 18.991 1.00 12.00 H new ATOM 0 HG11 VAL A 112 -5.914 -3.458 19.965 1.00 13.29 H new ATOM 0 HG12 VAL A 112 -5.300 -2.076 20.435 1.00 13.29 H new ATOM 0 HG13 VAL A 112 -6.254 -2.889 21.403 1.00 13.29 H new ATOM 0 HG21 VAL A 112 -8.305 -3.639 19.373 1.00 14.05 H new ATOM 0 HG22 VAL A 112 -8.760 -3.075 20.781 1.00 14.05 H new ATOM 0 HG23 VAL A 112 -9.254 -2.374 19.450 1.00 14.05 H new ATOM 799 N SER A 113 -8.631 0.917 19.103 1.00 12.32 N ATOM 800 CA SER A 113 -9.770 1.603 18.493 1.00 14.52 C ATOM 801 C SER A 113 -10.530 0.673 17.558 1.00 15.86 C ATOM 802 O SER A 113 -10.061 -0.412 17.198 1.00 14.56 O ATOM 803 CB SER A 113 -9.339 2.872 17.763 1.00 15.31 C ATOM 804 OG SER A 113 -8.502 2.567 16.672 1.00 15.12 O ATOM 0 H SER A 113 -7.865 1.103 18.759 1.00 12.32 H new ATOM 0 HA SER A 113 -10.367 1.867 19.211 1.00 14.52 H new ATOM 0 HB2 SER A 113 -10.122 3.351 17.450 1.00 15.31 H new ATOM 0 HB3 SER A 113 -8.873 3.460 18.378 1.00 15.31 H new ATOM 0 HG SER A 113 -8.910 2.722 15.954 1.00 15.12 H new ATOM 805 N SER A 114 -11.715 1.116 17.159 1.00 15.29 N ATOM 806 CA SER A 114 -12.638 0.271 16.416 1.00 16.63 C ATOM 807 C SER A 114 -12.040 -0.344 15.150 1.00 15.48 C ATOM 808 O SER A 114 -12.327 -1.498 14.834 1.00 16.43 O ATOM 809 CB SER A 114 -13.918 1.047 16.085 1.00 18.41 C ATOM 810 OG SER A 114 -13.635 2.185 15.289 1.00 20.64 O ATOM 0 H SER A 114 -12.006 1.911 17.310 1.00 15.29 H new ATOM 0 HA SER A 114 -12.846 -0.477 16.998 1.00 16.63 H new ATOM 0 HB2 SER A 114 -14.539 0.467 15.616 1.00 18.41 H new ATOM 0 HB3 SER A 114 -14.353 1.324 16.907 1.00 18.41 H new ATOM 0 HG SER A 114 -13.736 1.992 14.478 1.00 20.64 H new ATOM 811 N SER A 115 -11.212 0.405 14.428 1.00 15.29 N ATOM 812 CA SER A 115 -10.658 -0.097 13.175 1.00 15.58 C ATOM 813 C SER A 115 -9.777 -1.327 13.384 1.00 15.30 C ATOM 814 O SER A 115 -9.715 -2.202 12.522 1.00 15.83 O ATOM 815 CB SER A 115 -9.871 0.984 12.444 1.00 17.87 C ATOM 816 OG SER A 115 -8.805 1.455 13.246 1.00 27.45 O ATOM 0 H SER A 115 -10.960 1.199 14.643 1.00 15.29 H new ATOM 0 HA SER A 115 -11.415 -0.360 12.628 1.00 15.58 H new ATOM 0 HB2 SER A 115 -9.523 0.630 11.611 1.00 17.87 H new ATOM 0 HB3 SER A 115 -10.460 1.720 12.215 1.00 17.87 H new ATOM 0 HG SER A 115 -8.424 2.095 12.858 1.00 27.45 H new ATOM 817 N PHE A 116 -9.077 -1.386 14.516 1.00 12.18 N ATOM 818 CA PHE A 116 -8.265 -2.559 14.811 1.00 11.17 C ATOM 819 C PHE A 116 -9.150 -3.743 15.184 1.00 11.53 C ATOM 820 O PHE A 116 -8.959 -4.855 14.693 1.00 12.59 O ATOM 821 CB PHE A 116 -7.223 -2.254 15.898 1.00 12.22 C ATOM 822 CG PHE A 116 -6.132 -1.325 15.439 1.00 12.45 C ATOM 823 CD1 PHE A 116 -5.272 -1.702 14.422 1.00 13.68 C ATOM 824 CD2 PHE A 116 -5.970 -0.073 16.013 1.00 13.33 C ATOM 825 CE1 PHE A 116 -4.274 -0.856 13.981 1.00 15.74 C ATOM 826 CE2 PHE A 116 -4.968 0.777 15.580 1.00 13.10 C ATOM 827 CZ PHE A 116 -4.118 0.390 14.562 1.00 14.63 C ATOM 0 H PHE A 116 -9.059 -0.769 15.115 1.00 12.18 H new ATOM 0 HA PHE A 116 -7.774 -2.802 14.010 1.00 11.17 H new ATOM 0 HB2 PHE A 116 -7.671 -1.862 16.664 1.00 12.22 H new ATOM 0 HB3 PHE A 116 -6.825 -3.086 16.197 1.00 12.22 H new ATOM 0 HD1 PHE A 116 -5.368 -2.539 14.029 1.00 13.68 H new ATOM 0 HD2 PHE A 116 -6.541 0.198 16.696 1.00 13.33 H new ATOM 0 HE1 PHE A 116 -3.707 -1.123 13.294 1.00 15.74 H new ATOM 0 HE2 PHE A 116 -4.866 1.612 15.976 1.00 13.10 H new ATOM 0 HZ PHE A 116 -3.446 0.963 14.269 1.00 14.63 H new ATOM 828 N THR A 117 -10.132 -3.502 16.041 1.00 12.69 N ATOM 829 CA THR A 117 -11.086 -4.540 16.407 1.00 13.31 C ATOM 830 C THR A 117 -11.729 -5.159 15.171 1.00 13.60 C ATOM 831 O THR A 117 -11.876 -6.376 15.075 1.00 14.33 O ATOM 832 CB THR A 117 -12.189 -3.978 17.322 1.00 12.84 C ATOM 833 OG1 THR A 117 -11.589 -3.474 18.520 1.00 14.03 O ATOM 834 CG2 THR A 117 -13.198 -5.052 17.682 1.00 15.99 C ATOM 0 H THR A 117 -10.264 -2.743 16.423 1.00 12.69 H new ATOM 0 HA THR A 117 -10.593 -5.225 16.884 1.00 13.31 H new ATOM 0 HB THR A 117 -12.652 -3.268 16.850 1.00 12.84 H new ATOM 0 HG1 THR A 117 -11.304 -4.115 18.982 1.00 14.03 H new ATOM 0 HG21 THR A 117 -13.881 -4.674 18.258 1.00 15.99 H new ATOM 0 HG22 THR A 117 -13.610 -5.394 16.873 1.00 15.99 H new ATOM 0 HG23 THR A 117 -12.749 -5.776 18.146 1.00 15.99 H new ATOM 835 N GLU A 118 -12.084 -4.311 14.216 1.00 13.50 N ATOM 836 CA GLU A 118 -12.843 -4.742 13.050 1.00 16.18 C ATOM 837 C GLU A 118 -11.985 -5.478 12.029 1.00 17.92 C ATOM 838 O GLU A 118 -12.507 -6.091 11.093 1.00 20.83 O ATOM 839 CB GLU A 118 -13.550 -3.538 12.421 1.00 21.18 C ATOM 840 CG GLU A 118 -14.646 -2.975 13.315 1.00 20.16 C ATOM 841 CD GLU A 118 -15.044 -1.557 12.959 1.00 23.21 C ATOM 842 OE1 GLU A 118 -15.928 -1.008 13.652 1.00 25.37 O ATOM 843 OE2 GLU A 118 -14.477 -0.992 11.998 1.00 25.87 O ATOM 0 H GLU A 118 -11.893 -3.473 14.224 1.00 13.50 H new ATOM 0 HA GLU A 118 -13.508 -5.382 13.349 1.00 16.18 H new ATOM 0 HB2 GLU A 118 -12.898 -2.844 12.237 1.00 21.18 H new ATOM 0 HB3 GLU A 118 -13.934 -3.800 11.570 1.00 21.18 H new ATOM 0 HG2 GLU A 118 -15.427 -3.547 13.257 1.00 20.16 H new ATOM 0 HG3 GLU A 118 -14.346 -2.998 14.237 1.00 20.16 H new ATOM 844 N ASP A 119 -10.670 -5.423 12.201 1.00 15.99 N ATOM 845 CA ASP A 119 -9.787 -6.165 11.315 1.00 15.11 C ATOM 846 C ASP A 119 -9.250 -7.423 11.990 1.00 14.43 C ATOM 847 O ASP A 119 -8.213 -7.395 12.658 1.00 14.30 O ATOM 848 CB ASP A 119 -8.640 -5.303 10.823 1.00 17.34 C ATOM 849 CG ASP A 119 -7.795 -6.021 9.811 1.00 23.53 C ATOM 850 OD1 ASP A 119 -8.174 -7.154 9.437 1.00 22.94 O ATOM 851 OD2 ASP A 119 -6.767 -5.461 9.386 1.00 28.35 O ATOM 0 H ASP A 119 -10.274 -4.969 12.815 1.00 15.99 H new ATOM 0 HA ASP A 119 -10.316 -6.433 10.547 1.00 15.11 H new ATOM 0 HB2 ASP A 119 -8.993 -4.489 10.430 1.00 17.34 H new ATOM 0 HB3 ASP A 119 -8.088 -5.039 11.576 1.00 17.34 H new ATOM 852 N SER A 120 -9.961 -8.526 11.802 1.00 11.57 N ATOM 853 CA SER A 120 -9.637 -9.775 12.471 1.00 12.51 C ATOM 854 C SER A 120 -8.293 -10.346 12.057 1.00 10.57 C ATOM 855 O SER A 120 -7.752 -11.188 12.761 1.00 11.21 O ATOM 856 CB SER A 120 -10.726 -10.821 12.209 1.00 15.57 C ATOM 857 OG SER A 120 -10.749 -11.200 10.841 1.00 19.13 O ATOM 0 H SER A 120 -10.645 -8.571 11.283 1.00 11.57 H new ATOM 0 HA SER A 120 -9.587 -9.566 13.417 1.00 12.51 H new ATOM 0 HB2 SER A 120 -10.568 -11.602 12.762 1.00 15.57 H new ATOM 0 HB3 SER A 120 -11.591 -10.463 12.464 1.00 15.57 H new ATOM 0 HG SER A 120 -11.028 -10.558 10.377 1.00 19.13 H new ATOM 858 N THR A 121 -7.759 -9.891 10.924 1.00 9.40 N ATOM 859 CA THR A 121 -6.548 -10.509 10.358 1.00 9.27 C ATOM 860 C THR A 121 -5.243 -9.908 10.873 1.00 9.10 C ATOM 861 O THR A 121 -4.171 -10.450 10.612 1.00 9.42 O ATOM 862 CB THR A 121 -6.507 -10.404 8.822 1.00 11.73 C ATOM 863 OG1 THR A 121 -6.434 -9.028 8.437 1.00 16.49 O ATOM 864 CG2 THR A 121 -7.750 -11.043 8.205 1.00 16.06 C ATOM 0 H THR A 121 -8.075 -9.233 10.469 1.00 9.40 H new ATOM 0 HA THR A 121 -6.610 -11.433 10.647 1.00 9.27 H new ATOM 0 HB THR A 121 -5.723 -10.876 8.500 1.00 11.73 H new ATOM 0 HG1 THR A 121 -7.061 -8.602 8.800 1.00 16.49 H new ATOM 0 HG21 THR A 121 -7.707 -10.968 7.239 1.00 16.06 H new ATOM 0 HG22 THR A 121 -7.790 -11.980 8.454 1.00 16.06 H new ATOM 0 HG23 THR A 121 -8.543 -10.588 8.529 1.00 16.06 H new ATOM 865 N ILE A 122 -5.328 -8.787 11.581 1.00 8.26 N ATOM 866 CA ILE A 122 -4.130 -8.096 12.051 1.00 7.95 C ATOM 867 C ILE A 122 -4.054 -8.203 13.571 1.00 8.76 C ATOM 868 O ILE A 122 -4.915 -7.675 14.287 1.00 9.25 O ATOM 869 CB ILE A 122 -4.103 -6.624 11.573 1.00 8.16 C ATOM 870 CG1 ILE A 122 -3.942 -6.579 10.052 1.00 12.28 C ATOM 871 CG2 ILE A 122 -2.975 -5.850 12.261 1.00 9.08 C ATOM 872 CD1 ILE A 122 -3.899 -5.173 9.467 1.00 13.62 C ATOM 0 H ILE A 122 -6.069 -8.409 11.800 1.00 8.26 H new ATOM 0 HA ILE A 122 -3.346 -8.521 11.670 1.00 7.95 H new ATOM 0 HB ILE A 122 -4.942 -6.201 11.813 1.00 8.16 H new ATOM 0 HG12 ILE A 122 -3.126 -7.044 9.810 1.00 12.28 H new ATOM 0 HG13 ILE A 122 -4.676 -7.065 9.645 1.00 12.28 H new ATOM 0 HG21 ILE A 122 -2.975 -4.932 11.949 1.00 9.08 H new ATOM 0 HG22 ILE A 122 -3.111 -5.864 13.221 1.00 9.08 H new ATOM 0 HG23 ILE A 122 -2.123 -6.263 12.050 1.00 9.08 H new ATOM 0 HD11 ILE A 122 -3.796 -5.226 8.504 1.00 13.62 H new ATOM 0 HD12 ILE A 122 -4.724 -4.709 9.678 1.00 13.62 H new ATOM 0 HD13 ILE A 122 -3.149 -4.688 9.846 1.00 13.62 H new ATOM 873 N ASP A 123 -3.028 -8.903 14.052 1.00 7.41 N ATOM 874 CA ASP A 123 -2.876 -9.182 15.481 1.00 8.18 C ATOM 875 C ASP A 123 -2.050 -8.119 16.200 1.00 8.27 C ATOM 876 O ASP A 123 -1.826 -8.219 17.409 1.00 8.18 O ATOM 877 CB ASP A 123 -2.233 -10.555 15.702 1.00 8.78 C ATOM 878 CG ASP A 123 -3.028 -11.683 15.076 1.00 8.70 C ATOM 879 OD1 ASP A 123 -4.274 -11.607 15.098 1.00 9.47 O ATOM 880 OD2 ASP A 123 -2.408 -12.650 14.573 1.00 9.15 O ATOM 0 H ASP A 123 -2.402 -9.229 13.561 1.00 7.41 H new ATOM 0 HA ASP A 123 -3.770 -9.173 15.857 1.00 8.18 H new ATOM 0 HB2 ASP A 123 -1.337 -10.551 15.331 1.00 8.78 H new ATOM 0 HB3 ASP A 123 -2.145 -10.717 16.654 1.00 8.78 H new ATOM 881 N GLY A 124 -1.587 -7.120 15.458 1.00 6.79 N ATOM 882 CA GLY A 124 -0.774 -6.052 16.018 1.00 7.64 C ATOM 883 C GLY A 124 0.122 -5.467 14.948 1.00 7.31 C ATOM 884 O GLY A 124 0.005 -5.823 13.761 1.00 7.65 O ATOM 0 H GLY A 124 -1.736 -7.043 14.615 1.00 6.79 H new ATOM 0 HA2 GLY A 124 -1.345 -5.360 16.386 1.00 7.64 H new ATOM 0 HA3 GLY A 124 -0.236 -6.394 16.749 1.00 7.64 H new ATOM 885 N LEU A 125 1.003 -4.557 15.368 1.00 7.56 N ATOM 886 CA LEU A 125 1.924 -3.866 14.472 1.00 6.95 C ATOM 887 C LEU A 125 3.350 -4.094 14.918 1.00 7.46 C ATOM 888 O LEU A 125 3.621 -4.238 16.119 1.00 8.35 O ATOM 889 CB LEU A 125 1.643 -2.362 14.440 1.00 9.59 C ATOM 890 CG LEU A 125 0.702 -1.887 13.323 1.00 13.06 C ATOM 891 CD1 LEU A 125 -0.702 -2.476 13.485 1.00 12.71 C ATOM 892 CD2 LEU A 125 0.644 -0.367 13.258 1.00 16.87 C ATOM 0 H LEU A 125 1.081 -4.323 16.192 1.00 7.56 H new ATOM 0 HA LEU A 125 1.795 -4.226 13.580 1.00 6.95 H new ATOM 0 HB2 LEU A 125 1.263 -2.102 15.294 1.00 9.59 H new ATOM 0 HB3 LEU A 125 2.487 -1.893 14.351 1.00 9.59 H new ATOM 0 HG LEU A 125 1.066 -2.210 12.484 1.00 13.06 H new ATOM 0 HD11 LEU A 125 -1.271 -2.158 12.767 1.00 12.71 H new ATOM 0 HD12 LEU A 125 -0.653 -3.444 13.454 1.00 12.71 H new ATOM 0 HD13 LEU A 125 -1.073 -2.199 14.337 1.00 12.71 H new ATOM 0 HD21 LEU A 125 0.044 -0.096 12.546 1.00 16.87 H new ATOM 0 HD22 LEU A 125 0.320 -0.019 14.103 1.00 16.87 H new ATOM 0 HD23 LEU A 125 1.531 -0.016 13.084 1.00 16.87 H new ATOM 893 N LEU A 126 4.259 -4.136 13.951 1.00 7.71 N ATOM 894 CA LEU A 126 5.686 -4.169 14.234 1.00 7.43 C ATOM 895 C LEU A 126 6.316 -2.953 13.547 1.00 7.06 C ATOM 896 O LEU A 126 6.460 -2.905 12.322 1.00 7.55 O ATOM 897 CB LEU A 126 6.308 -5.487 13.758 1.00 7.40 C ATOM 898 CG LEU A 126 7.749 -5.702 14.239 1.00 7.59 C ATOM 899 CD1 LEU A 126 8.034 -7.181 14.450 1.00 9.18 C ATOM 900 CD2 LEU A 126 8.736 -5.086 13.249 1.00 9.54 C ATOM 0 H LEU A 126 4.065 -4.146 13.113 1.00 7.71 H new ATOM 0 HA LEU A 126 5.850 -4.126 15.189 1.00 7.43 H new ATOM 0 HB2 LEU A 126 5.759 -6.224 14.068 1.00 7.40 H new ATOM 0 HB3 LEU A 126 6.293 -5.510 12.788 1.00 7.40 H new ATOM 0 HG LEU A 126 7.859 -5.256 15.094 1.00 7.59 H new ATOM 0 HD11 LEU A 126 8.948 -7.294 14.753 1.00 9.18 H new ATOM 0 HD12 LEU A 126 7.426 -7.536 15.117 1.00 9.18 H new ATOM 0 HD13 LEU A 126 7.910 -7.657 13.614 1.00 9.18 H new ATOM 0 HD21 LEU A 126 9.642 -5.229 13.564 1.00 9.54 H new ATOM 0 HD22 LEU A 126 8.627 -5.504 12.380 1.00 9.54 H new ATOM 0 HD23 LEU A 126 8.567 -4.134 13.173 1.00 9.54 H new ATOM 901 N GLY A 127 6.667 -1.945 14.341 1.00 7.45 N ATOM 902 CA GLY A 127 7.178 -0.696 13.801 1.00 8.04 C ATOM 903 C GLY A 127 8.625 -0.791 13.349 1.00 7.30 C ATOM 904 O GLY A 127 9.458 -1.400 14.026 1.00 8.56 O ATOM 0 H GLY A 127 6.615 -1.968 15.199 1.00 7.45 H new ATOM 0 HA2 GLY A 127 6.627 -0.425 13.050 1.00 8.04 H new ATOM 0 HA3 GLY A 127 7.100 -0.003 14.475 1.00 8.04 H new ATOM 905 N LEU A 128 8.933 -0.159 12.215 1.00 7.06 N ATOM 906 CA LEU A 128 10.257 -0.210 11.603 1.00 6.54 C ATOM 907 C LEU A 128 10.762 1.179 11.212 1.00 7.53 C ATOM 908 O LEU A 128 11.723 1.293 10.451 1.00 7.75 O ATOM 909 CB LEU A 128 10.262 -1.157 10.394 1.00 8.30 C ATOM 910 CG LEU A 128 10.065 -2.639 10.722 1.00 7.00 C ATOM 911 CD1 LEU A 128 9.746 -3.420 9.456 1.00 9.44 C ATOM 912 CD2 LEU A 128 11.299 -3.207 11.428 1.00 10.54 C ATOM 0 H LEU A 128 8.368 0.318 11.775 1.00 7.06 H new ATOM 0 HA LEU A 128 10.870 -0.559 12.269 1.00 6.54 H new ATOM 0 HB2 LEU A 128 9.562 -0.881 9.783 1.00 8.30 H new ATOM 0 HB3 LEU A 128 11.105 -1.054 9.925 1.00 8.30 H new ATOM 0 HG LEU A 128 9.313 -2.726 11.329 1.00 7.00 H new ATOM 0 HD11 LEU A 128 9.623 -4.357 9.676 1.00 9.44 H new ATOM 0 HD12 LEU A 128 8.933 -3.073 9.058 1.00 9.44 H new ATOM 0 HD13 LEU A 128 10.478 -3.329 8.826 1.00 9.44 H new ATOM 0 HD21 LEU A 128 11.155 -4.145 11.627 1.00 10.54 H new ATOM 0 HD22 LEU A 128 12.073 -3.115 10.851 1.00 10.54 H new ATOM 0 HD23 LEU A 128 11.452 -2.721 12.254 1.00 10.54 H new ATOM 913 N ALA A 129 10.112 2.226 11.725 1.00 7.32 N ATOM 914 CA ALA A 129 10.660 3.582 11.626 1.00 7.75 C ATOM 915 C ALA A 129 11.743 3.746 12.695 1.00 8.69 C ATOM 916 O ALA A 129 12.182 2.771 13.303 1.00 9.84 O ATOM 917 CB ALA A 129 9.565 4.630 11.795 1.00 8.31 C ATOM 0 H ALA A 129 9.356 2.174 12.132 1.00 7.32 H new ATOM 0 HA ALA A 129 11.046 3.713 10.746 1.00 7.75 H new ATOM 0 HB1 ALA A 129 9.952 5.517 11.726 1.00 8.31 H new ATOM 0 HB2 ALA A 129 8.896 4.514 11.102 1.00 8.31 H new ATOM 0 HB3 ALA A 129 9.149 4.526 12.665 1.00 8.31 H new ATOM 918 N PHE A 130 12.194 4.971 12.920 1.00 9.28 N ATOM 919 CA PHE A 130 13.300 5.175 13.845 1.00 8.82 C ATOM 920 C PHE A 130 12.803 5.175 15.288 1.00 9.20 C ATOM 921 O PHE A 130 11.685 5.615 15.573 1.00 8.50 O ATOM 922 CB PHE A 130 14.090 6.423 13.444 1.00 10.54 C ATOM 923 CG PHE A 130 14.790 6.249 12.137 1.00 10.12 C ATOM 924 CD1 PHE A 130 14.157 6.556 10.946 1.00 11.56 C ATOM 925 CD2 PHE A 130 16.053 5.689 12.090 1.00 13.76 C ATOM 926 CE1 PHE A 130 14.792 6.344 9.730 1.00 11.19 C ATOM 927 CE2 PHE A 130 16.690 5.469 10.883 1.00 13.83 C ATOM 928 CZ PHE A 130 16.056 5.797 9.703 1.00 11.85 C ATOM 0 H PHE A 130 11.882 5.685 12.556 1.00 9.28 H new ATOM 0 HA PHE A 130 13.924 4.434 13.792 1.00 8.82 H new ATOM 0 HB2 PHE A 130 13.488 7.181 13.388 1.00 10.54 H new ATOM 0 HB3 PHE A 130 14.741 6.628 14.133 1.00 10.54 H new ATOM 0 HD1 PHE A 130 13.296 6.908 10.960 1.00 11.56 H new ATOM 0 HD2 PHE A 130 16.481 5.457 12.882 1.00 13.76 H new ATOM 0 HE1 PHE A 130 14.365 6.571 8.935 1.00 11.19 H new ATOM 0 HE2 PHE A 130 17.544 5.101 10.867 1.00 13.83 H new ATOM 0 HZ PHE A 130 16.482 5.649 8.889 1.00 11.85 H new ATOM 929 N SER A 131 13.633 4.663 16.195 1.00 9.93 N ATOM 930 CA SER A 131 13.188 4.437 17.569 1.00 9.23 C ATOM 931 C SER A 131 12.827 5.718 18.313 1.00 9.74 C ATOM 932 O SER A 131 12.162 5.677 19.343 1.00 10.53 O ATOM 933 CB SER A 131 14.233 3.644 18.353 1.00 11.27 C ATOM 934 OG SER A 131 14.382 2.335 17.819 1.00 11.30 O ATOM 0 H SER A 131 14.449 4.442 16.038 1.00 9.93 H new ATOM 0 HA SER A 131 12.370 3.919 17.503 1.00 9.23 H new ATOM 0 HB2 SER A 131 15.085 4.108 18.325 1.00 11.27 H new ATOM 0 HB3 SER A 131 13.971 3.589 19.285 1.00 11.27 H new ATOM 0 HG SER A 131 15.186 2.206 17.614 1.00 11.30 H new ATOM 935 N THR A 132 13.244 6.856 17.773 1.00 8.66 N ATOM 936 CA THR A 132 12.892 8.145 18.352 1.00 11.09 C ATOM 937 C THR A 132 11.380 8.381 18.377 1.00 10.29 C ATOM 938 O THR A 132 10.909 9.235 19.118 1.00 11.47 O ATOM 939 CB THR A 132 13.556 9.297 17.587 1.00 11.14 C ATOM 940 OG1 THR A 132 13.234 9.156 16.197 1.00 12.22 O ATOM 941 CG2 THR A 132 15.076 9.277 17.774 1.00 15.46 C ATOM 0 H THR A 132 13.734 6.903 17.068 1.00 8.66 H new ATOM 0 HA THR A 132 13.217 8.124 19.266 1.00 11.09 H new ATOM 0 HB THR A 132 13.227 10.143 17.929 1.00 11.14 H new ATOM 0 HG1 THR A 132 13.867 9.453 15.731 1.00 12.22 H new ATOM 0 HG21 THR A 132 15.472 10.013 17.282 1.00 15.46 H new ATOM 0 HG22 THR A 132 15.288 9.367 18.716 1.00 15.46 H new ATOM 0 HG23 THR A 132 15.432 8.438 17.442 1.00 15.46 H new ATOM 942 N LEU A 133 10.621 7.646 17.558 1.00 9.78 N ATOM 943 CA LEU A 133 9.157 7.749 17.565 1.00 10.49 C ATOM 944 C LEU A 133 8.463 6.801 18.545 1.00 8.75 C ATOM 945 O LEU A 133 7.248 6.868 18.721 1.00 10.82 O ATOM 946 CB LEU A 133 8.577 7.516 16.165 1.00 10.75 C ATOM 947 CG LEU A 133 8.911 8.522 15.070 1.00 10.80 C ATOM 948 CD1 LEU A 133 8.202 8.140 13.783 1.00 13.75 C ATOM 949 CD2 LEU A 133 8.521 9.935 15.496 1.00 19.30 C ATOM 0 H LEU A 133 10.935 7.081 16.990 1.00 9.78 H new ATOM 0 HA LEU A 133 8.979 8.655 17.863 1.00 10.49 H new ATOM 0 HB2 LEU A 133 8.871 6.642 15.864 1.00 10.75 H new ATOM 0 HB3 LEU A 133 7.611 7.477 16.247 1.00 10.75 H new ATOM 0 HG LEU A 133 9.869 8.508 14.918 1.00 10.80 H new ATOM 0 HD11 LEU A 133 8.419 8.784 13.091 1.00 13.75 H new ATOM 0 HD12 LEU A 133 8.490 7.257 13.504 1.00 13.75 H new ATOM 0 HD13 LEU A 133 7.243 8.135 13.931 1.00 13.75 H new ATOM 0 HD21 LEU A 133 8.741 10.559 14.787 1.00 19.30 H new ATOM 0 HD22 LEU A 133 7.568 9.969 15.671 1.00 19.30 H new ATOM 0 HD23 LEU A 133 9.006 10.176 16.301 1.00 19.30 H new ATOM 950 N ASN A 134 9.215 5.909 19.173 1.00 9.33 N ATOM 951 CA ASN A 134 8.588 4.929 20.046 1.00 9.49 C ATOM 952 C ASN A 134 7.866 5.620 21.211 1.00 9.33 C ATOM 953 O ASN A 134 8.419 6.552 21.811 1.00 9.98 O ATOM 954 CB ASN A 134 9.623 3.926 20.554 1.00 8.06 C ATOM 955 CG ASN A 134 9.029 2.946 21.526 1.00 10.43 C ATOM 956 OD1 ASN A 134 9.053 3.167 22.743 1.00 9.97 O ATOM 957 ND2 ASN A 134 8.459 1.865 21.006 1.00 9.53 N ATOM 0 H ASN A 134 10.071 5.853 19.110 1.00 9.33 H new ATOM 0 HA ASN A 134 7.923 4.442 19.534 1.00 9.49 H new ATOM 0 HB2 ASN A 134 10.002 3.445 19.802 1.00 8.06 H new ATOM 0 HB3 ASN A 134 10.351 4.403 20.982 1.00 8.06 H new ATOM 0 HD21 ASN A 134 8.087 1.285 21.521 1.00 9.53 H new ATOM 0 HD22 ASN A 134 8.462 1.745 20.154 1.00 9.53 H new ATOM 958 N THR A 135 6.651 5.178 21.533 1.00 8.63 N ATOM 959 CA THR A 135 5.806 5.891 22.493 1.00 9.01 C ATOM 960 C THR A 135 5.909 5.393 23.933 1.00 11.45 C ATOM 961 O THR A 135 5.219 5.912 24.805 1.00 12.60 O ATOM 962 CB THR A 135 4.309 5.877 22.088 1.00 11.52 C ATOM 963 OG1 THR A 135 3.726 4.601 22.385 1.00 10.87 O ATOM 964 CG2 THR A 135 4.124 6.223 20.607 1.00 9.84 C ATOM 0 H THR A 135 6.296 4.466 21.206 1.00 8.63 H new ATOM 0 HA THR A 135 6.158 6.794 22.464 1.00 9.01 H new ATOM 0 HB THR A 135 3.853 6.558 22.607 1.00 11.52 H new ATOM 0 HG1 THR A 135 4.067 4.015 21.889 1.00 10.87 H new ATOM 0 HG21 THR A 135 3.180 6.206 20.386 1.00 9.84 H new ATOM 0 HG22 THR A 135 4.480 7.109 20.435 1.00 9.84 H new ATOM 0 HG23 THR A 135 4.595 5.574 20.062 1.00 9.84 H new ATOM 965 N VAL A 136 6.754 4.405 24.199 1.00 8.81 N ATOM 966 CA VAL A 136 6.837 3.893 25.566 1.00 9.87 C ATOM 967 C VAL A 136 7.360 4.949 26.547 1.00 10.01 C ATOM 968 O VAL A 136 8.345 5.621 26.284 1.00 11.48 O ATOM 969 CB VAL A 136 7.665 2.608 25.657 1.00 9.12 C ATOM 970 CG1 VAL A 136 7.749 2.124 27.109 1.00 10.70 C ATOM 971 CG2 VAL A 136 7.054 1.525 24.752 1.00 9.86 C ATOM 0 H VAL A 136 7.273 4.026 23.627 1.00 8.81 H new ATOM 0 HA VAL A 136 5.929 3.673 25.826 1.00 9.87 H new ATOM 0 HB VAL A 136 8.567 2.793 25.351 1.00 9.12 H new ATOM 0 HG11 VAL A 136 8.276 1.311 27.149 1.00 10.70 H new ATOM 0 HG12 VAL A 136 8.168 2.808 27.654 1.00 10.70 H new ATOM 0 HG13 VAL A 136 6.856 1.947 27.443 1.00 10.70 H new ATOM 0 HG21 VAL A 136 7.583 0.714 24.815 1.00 9.86 H new ATOM 0 HG22 VAL A 136 6.145 1.340 25.036 1.00 9.86 H new ATOM 0 HG23 VAL A 136 7.048 1.836 23.833 1.00 9.86 H new ATOM 972 N SER A 137 6.662 5.077 27.670 1.00 10.73 N ATOM 973 CA SER A 137 6.993 6.030 28.716 1.00 10.55 C ATOM 974 C SER A 137 7.065 5.269 30.030 1.00 9.59 C ATOM 975 O SER A 137 6.252 4.379 30.271 1.00 11.43 O ATOM 976 CB SER A 137 5.891 7.085 28.793 1.00 14.07 C ATOM 977 OG SER A 137 6.141 8.039 29.811 1.00 14.56 O ATOM 0 H SER A 137 5.968 4.601 27.847 1.00 10.73 H new ATOM 0 HA SER A 137 7.839 6.467 28.533 1.00 10.55 H new ATOM 0 HB2 SER A 137 5.817 7.537 27.938 1.00 14.07 H new ATOM 0 HB3 SER A 137 5.040 6.651 28.959 1.00 14.07 H new ATOM 0 HG SER A 137 5.783 7.785 30.527 1.00 14.56 H new ATOM 978 N PRO A 138 7.996 5.653 30.923 1.00 10.12 N ATOM 979 CA PRO A 138 8.884 6.817 30.856 1.00 10.90 C ATOM 980 C PRO A 138 10.229 6.525 30.194 1.00 12.05 C ATOM 981 O PRO A 138 11.054 7.428 30.061 1.00 13.20 O ATOM 982 CB PRO A 138 9.096 7.153 32.335 1.00 12.66 C ATOM 983 CG PRO A 138 9.082 5.818 33.001 1.00 11.77 C ATOM 984 CD PRO A 138 8.040 5.009 32.251 1.00 11.94 C ATOM 0 HA PRO A 138 8.500 7.528 30.319 1.00 10.90 H new ATOM 0 HB2 PRO A 138 9.936 7.615 32.479 1.00 12.66 H new ATOM 0 HB3 PRO A 138 8.393 7.729 32.675 1.00 12.66 H new ATOM 0 HG2 PRO A 138 9.954 5.395 32.955 1.00 11.77 H new ATOM 0 HG3 PRO A 138 8.854 5.898 33.940 1.00 11.77 H new ATOM 0 HD2 PRO A 138 8.291 4.074 32.187 1.00 11.94 H new ATOM 0 HD3 PRO A 138 7.177 5.041 32.693 1.00 11.94 H new ATOM 985 N THR A 139 10.449 5.279 29.792 1.00 9.63 N ATOM 986 CA THR A 139 11.695 4.881 29.147 1.00 10.62 C ATOM 987 C THR A 139 11.405 4.412 27.720 1.00 9.60 C ATOM 988 O THR A 139 10.844 3.338 27.503 1.00 11.12 O ATOM 989 CB THR A 139 12.388 3.755 29.940 1.00 10.61 C ATOM 990 OG1 THR A 139 12.518 4.147 31.318 1.00 10.35 O ATOM 991 CG2 THR A 139 13.767 3.451 29.363 1.00 10.91 C ATOM 0 H THR A 139 9.881 4.640 29.885 1.00 9.63 H new ATOM 0 HA THR A 139 12.290 5.646 29.123 1.00 10.62 H new ATOM 0 HB THR A 139 11.845 2.954 29.875 1.00 10.61 H new ATOM 0 HG1 THR A 139 13.166 4.675 31.399 1.00 10.35 H new ATOM 0 HG21 THR A 139 14.184 2.741 29.876 1.00 10.91 H new ATOM 0 HG22 THR A 139 13.677 3.171 28.439 1.00 10.91 H new ATOM 0 HG23 THR A 139 14.319 4.247 29.406 1.00 10.91 H new ATOM 992 N GLN A 140 11.786 5.229 26.747 1.00 10.95 N ATOM 993 CA GLN A 140 11.550 4.901 25.347 1.00 11.39 C ATOM 994 C GLN A 140 12.252 3.591 24.978 1.00 10.61 C ATOM 995 O GLN A 140 13.362 3.321 25.443 1.00 10.50 O ATOM 996 CB GLN A 140 12.068 6.033 24.475 1.00 11.68 C ATOM 997 CG GLN A 140 11.676 5.924 23.018 1.00 14.26 C ATOM 998 CD GLN A 140 12.014 7.178 22.253 1.00 15.75 C ATOM 999 OE1 GLN A 140 13.181 7.566 22.161 1.00 17.06 O ATOM 1000 NE2 GLN A 140 10.996 7.833 21.710 1.00 12.33 N ATOM 0 H GLN A 140 12.184 5.980 26.876 1.00 10.95 H new ATOM 0 HA GLN A 140 10.598 4.788 25.202 1.00 11.39 H new ATOM 0 HB2 GLN A 140 11.738 6.875 24.826 1.00 11.68 H new ATOM 0 HB3 GLN A 140 13.036 6.059 24.538 1.00 11.68 H new ATOM 0 HG2 GLN A 140 12.131 5.167 22.616 1.00 14.26 H new ATOM 0 HG3 GLN A 140 10.724 5.751 22.951 1.00 14.26 H new ATOM 0 HE21 GLN A 140 10.195 7.531 21.796 1.00 12.33 H new ATOM 0 HE22 GLN A 140 11.137 8.560 21.272 1.00 12.33 H new ATOM 1001 N GLN A 141 11.597 2.782 24.147 1.00 9.31 N ATOM 1002 CA GLN A 141 12.115 1.473 23.754 1.00 9.25 C ATOM 1003 C GLN A 141 12.555 1.429 22.292 1.00 9.15 C ATOM 1004 O GLN A 141 12.126 2.241 21.478 1.00 11.62 O ATOM 1005 CB GLN A 141 11.068 0.389 24.022 1.00 10.45 C ATOM 1006 CG GLN A 141 10.637 0.335 25.476 1.00 9.46 C ATOM 1007 CD GLN A 141 11.753 -0.135 26.394 1.00 10.61 C ATOM 1008 OE1 GLN A 141 12.337 -1.204 26.187 1.00 11.58 O ATOM 1009 NE2 GLN A 141 12.058 0.662 27.417 1.00 10.96 N ATOM 0 H GLN A 141 10.837 2.978 23.794 1.00 9.31 H new ATOM 0 HA GLN A 141 12.904 1.306 24.293 1.00 9.25 H new ATOM 0 HB2 GLN A 141 10.291 0.551 23.464 1.00 10.45 H new ATOM 0 HB3 GLN A 141 11.428 -0.474 23.763 1.00 10.45 H new ATOM 0 HG2 GLN A 141 10.341 1.215 25.756 1.00 9.46 H new ATOM 0 HG3 GLN A 141 9.877 -0.261 25.563 1.00 9.46 H new ATOM 0 HE21 GLN A 141 11.630 1.399 27.530 1.00 10.96 H new ATOM 0 HE22 GLN A 141 12.683 0.439 27.964 1.00 10.96 H new ATOM 1010 N LYS A 142 13.415 0.466 21.975 1.00 10.53 N ATOM 1011 CA LYS A 142 13.945 0.301 20.625 1.00 11.66 C ATOM 1012 C LYS A 142 13.084 -0.608 19.752 1.00 8.79 C ATOM 1013 O LYS A 142 12.435 -1.537 20.240 1.00 9.25 O ATOM 1014 CB LYS A 142 15.363 -0.270 20.687 1.00 11.13 C ATOM 1015 CG LYS A 142 16.404 0.708 21.214 1.00 14.09 C ATOM 1016 CD LYS A 142 17.778 0.056 21.264 1.00 17.61 C ATOM 1017 CE LYS A 142 18.831 1.011 21.801 1.00 24.73 C ATOM 1018 NZ LYS A 142 20.182 0.375 21.844 1.00 34.51 N ATOM 0 H LYS A 142 13.709 -0.113 22.539 1.00 10.53 H new ATOM 0 HA LYS A 142 13.945 1.182 20.220 1.00 11.66 H new ATOM 0 HB2 LYS A 142 15.359 -1.059 21.251 1.00 11.13 H new ATOM 0 HB3 LYS A 142 15.624 -0.558 19.798 1.00 11.13 H new ATOM 0 HG2 LYS A 142 16.434 1.493 20.645 1.00 14.09 H new ATOM 0 HG3 LYS A 142 16.152 1.010 22.101 1.00 14.09 H new ATOM 0 HD2 LYS A 142 17.741 -0.735 21.824 1.00 17.61 H new ATOM 0 HD3 LYS A 142 18.030 -0.238 20.375 1.00 17.61 H new ATOM 0 HE2 LYS A 142 18.864 1.804 21.243 1.00 24.73 H new ATOM 0 HE3 LYS A 142 18.581 1.301 22.692 1.00 24.73 H new ATOM 0 HZ1 LYS A 142 20.775 0.958 22.162 1.00 34.51 H new ATOM 0 HZ2 LYS A 142 20.157 -0.340 22.373 1.00 34.51 H new ATOM 0 HZ3 LYS A 142 20.420 0.128 21.023 1.00 34.51 H new ATOM 1019 N THR A 143 13.087 -0.337 18.449 1.00 8.53 N ATOM 1020 CA THR A 143 12.423 -1.229 17.500 1.00 8.87 C ATOM 1021 C THR A 143 13.145 -2.567 17.374 1.00 9.88 C ATOM 1022 O THR A 143 14.317 -2.714 17.750 1.00 9.10 O ATOM 1023 CB THR A 143 12.325 -0.620 16.092 1.00 10.17 C ATOM 1024 OG1 THR A 143 13.642 -0.545 15.531 1.00 10.95 O ATOM 1025 CG2 THR A 143 11.679 0.769 16.129 1.00 10.40 C ATOM 0 H THR A 143 13.464 0.351 18.096 1.00 8.53 H new ATOM 0 HA THR A 143 11.532 -1.362 17.860 1.00 8.87 H new ATOM 0 HB THR A 143 11.761 -1.185 15.541 1.00 10.17 H new ATOM 0 HG1 THR A 143 13.624 -0.076 14.835 1.00 10.95 H new ATOM 0 HG21 THR A 143 11.631 1.128 15.229 1.00 10.40 H new ATOM 0 HG22 THR A 143 10.785 0.700 16.498 1.00 10.40 H new ATOM 0 HG23 THR A 143 12.212 1.360 16.684 1.00 10.40 H new ATOM 1026 N PHE A 144 12.432 -3.538 16.817 1.00 9.07 N ATOM 1027 CA PHE A 144 12.996 -4.844 16.530 1.00 7.82 C ATOM 1028 C PHE A 144 14.250 -4.712 15.669 1.00 9.42 C ATOM 1029 O PHE A 144 15.268 -5.359 15.934 1.00 9.39 O ATOM 1030 CB PHE A 144 11.947 -5.707 15.819 1.00 7.45 C ATOM 1031 CG PHE A 144 12.460 -7.040 15.361 1.00 7.39 C ATOM 1032 CD1 PHE A 144 12.561 -8.098 16.248 1.00 8.80 C ATOM 1033 CD2 PHE A 144 12.829 -7.244 14.040 1.00 9.19 C ATOM 1034 CE1 PHE A 144 13.039 -9.334 15.835 1.00 9.27 C ATOM 1035 CE2 PHE A 144 13.307 -8.478 13.616 1.00 10.03 C ATOM 1036 CZ PHE A 144 13.415 -9.525 14.517 1.00 8.95 C ATOM 0 H PHE A 144 11.605 -3.455 16.595 1.00 9.07 H new ATOM 0 HA PHE A 144 13.249 -5.270 17.364 1.00 7.82 H new ATOM 0 HB2 PHE A 144 11.198 -5.848 16.419 1.00 7.45 H new ATOM 0 HB3 PHE A 144 11.608 -5.220 15.051 1.00 7.45 H new ATOM 0 HD1 PHE A 144 12.305 -7.979 17.134 1.00 8.80 H new ATOM 0 HD2 PHE A 144 12.756 -6.546 13.430 1.00 9.19 H new ATOM 0 HE1 PHE A 144 13.107 -10.034 16.444 1.00 9.27 H new ATOM 0 HE2 PHE A 144 13.554 -8.601 12.728 1.00 10.03 H new ATOM 0 HZ PHE A 144 13.738 -10.351 14.238 1.00 8.95 H new ATOM 1037 N PHE A 145 14.188 -3.867 14.640 1.00 7.88 N ATOM 1038 CA PHE A 145 15.341 -3.674 13.762 1.00 9.87 C ATOM 1039 C PHE A 145 16.517 -3.046 14.502 1.00 9.81 C ATOM 1040 O PHE A 145 17.663 -3.474 14.351 1.00 10.04 O ATOM 1041 CB PHE A 145 14.942 -2.843 12.542 1.00 10.62 C ATOM 1042 CG PHE A 145 16.075 -2.550 11.589 1.00 10.04 C ATOM 1043 CD1 PHE A 145 16.348 -1.240 11.228 1.00 12.60 C ATOM 1044 CD2 PHE A 145 16.839 -3.568 11.030 1.00 10.75 C ATOM 1045 CE1 PHE A 145 17.379 -0.940 10.337 1.00 13.85 C ATOM 1046 CE2 PHE A 145 17.875 -3.272 10.137 1.00 11.15 C ATOM 1047 CZ PHE A 145 18.135 -1.960 9.794 1.00 13.43 C ATOM 0 H PHE A 145 13.495 -3.401 14.435 1.00 7.88 H new ATOM 0 HA PHE A 145 15.636 -4.546 13.457 1.00 9.87 H new ATOM 0 HB2 PHE A 145 14.242 -3.311 12.061 1.00 10.62 H new ATOM 0 HB3 PHE A 145 14.564 -2.003 12.846 1.00 10.62 H new ATOM 0 HD1 PHE A 145 15.836 -0.550 11.585 1.00 12.60 H new ATOM 0 HD2 PHE A 145 16.660 -4.453 11.251 1.00 10.75 H new ATOM 0 HE1 PHE A 145 17.556 -0.056 10.110 1.00 13.85 H new ATOM 0 HE2 PHE A 145 18.388 -3.958 9.775 1.00 11.15 H new ATOM 0 HZ PHE A 145 18.820 -1.763 9.197 1.00 13.43 H new ATOM 1048 N ASP A 146 16.234 -2.034 15.310 1.00 9.83 N ATOM 1049 CA AASP A 146 17.259 -1.365 16.103 0.51 12.33 C ATOM 1050 CA BASP A 146 17.290 -1.387 16.073 0.49 12.29 C ATOM 1051 C ASP A 146 17.970 -2.376 17.009 1.00 10.79 C ATOM 1052 O ASP A 146 19.199 -2.384 17.119 1.00 12.95 O ATOM 1053 CB AASP A 146 16.606 -0.260 16.943 0.51 12.84 C ATOM 1054 CB BASP A 146 16.748 -0.186 16.845 0.49 12.53 C ATOM 1055 CG AASP A 146 17.567 0.852 17.313 0.51 14.21 C ATOM 1056 CG BASP A 146 17.129 1.124 16.207 0.49 15.14 C ATOM 1057 OD1AASP A 146 18.794 0.661 17.192 0.51 16.30 O ATOM 1058 OD1BASP A 146 17.693 1.096 15.092 0.49 16.38 O ATOM 1059 OD2AASP A 146 17.085 1.922 17.741 0.51 12.53 O ATOM 1060 OD2BASP A 146 16.861 2.177 16.817 0.49 16.82 O ATOM 0 H AASP A 146 15.443 -1.714 15.415 0.51 9.83 H new ATOM 0 H BASP A 146 15.447 -1.710 15.430 0.49 9.83 H new ATOM 0 HA AASP A 146 17.919 -0.970 15.512 0.51 12.29 H new ATOM 0 HA BASP A 146 17.956 -1.063 15.447 0.49 12.29 H new ATOM 0 HB2AASP A 146 15.860 0.115 16.450 0.51 12.53 H new ATOM 0 HB2BASP A 146 15.781 -0.248 16.898 0.49 12.53 H new ATOM 0 HB3AASP A 146 16.243 -0.649 17.754 0.51 12.53 H new ATOM 0 HB3BASP A 146 17.085 -0.210 17.754 0.49 12.53 H new ATOM 1061 N ASN A 147 17.188 -3.228 17.668 1.00 10.50 N ATOM 1062 CA ASN A 147 17.754 -4.247 18.552 1.00 10.30 C ATOM 1063 C ASN A 147 18.574 -5.287 17.794 1.00 11.90 C ATOM 1064 O ASN A 147 19.598 -5.748 18.291 1.00 13.57 O ATOM 1065 CB ASN A 147 16.658 -4.965 19.352 1.00 11.45 C ATOM 1066 CG ASN A 147 16.147 -4.144 20.520 1.00 12.61 C ATOM 1067 OD1 ASN A 147 16.909 -3.428 21.175 1.00 13.95 O ATOM 1068 ND2 ASN A 147 14.853 -4.251 20.798 1.00 11.16 N ATOM 0 H ASN A 147 16.329 -3.234 17.618 1.00 10.50 H new ATOM 0 HA ASN A 147 18.344 -3.773 19.159 1.00 10.30 H new ATOM 0 HB2 ASN A 147 15.918 -5.175 18.761 1.00 11.45 H new ATOM 0 HB3 ASN A 147 17.005 -5.808 19.683 1.00 11.45 H new ATOM 0 HD21 ASN A 147 14.517 -3.811 21.456 1.00 11.16 H new ATOM 0 HD22 ASN A 147 14.351 -4.760 20.320 1.00 11.16 H new ATOM 1069 N ALA A 148 18.134 -5.650 16.591 1.00 9.85 N ATOM 1070 CA ALA A 148 18.783 -6.701 15.811 1.00 9.88 C ATOM 1071 C ALA A 148 20.021 -6.230 15.069 1.00 10.87 C ATOM 1072 O ALA A 148 20.872 -7.046 14.707 1.00 11.35 O ATOM 1073 CB ALA A 148 17.797 -7.293 14.807 1.00 11.49 C ATOM 0 H ALA A 148 17.453 -5.295 16.205 1.00 9.85 H new ATOM 0 HA ALA A 148 19.070 -7.371 16.451 1.00 9.88 H new ATOM 0 HB1 ALA A 148 18.236 -7.989 14.294 1.00 11.49 H new ATOM 0 HB2 ALA A 148 17.039 -7.670 15.281 1.00 11.49 H new ATOM 0 HB3 ALA A 148 17.488 -6.596 14.207 1.00 11.49 H new ATOM 1074 N LYS A 149 20.101 -4.926 14.829 1.00 10.98 N ATOM 1075 CA LYS A 149 21.015 -4.350 13.841 1.00 13.32 C ATOM 1076 C LYS A 149 22.465 -4.805 13.979 1.00 18.18 C ATOM 1077 O LYS A 149 23.088 -5.220 12.999 1.00 16.15 O ATOM 1078 CB LYS A 149 20.931 -2.816 13.861 1.00 18.56 C ATOM 0 H LYS A 149 19.621 -4.341 15.239 1.00 10.98 H new ATOM 0 HA LYS A 149 20.716 -4.688 12.983 1.00 13.32 H new ATOM 1079 N ALA A 150 22.996 -4.725 15.192 1.00 15.16 N ATOM 1080 CA ALA A 150 24.403 -5.033 15.429 1.00 17.68 C ATOM 1081 C ALA A 150 24.730 -6.475 15.065 1.00 18.36 C ATOM 1082 O ALA A 150 25.852 -6.780 14.641 1.00 20.38 O ATOM 1083 CB ALA A 150 24.765 -4.758 16.879 1.00 22.01 C ATOM 0 H ALA A 150 22.558 -4.493 15.895 1.00 15.16 H new ATOM 0 HA ALA A 150 24.933 -4.457 14.856 1.00 17.68 H new ATOM 0 HB1 ALA A 150 25.701 -4.966 17.024 1.00 22.01 H new ATOM 0 HB2 ALA A 150 24.607 -3.822 17.080 1.00 22.01 H new ATOM 0 HB3 ALA A 150 24.218 -5.310 17.460 1.00 22.01 H new ATOM 1084 N SER A 151 23.749 -7.357 15.238 1.00 13.48 N ATOM 1085 CA SER A 151 23.925 -8.780 14.984 1.00 12.79 C ATOM 1086 C SER A 151 23.771 -9.162 13.513 1.00 12.98 C ATOM 1087 O SER A 151 24.201 -10.229 13.103 1.00 14.02 O ATOM 1088 CB SER A 151 22.945 -9.597 15.824 1.00 16.07 C ATOM 1089 OG SER A 151 23.160 -9.376 17.206 1.00 27.97 O ATOM 0 H SER A 151 22.960 -7.144 15.507 1.00 13.48 H new ATOM 0 HA SER A 151 24.839 -8.984 15.237 1.00 12.79 H new ATOM 0 HB2 SER A 151 22.035 -9.356 15.592 1.00 16.07 H new ATOM 0 HB3 SER A 151 23.049 -10.540 15.623 1.00 16.07 H new ATOM 0 HG SER A 151 22.811 -8.646 17.431 1.00 27.97 H new ATOM 1090 N LEU A 152 23.158 -8.289 12.722 1.00 12.26 N ATOM 1091 CA LEU A 152 22.902 -8.587 11.315 1.00 11.28 C ATOM 1092 C LEU A 152 24.168 -8.619 10.448 1.00 11.41 C ATOM 1093 O LEU A 152 25.128 -7.877 10.700 1.00 11.97 O ATOM 1094 CB LEU A 152 21.933 -7.558 10.738 1.00 12.35 C ATOM 1095 CG LEU A 152 20.549 -7.530 11.380 1.00 10.18 C ATOM 1096 CD1 LEU A 152 19.701 -6.415 10.773 1.00 11.52 C ATOM 1097 CD2 LEU A 152 19.885 -8.872 11.192 1.00 11.58 C ATOM 0 H LEU A 152 22.881 -7.517 12.980 1.00 12.26 H new ATOM 0 HA LEU A 152 22.522 -9.479 11.294 1.00 11.28 H new ATOM 0 HB2 LEU A 152 22.331 -6.678 10.824 1.00 12.35 H new ATOM 0 HB3 LEU A 152 21.829 -7.730 9.789 1.00 12.35 H new ATOM 0 HG LEU A 152 20.638 -7.351 12.329 1.00 10.18 H new ATOM 0 HD11 LEU A 152 18.826 -6.410 11.191 1.00 11.52 H new ATOM 0 HD12 LEU A 152 20.135 -5.560 10.922 1.00 11.52 H new ATOM 0 HD13 LEU A 152 19.603 -6.565 9.820 1.00 11.52 H new ATOM 0 HD21 LEU A 152 19.005 -8.858 11.599 1.00 11.58 H new ATOM 0 HD22 LEU A 152 19.799 -9.061 10.244 1.00 11.58 H new ATOM 0 HD23 LEU A 152 20.423 -9.561 11.611 1.00 11.58 H new ATOM 1098 N ASP A 153 24.166 -9.452 9.412 1.00 10.50 N ATOM 1099 CA ASP A 153 25.299 -9.495 8.488 1.00 11.88 C ATOM 1100 C ASP A 153 25.559 -8.117 7.879 1.00 12.61 C ATOM 1101 O ASP A 153 26.711 -7.721 7.681 1.00 14.11 O ATOM 1102 CB ASP A 153 25.063 -10.518 7.375 1.00 11.86 C ATOM 1103 CG ASP A 153 25.119 -11.949 7.871 1.00 13.23 C ATOM 1104 OD1 ASP A 153 24.935 -12.865 7.045 1.00 15.58 O ATOM 1105 OD2 ASP A 153 25.361 -12.151 9.081 1.00 15.47 O ATOM 0 H ASP A 153 23.526 -9.996 9.226 1.00 10.50 H new ATOM 0 HA ASP A 153 26.080 -9.765 8.996 1.00 11.88 H new ATOM 0 HB2 ASP A 153 24.197 -10.354 6.969 1.00 11.86 H new ATOM 0 HB3 ASP A 153 25.729 -10.394 6.681 1.00 11.86 H new ATOM 1106 N SER A 154 24.480 -7.396 7.581 1.00 11.51 N ATOM 1107 CA SER A 154 24.531 -6.025 7.069 1.00 10.60 C ATOM 1108 C SER A 154 23.360 -5.295 7.733 1.00 10.50 C ATOM 1109 O SER A 154 22.301 -5.902 7.930 1.00 9.93 O ATOM 1110 CB SER A 154 24.379 -6.033 5.547 1.00 13.85 C ATOM 1111 OG SER A 154 24.460 -4.732 4.983 1.00 15.05 O ATOM 0 H SER A 154 23.679 -7.696 7.673 1.00 11.51 H new ATOM 0 HA SER A 154 25.374 -5.589 7.268 1.00 10.60 H new ATOM 0 HB2 SER A 154 25.069 -6.593 5.159 1.00 13.85 H new ATOM 0 HB3 SER A 154 23.526 -6.431 5.313 1.00 13.85 H new ATOM 0 HG SER A 154 25.261 -4.478 4.977 1.00 15.05 H new ATOM 1112 N PRO A 155 23.532 -4.009 8.098 1.00 10.40 N ATOM 1113 CA PRO A 155 22.508 -3.303 8.888 1.00 10.30 C ATOM 1114 C PRO A 155 21.347 -2.779 8.038 1.00 8.96 C ATOM 1115 O PRO A 155 21.098 -1.570 7.971 1.00 10.03 O ATOM 1116 CB PRO A 155 23.294 -2.144 9.505 1.00 13.26 C ATOM 1117 CG PRO A 155 24.343 -1.845 8.489 1.00 15.39 C ATOM 1118 CD PRO A 155 24.733 -3.176 7.881 1.00 11.10 C ATOM 0 HA PRO A 155 22.084 -3.887 9.536 1.00 10.30 H new ATOM 0 HB2 PRO A 155 22.726 -1.375 9.667 1.00 13.26 H new ATOM 0 HB3 PRO A 155 23.685 -2.393 10.357 1.00 13.26 H new ATOM 0 HG2 PRO A 155 24.006 -1.240 7.810 1.00 15.39 H new ATOM 0 HG3 PRO A 155 25.109 -1.413 8.899 1.00 15.39 H new ATOM 0 HD2 PRO A 155 24.945 -3.091 6.938 1.00 11.10 H new ATOM 0 HD3 PRO A 155 25.514 -3.553 8.315 1.00 11.10 H new ATOM 1119 N VAL A 156 20.625 -3.710 7.427 1.00 9.29 N ATOM 1120 CA VAL A 156 19.586 -3.379 6.460 1.00 8.74 C ATOM 1121 C VAL A 156 18.381 -4.285 6.644 1.00 8.65 C ATOM 1122 O VAL A 156 18.488 -5.391 7.182 1.00 8.29 O ATOM 1123 CB VAL A 156 20.093 -3.553 5.003 1.00 9.82 C ATOM 1124 CG1 VAL A 156 21.343 -2.724 4.757 1.00 12.07 C ATOM 1125 CG2 VAL A 156 20.363 -5.017 4.693 1.00 12.21 C ATOM 0 H VAL A 156 20.724 -4.554 7.562 1.00 9.29 H new ATOM 0 HA VAL A 156 19.342 -2.453 6.612 1.00 8.74 H new ATOM 0 HB VAL A 156 19.395 -3.236 4.409 1.00 9.82 H new ATOM 0 HG11 VAL A 156 21.640 -2.849 3.842 1.00 12.07 H new ATOM 0 HG12 VAL A 156 21.144 -1.786 4.907 1.00 12.07 H new ATOM 0 HG13 VAL A 156 22.044 -3.007 5.365 1.00 12.07 H new ATOM 0 HG21 VAL A 156 20.678 -5.102 3.780 1.00 12.21 H new ATOM 0 HG22 VAL A 156 21.038 -5.357 5.300 1.00 12.21 H new ATOM 0 HG23 VAL A 156 19.545 -5.527 4.801 1.00 12.21 H new ATOM 1126 N PHE A 157 17.225 -3.816 6.185 1.00 8.08 N ATOM 1127 CA PHE A 157 16.119 -4.725 5.911 1.00 7.66 C ATOM 1128 C PHE A 157 15.517 -4.332 4.577 1.00 8.01 C ATOM 1129 O PHE A 157 15.713 -3.209 4.117 1.00 8.21 O ATOM 1130 CB PHE A 157 15.085 -4.786 7.052 1.00 8.04 C ATOM 1131 CG PHE A 157 14.291 -3.518 7.255 1.00 6.69 C ATOM 1132 CD1 PHE A 157 13.088 -3.323 6.583 1.00 7.50 C ATOM 1133 CD2 PHE A 157 14.707 -2.546 8.166 1.00 7.98 C ATOM 1134 CE1 PHE A 157 12.347 -2.157 6.777 1.00 9.35 C ATOM 1135 CE2 PHE A 157 13.967 -1.385 8.359 1.00 9.90 C ATOM 1136 CZ PHE A 157 12.787 -1.200 7.664 1.00 9.07 C ATOM 0 H PHE A 157 17.062 -2.986 6.027 1.00 8.08 H new ATOM 0 HA PHE A 157 16.453 -5.634 5.859 1.00 7.66 H new ATOM 0 HB2 PHE A 157 14.469 -5.514 6.874 1.00 8.04 H new ATOM 0 HB3 PHE A 157 15.546 -5.000 7.878 1.00 8.04 H new ATOM 0 HD1 PHE A 157 12.775 -3.976 5.999 1.00 7.50 H new ATOM 0 HD2 PHE A 157 15.490 -2.677 8.651 1.00 7.98 H new ATOM 0 HE1 PHE A 157 11.555 -2.026 6.307 1.00 9.35 H new ATOM 0 HE2 PHE A 157 14.265 -0.735 8.954 1.00 9.90 H new ATOM 0 HZ PHE A 157 12.288 -0.426 7.796 1.00 9.07 H new ATOM 1137 N THR A 158 14.824 -5.264 3.934 1.00 6.36 N ATOM 1138 CA THR A 158 14.231 -4.987 2.634 1.00 6.21 C ATOM 1139 C THR A 158 12.762 -5.365 2.621 1.00 6.76 C ATOM 1140 O THR A 158 12.327 -6.308 3.299 1.00 7.13 O ATOM 1141 CB THR A 158 14.979 -5.720 1.485 1.00 6.85 C ATOM 1142 OG1 THR A 158 14.825 -7.139 1.626 1.00 8.01 O ATOM 1143 CG2 THR A 158 16.468 -5.390 1.527 1.00 7.82 C ATOM 0 H THR A 158 14.686 -6.059 4.232 1.00 6.36 H new ATOM 0 HA THR A 158 14.315 -4.033 2.482 1.00 6.21 H new ATOM 0 HB THR A 158 14.601 -5.426 0.641 1.00 6.85 H new ATOM 0 HG1 THR A 158 14.154 -7.393 1.189 1.00 8.01 H new ATOM 0 HG21 THR A 158 16.923 -5.853 0.806 1.00 7.82 H new ATOM 0 HG22 THR A 158 16.591 -4.433 1.425 1.00 7.82 H new ATOM 0 HG23 THR A 158 16.839 -5.674 2.377 1.00 7.82 H new ATOM 1144 N ALA A 159 12.000 -4.580 1.870 1.00 7.00 N ATOM 1145 CA ALA A 159 10.580 -4.826 1.674 1.00 6.73 C ATOM 1146 C ALA A 159 10.324 -5.133 0.217 1.00 6.00 C ATOM 1147 O ALA A 159 10.666 -4.346 -0.663 1.00 7.50 O ATOM 1148 CB ALA A 159 9.765 -3.622 2.104 1.00 8.67 C ATOM 0 H ALA A 159 12.295 -3.885 1.458 1.00 7.00 H new ATOM 0 HA ALA A 159 10.312 -5.583 2.218 1.00 6.73 H new ATOM 0 HB1 ALA A 159 8.822 -3.803 1.967 1.00 8.67 H new ATOM 0 HB2 ALA A 159 9.925 -3.441 3.043 1.00 8.67 H new ATOM 0 HB3 ALA A 159 10.025 -2.850 1.578 1.00 8.67 H new ATOM 1149 N ASP A 160 9.690 -6.273 -0.023 1.00 6.26 N ATOM 1150 CA ASP A 160 9.383 -6.726 -1.369 1.00 6.44 C ATOM 1151 C ASP A 160 7.916 -7.135 -1.359 1.00 7.17 C ATOM 1152 O ASP A 160 7.586 -8.322 -1.276 1.00 7.21 O ATOM 1153 CB ASP A 160 10.315 -7.897 -1.712 1.00 7.89 C ATOM 1154 CG ASP A 160 10.117 -8.433 -3.107 1.00 9.50 C ATOM 1155 OD1 ASP A 160 10.730 -9.478 -3.405 1.00 11.05 O ATOM 1156 OD2 ASP A 160 9.354 -7.845 -3.904 1.00 11.75 O ATOM 0 H ASP A 160 9.425 -6.808 0.596 1.00 6.26 H new ATOM 0 HA ASP A 160 9.521 -6.042 -2.043 1.00 6.44 H new ATOM 0 HB2 ASP A 160 11.236 -7.609 -1.611 1.00 7.89 H new ATOM 0 HB3 ASP A 160 10.171 -8.614 -1.074 1.00 7.89 H new ATOM 1157 N LEU A 161 7.036 -6.142 -1.397 1.00 7.02 N ATOM 1158 CA LEU A 161 5.605 -6.393 -1.290 1.00 7.11 C ATOM 1159 C LEU A 161 5.049 -6.839 -2.630 1.00 8.25 C ATOM 1160 O LEU A 161 5.429 -6.314 -3.670 1.00 8.50 O ATOM 1161 CB LEU A 161 4.878 -5.129 -0.847 1.00 7.50 C ATOM 1162 CG LEU A 161 5.320 -4.535 0.496 1.00 8.54 C ATOM 1163 CD1 LEU A 161 4.502 -3.301 0.806 1.00 11.85 C ATOM 1164 CD2 LEU A 161 5.211 -5.546 1.637 1.00 12.26 C ATOM 0 H LEU A 161 7.248 -5.313 -1.484 1.00 7.02 H new ATOM 0 HA LEU A 161 5.468 -7.093 -0.632 1.00 7.11 H new ATOM 0 HB2 LEU A 161 4.994 -4.453 -1.533 1.00 7.50 H new ATOM 0 HB3 LEU A 161 3.929 -5.323 -0.798 1.00 7.50 H new ATOM 0 HG LEU A 161 6.256 -4.293 0.417 1.00 8.54 H new ATOM 0 HD11 LEU A 161 4.786 -2.930 1.656 1.00 11.85 H new ATOM 0 HD12 LEU A 161 4.632 -2.642 0.106 1.00 11.85 H new ATOM 0 HD13 LEU A 161 3.563 -3.539 0.855 1.00 11.85 H new ATOM 0 HD21 LEU A 161 5.499 -5.132 2.465 1.00 12.26 H new ATOM 0 HD22 LEU A 161 4.290 -5.837 1.725 1.00 12.26 H new ATOM 0 HD23 LEU A 161 5.775 -6.312 1.446 1.00 12.26 H new ATOM 1165 N GLY A 162 4.125 -7.790 -2.605 1.00 8.57 N ATOM 1166 CA GLY A 162 3.499 -8.269 -3.826 1.00 8.64 C ATOM 1167 C GLY A 162 2.215 -7.541 -4.180 1.00 8.78 C ATOM 1168 O GLY A 162 1.528 -7.010 -3.316 1.00 10.62 O ATOM 0 H GLY A 162 3.846 -8.172 -1.887 1.00 8.57 H new ATOM 0 HA2 GLY A 162 4.127 -8.176 -4.560 1.00 8.64 H new ATOM 0 HA3 GLY A 162 3.309 -9.216 -3.733 1.00 8.64 H new ATOM 1169 N TYR A 163 1.903 -7.502 -5.470 1.00 10.25 N ATOM 1170 CA TYR A 163 0.597 -7.056 -5.937 1.00 9.70 C ATOM 1171 C TYR A 163 -0.328 -8.260 -5.994 1.00 10.13 C ATOM 1172 O TYR A 163 -0.093 -9.201 -6.759 1.00 10.88 O ATOM 1173 CB TYR A 163 0.711 -6.398 -7.314 1.00 9.94 C ATOM 1174 CG TYR A 163 -0.617 -6.191 -8.006 1.00 11.29 C ATOM 1175 CD1 TYR A 163 -1.540 -5.277 -7.524 1.00 10.84 C ATOM 1176 CD2 TYR A 163 -0.940 -6.907 -9.151 1.00 11.26 C ATOM 1177 CE1 TYR A 163 -2.763 -5.091 -8.162 1.00 10.74 C ATOM 1178 CE2 TYR A 163 -2.158 -6.731 -9.789 1.00 11.28 C ATOM 1179 CZ TYR A 163 -3.060 -5.820 -9.292 1.00 12.19 C ATOM 1180 OH TYR A 163 -4.273 -5.641 -9.928 1.00 14.77 O ATOM 0 H TYR A 163 2.442 -7.733 -6.099 1.00 10.25 H new ATOM 0 HA TYR A 163 0.238 -6.394 -5.326 1.00 9.70 H new ATOM 0 HB2 TYR A 163 1.152 -5.540 -7.217 1.00 9.94 H new ATOM 0 HB3 TYR A 163 1.278 -6.946 -7.879 1.00 9.94 H new ATOM 0 HD1 TYR A 163 -1.340 -4.781 -6.763 1.00 10.84 H new ATOM 0 HD2 TYR A 163 -0.328 -7.516 -9.496 1.00 11.26 H new ATOM 0 HE1 TYR A 163 -3.376 -4.478 -7.827 1.00 10.74 H new ATOM 0 HE2 TYR A 163 -2.364 -7.226 -10.549 1.00 11.28 H new ATOM 0 HH TYR A 163 -4.858 -6.114 -9.554 1.00 14.77 H new ATOM 1181 N HIS A 164 -1.354 -8.247 -5.151 1.00 9.19 N ATOM 1182 CA HIS A 164 -2.315 -9.343 -5.080 1.00 11.04 C ATOM 1183 C HIS A 164 -1.600 -10.687 -4.917 1.00 13.04 C ATOM 1184 O HIS A 164 -2.034 -11.698 -5.461 1.00 14.10 O ATOM 1185 CB HIS A 164 -3.227 -9.363 -6.324 1.00 13.76 C ATOM 1186 CG HIS A 164 -4.169 -8.198 -6.429 1.00 13.98 C ATOM 1187 ND1 HIS A 164 -4.244 -7.196 -5.485 1.00 19.77 N ATOM 1188 CD2 HIS A 164 -5.086 -7.884 -7.378 1.00 17.11 C ATOM 1189 CE1 HIS A 164 -5.158 -6.312 -5.851 1.00 18.69 C ATOM 1190 NE2 HIS A 164 -5.686 -6.710 -6.993 1.00 21.64 N ATOM 0 H HIS A 164 -1.513 -7.603 -4.604 1.00 9.19 H new ATOM 0 HA HIS A 164 -2.872 -9.197 -4.299 1.00 11.04 H new ATOM 0 HB2 HIS A 164 -2.670 -9.386 -7.118 1.00 13.76 H new ATOM 0 HB3 HIS A 164 -3.745 -10.183 -6.317 1.00 13.76 H new ATOM 0 HD1 HIS A 164 -3.770 -7.152 -4.769 1.00 19.77 H new ATOM 0 HD2 HIS A 164 -5.274 -8.373 -8.147 1.00 17.11 H new ATOM 0 HE1 HIS A 164 -5.389 -5.542 -5.383 1.00 18.69 H new ATOM 1191 N ALA A 165 -0.501 -10.695 -4.163 1.00 9.83 N ATOM 1192 CA ALA A 165 0.318 -11.894 -3.983 1.00 11.15 C ATOM 1193 C ALA A 165 1.232 -11.705 -2.784 1.00 8.87 C ATOM 1194 O ALA A 165 1.466 -10.580 -2.358 1.00 9.26 O ATOM 1195 CB ALA A 165 1.151 -12.156 -5.220 1.00 13.54 C ATOM 0 H ALA A 165 -0.209 -10.005 -3.741 1.00 9.83 H new ATOM 0 HA ALA A 165 -0.266 -12.654 -3.834 1.00 11.15 H new ATOM 0 HB1 ALA A 165 1.688 -12.953 -5.086 1.00 13.54 H new ATOM 0 HB2 ALA A 165 0.566 -12.285 -5.983 1.00 13.54 H new ATOM 0 HB3 ALA A 165 1.734 -11.398 -5.385 1.00 13.54 H new ATOM 1196 N PRO A 166 1.756 -12.810 -2.237 1.00 8.18 N ATOM 1197 CA PRO A 166 2.708 -12.696 -1.130 1.00 8.90 C ATOM 1198 C PRO A 166 4.030 -12.075 -1.572 1.00 10.00 C ATOM 1199 O PRO A 166 4.362 -12.037 -2.760 1.00 11.78 O ATOM 1200 CB PRO A 166 2.898 -14.151 -0.676 1.00 10.71 C ATOM 1201 CG PRO A 166 1.643 -14.848 -1.130 1.00 13.09 C ATOM 1202 CD PRO A 166 1.334 -14.203 -2.453 1.00 11.09 C ATOM 0 HA PRO A 166 2.388 -12.114 -0.423 1.00 8.90 H new ATOM 0 HB2 PRO A 166 3.688 -14.547 -1.077 1.00 10.71 H new ATOM 0 HB3 PRO A 166 3.008 -14.210 0.286 1.00 10.71 H new ATOM 0 HG2 PRO A 166 1.780 -15.804 -1.223 1.00 13.09 H new ATOM 0 HG3 PRO A 166 0.919 -14.726 -0.496 1.00 13.09 H new ATOM 0 HD2 PRO A 166 1.823 -14.619 -3.180 1.00 11.09 H new ATOM 0 HD3 PRO A 166 0.391 -14.264 -2.673 1.00 11.09 H new ATOM 1203 N GLY A 167 4.772 -11.589 -0.586 1.00 8.89 N ATOM 1204 CA GLY A 167 6.059 -10.960 -0.799 1.00 8.23 C ATOM 1205 C GLY A 167 6.950 -11.315 0.370 1.00 6.61 C ATOM 1206 O GLY A 167 6.689 -12.291 1.090 1.00 6.73 O ATOM 0 H GLY A 167 4.534 -11.618 0.240 1.00 8.89 H new ATOM 0 HA2 GLY A 167 6.453 -11.266 -1.631 1.00 8.23 H new ATOM 0 HA3 GLY A 167 5.959 -9.998 -0.870 1.00 8.23 H new ATOM 1207 N THR A 168 7.994 -10.523 0.572 1.00 6.60 N ATOM 1208 CA THR A 168 9.032 -10.890 1.520 1.00 7.13 C ATOM 1209 C THR A 168 9.607 -9.689 2.262 1.00 7.10 C ATOM 1210 O THR A 168 9.861 -8.648 1.657 1.00 6.85 O ATOM 1211 CB THR A 168 10.195 -11.584 0.772 1.00 7.75 C ATOM 1212 OG1 THR A 168 9.700 -12.695 0.015 1.00 9.43 O ATOM 1213 CG2 THR A 168 11.269 -12.068 1.740 1.00 10.08 C ATOM 0 H THR A 168 8.119 -9.772 0.172 1.00 6.60 H new ATOM 0 HA THR A 168 8.618 -11.481 2.168 1.00 7.13 H new ATOM 0 HB THR A 168 10.593 -10.931 0.175 1.00 7.75 H new ATOM 0 HG1 THR A 168 9.520 -12.444 -0.766 1.00 9.43 H new ATOM 0 HG21 THR A 168 11.983 -12.498 1.243 1.00 10.08 H new ATOM 0 HG22 THR A 168 11.627 -11.312 2.231 1.00 10.08 H new ATOM 0 HG23 THR A 168 10.881 -12.703 2.363 1.00 10.08 H new ATOM 1214 N TYR A 169 9.852 -9.867 3.561 1.00 6.20 N ATOM 1215 CA TYR A 169 10.703 -8.979 4.345 1.00 6.67 C ATOM 1216 C TYR A 169 11.967 -9.734 4.698 1.00 6.92 C ATOM 1217 O TYR A 169 11.899 -10.797 5.328 1.00 7.02 O ATOM 1218 CB TYR A 169 10.017 -8.534 5.645 1.00 7.31 C ATOM 1219 CG TYR A 169 9.006 -7.414 5.478 1.00 7.47 C ATOM 1220 CD1 TYR A 169 9.426 -6.105 5.332 1.00 8.55 C ATOM 1221 CD2 TYR A 169 7.639 -7.665 5.476 1.00 7.77 C ATOM 1222 CE1 TYR A 169 8.514 -5.078 5.174 1.00 9.05 C ATOM 1223 CE2 TYR A 169 6.711 -6.636 5.319 1.00 7.54 C ATOM 1224 CZ TYR A 169 7.162 -5.350 5.162 1.00 7.81 C ATOM 1225 OH TYR A 169 6.260 -4.312 5.008 1.00 9.43 O ATOM 0 H TYR A 169 9.522 -10.518 4.016 1.00 6.20 H new ATOM 0 HA TYR A 169 10.892 -8.186 3.819 1.00 6.67 H new ATOM 0 HB2 TYR A 169 9.571 -9.300 6.039 1.00 7.31 H new ATOM 0 HB3 TYR A 169 10.698 -8.248 6.274 1.00 7.31 H new ATOM 0 HD1 TYR A 169 10.336 -5.912 5.340 1.00 8.55 H new ATOM 0 HD2 TYR A 169 7.337 -8.538 5.582 1.00 7.77 H new ATOM 0 HE1 TYR A 169 8.813 -4.203 5.076 1.00 9.05 H new ATOM 0 HE2 TYR A 169 5.799 -6.819 5.321 1.00 7.54 H new ATOM 0 HH TYR A 169 6.527 -3.642 5.439 1.00 9.43 H new ATOM 1226 N ASN A 170 13.111 -9.189 4.287 1.00 6.74 N ATOM 1227 CA ASN A 170 14.408 -9.735 4.670 1.00 6.80 C ATOM 1228 C ASN A 170 15.129 -8.798 5.620 1.00 6.85 C ATOM 1229 O ASN A 170 15.035 -7.571 5.515 1.00 7.49 O ATOM 1230 CB ASN A 170 15.285 -9.999 3.441 1.00 7.62 C ATOM 1231 CG ASN A 170 14.762 -11.130 2.593 1.00 7.18 C ATOM 1232 OD1 ASN A 170 14.125 -12.047 3.111 1.00 7.98 O ATOM 1233 ND2 ASN A 170 15.019 -11.081 1.293 1.00 8.11 N ATOM 0 H ASN A 170 13.155 -8.495 3.781 1.00 6.74 H new ATOM 0 HA ASN A 170 14.245 -10.578 5.121 1.00 6.80 H new ATOM 0 HB2 ASN A 170 15.336 -9.193 2.904 1.00 7.62 H new ATOM 0 HB3 ASN A 170 16.188 -10.205 3.730 1.00 7.62 H new ATOM 0 HD21 ASN A 170 14.737 -11.707 0.775 1.00 8.11 H new ATOM 0 HD22 ASN A 170 15.468 -10.423 0.968 1.00 8.11 H new ATOM 1234 N PHE A 171 15.853 -9.394 6.558 1.00 7.57 N ATOM 1235 CA PHE A 171 16.685 -8.660 7.499 1.00 7.95 C ATOM 1236 C PHE A 171 18.123 -9.113 7.380 1.00 6.98 C ATOM 1237 O PHE A 171 18.409 -10.312 7.456 1.00 7.68 O ATOM 1238 CB PHE A 171 16.201 -8.892 8.934 1.00 10.17 C ATOM 1239 CG PHE A 171 14.866 -8.291 9.204 1.00 9.18 C ATOM 1240 CD1 PHE A 171 13.706 -8.957 8.831 1.00 9.46 C ATOM 1241 CD2 PHE A 171 14.763 -7.046 9.792 1.00 10.33 C ATOM 1242 CE1 PHE A 171 12.461 -8.390 9.053 1.00 11.52 C ATOM 1243 CE2 PHE A 171 13.515 -6.476 10.017 1.00 10.83 C ATOM 1244 CZ PHE A 171 12.369 -7.149 9.647 1.00 11.03 C ATOM 0 H PHE A 171 15.875 -10.247 6.667 1.00 7.57 H new ATOM 0 HA PHE A 171 16.623 -7.715 7.290 1.00 7.95 H new ATOM 0 HB2 PHE A 171 16.161 -9.846 9.106 1.00 10.17 H new ATOM 0 HB3 PHE A 171 16.849 -8.519 9.552 1.00 10.17 H new ATOM 0 HD1 PHE A 171 13.765 -9.793 8.428 1.00 9.46 H new ATOM 0 HD2 PHE A 171 15.533 -6.586 10.039 1.00 10.33 H new ATOM 0 HE1 PHE A 171 11.690 -8.845 8.802 1.00 11.52 H new ATOM 0 HE2 PHE A 171 13.453 -5.639 10.418 1.00 10.83 H new ATOM 0 HZ PHE A 171 11.535 -6.766 9.798 1.00 11.03 H new ATOM 1245 N GLY A 172 19.022 -8.154 7.174 1.00 8.04 N ATOM 1246 CA GLY A 172 20.443 -8.428 7.254 1.00 8.55 C ATOM 1247 C GLY A 172 21.122 -8.772 5.946 1.00 9.36 C ATOM 1248 O GLY A 172 22.338 -8.973 5.930 1.00 9.83 O ATOM 0 H GLY A 172 18.824 -7.338 6.987 1.00 8.04 H new ATOM 0 HA2 GLY A 172 20.884 -7.652 7.634 1.00 8.55 H new ATOM 0 HA3 GLY A 172 20.579 -9.163 7.873 1.00 8.55 H new ATOM 1249 N PHE A 173 20.370 -8.830 4.849 1.00 9.11 N ATOM 1250 CA PHE A 173 20.966 -9.117 3.550 1.00 8.81 C ATOM 1251 C PHE A 173 20.093 -8.599 2.427 1.00 8.54 C ATOM 1252 O PHE A 173 18.878 -8.428 2.597 1.00 9.64 O ATOM 1253 CB PHE A 173 21.215 -10.620 3.369 1.00 10.37 C ATOM 1254 CG PHE A 173 19.962 -11.430 3.153 1.00 8.30 C ATOM 1255 CD1 PHE A 173 19.660 -11.934 1.898 1.00 10.03 C ATOM 1256 CD2 PHE A 173 19.106 -11.709 4.208 1.00 9.47 C ATOM 1257 CE1 PHE A 173 18.513 -12.686 1.695 1.00 11.25 C ATOM 1258 CE2 PHE A 173 17.964 -12.464 4.013 1.00 11.35 C ATOM 1259 CZ PHE A 173 17.663 -12.950 2.754 1.00 10.27 C ATOM 0 H PHE A 173 19.519 -8.707 4.836 1.00 9.11 H new ATOM 0 HA PHE A 173 21.821 -8.660 3.518 1.00 8.81 H new ATOM 0 HB2 PHE A 173 21.808 -10.751 2.612 1.00 10.37 H new ATOM 0 HB3 PHE A 173 21.676 -10.958 4.152 1.00 10.37 H new ATOM 0 HD1 PHE A 173 20.233 -11.766 1.185 1.00 10.03 H new ATOM 0 HD2 PHE A 173 19.302 -11.384 5.057 1.00 9.47 H new ATOM 0 HE1 PHE A 173 18.315 -13.013 0.847 1.00 11.25 H new ATOM 0 HE2 PHE A 173 17.398 -12.645 4.729 1.00 11.35 H new ATOM 0 HZ PHE A 173 16.892 -13.452 2.620 1.00 10.27 H new ATOM 1260 N ILE A 174 20.716 -8.364 1.279 1.00 9.54 N ATOM 1261 CA ILE A 174 20.005 -7.977 0.075 1.00 10.99 C ATOM 1262 C ILE A 174 19.985 -9.163 -0.882 1.00 10.08 C ATOM 1263 O ILE A 174 21.040 -9.681 -1.278 1.00 13.21 O ATOM 1264 CB ILE A 174 20.651 -6.722 -0.546 1.00 12.26 C ATOM 1265 CG1 ILE A 174 20.339 -5.502 0.339 1.00 15.14 C ATOM 1266 CG2 ILE A 174 20.162 -6.503 -1.970 1.00 13.18 C ATOM 1267 CD1 ILE A 174 21.163 -4.280 0.026 1.00 18.50 C ATOM 0 H ILE A 174 21.568 -8.426 1.179 1.00 9.54 H new ATOM 0 HA ILE A 174 19.087 -7.740 0.281 1.00 10.99 H new ATOM 0 HB ILE A 174 21.612 -6.847 -0.589 1.00 12.26 H new ATOM 0 HG12 ILE A 174 19.400 -5.279 0.244 1.00 15.14 H new ATOM 0 HG13 ILE A 174 20.480 -5.745 1.267 1.00 15.14 H new ATOM 0 HG21 ILE A 174 20.582 -5.710 -2.338 1.00 13.18 H new ATOM 0 HG22 ILE A 174 20.393 -7.272 -2.514 1.00 13.18 H new ATOM 0 HG23 ILE A 174 19.199 -6.387 -1.967 1.00 13.18 H new ATOM 0 HD11 ILE A 174 20.910 -3.558 0.622 1.00 18.50 H new ATOM 0 HD12 ILE A 174 22.104 -4.484 0.147 1.00 18.50 H new ATOM 0 HD13 ILE A 174 21.007 -4.011 -0.893 1.00 18.50 H new ATOM 1268 N ASP A 175 18.782 -9.625 -1.215 1.00 10.06 N ATOM 1269 CA ASP A 175 18.628 -10.754 -2.122 1.00 10.59 C ATOM 1270 C ASP A 175 18.753 -10.261 -3.559 1.00 12.73 C ATOM 1271 O ASP A 175 17.817 -9.671 -4.107 1.00 10.88 O ATOM 1272 CB ASP A 175 17.280 -11.444 -1.891 1.00 11.21 C ATOM 1273 CG ASP A 175 17.034 -12.602 -2.844 1.00 15.13 C ATOM 1274 OD1 ASP A 175 15.962 -13.236 -2.733 1.00 15.99 O ATOM 1275 OD2 ASP A 175 17.897 -12.877 -3.710 1.00 14.53 O ATOM 0 H ASP A 175 18.042 -9.296 -0.925 1.00 10.06 H new ATOM 0 HA ASP A 175 19.325 -11.407 -1.952 1.00 10.59 H new ATOM 0 HB2 ASP A 175 17.241 -11.769 -0.978 1.00 11.21 H new ATOM 0 HB3 ASP A 175 16.568 -10.793 -1.991 1.00 11.21 H new ATOM 1276 N THR A 176 19.911 -10.495 -4.169 1.00 13.59 N ATOM 1277 CA THR A 176 20.181 -9.950 -5.496 1.00 13.78 C ATOM 1278 C THR A 176 19.380 -10.640 -6.594 1.00 13.28 C ATOM 1279 O THR A 176 19.436 -10.216 -7.749 1.00 17.10 O ATOM 1280 CB THR A 176 21.687 -9.991 -5.834 1.00 16.18 C ATOM 1281 OG1 THR A 176 22.144 -11.347 -5.809 1.00 18.33 O ATOM 1282 CG2 THR A 176 22.481 -9.179 -4.823 1.00 16.87 C ATOM 0 H THR A 176 20.550 -10.964 -3.835 1.00 13.59 H new ATOM 0 HA THR A 176 19.893 -9.024 -5.463 1.00 13.78 H new ATOM 0 HB THR A 176 21.818 -9.612 -6.717 1.00 16.18 H new ATOM 0 HG1 THR A 176 22.126 -11.664 -6.587 1.00 18.33 H new ATOM 0 HG21 THR A 176 23.424 -9.214 -5.048 1.00 16.87 H new ATOM 0 HG22 THR A 176 22.179 -8.257 -4.839 1.00 16.87 H new ATOM 0 HG23 THR A 176 22.347 -9.547 -3.935 1.00 16.87 H new ATOM 1283 N THR A 177 18.633 -11.686 -6.251 1.00 11.73 N ATOM 1284 CA THR A 177 17.769 -12.335 -7.235 1.00 13.91 C ATOM 1285 C THR A 177 16.352 -11.768 -7.217 1.00 13.91 C ATOM 1286 O THR A 177 15.505 -12.169 -8.022 1.00 15.37 O ATOM 1287 CB THR A 177 17.677 -13.867 -7.033 1.00 15.68 C ATOM 1288 OG1 THR A 177 16.934 -14.162 -5.844 1.00 17.17 O ATOM 1289 CG2 THR A 177 19.062 -14.501 -6.944 1.00 17.84 C ATOM 0 H THR A 177 18.611 -12.032 -5.464 1.00 11.73 H new ATOM 0 HA THR A 177 18.186 -12.152 -8.092 1.00 13.91 H new ATOM 0 HB THR A 177 17.221 -14.241 -7.803 1.00 15.68 H new ATOM 0 HG1 THR A 177 17.248 -13.722 -5.201 1.00 17.17 H new ATOM 0 HG21 THR A 177 18.972 -15.459 -6.818 1.00 17.84 H new ATOM 0 HG22 THR A 177 19.551 -14.328 -7.764 1.00 17.84 H new ATOM 0 HG23 THR A 177 19.545 -14.120 -6.194 1.00 17.84 H new ATOM 1290 N ALA A 178 16.097 -10.834 -6.303 1.00 11.62 N ATOM 1291 CA ALA A 178 14.734 -10.355 -6.060 1.00 11.62 C ATOM 1292 C ALA A 178 14.373 -9.087 -6.835 1.00 11.11 C ATOM 1293 O ALA A 178 13.251 -8.587 -6.722 1.00 12.85 O ATOM 1294 CB ALA A 178 14.502 -10.146 -4.566 1.00 11.31 C ATOM 0 H ALA A 178 16.698 -10.464 -5.812 1.00 11.62 H new ATOM 0 HA ALA A 178 14.145 -11.050 -6.393 1.00 11.62 H new ATOM 0 HB1 ALA A 178 13.597 -9.829 -4.420 1.00 11.31 H new ATOM 0 HB2 ALA A 178 14.630 -10.986 -4.098 1.00 11.31 H new ATOM 0 HB3 ALA A 178 15.132 -9.490 -4.229 1.00 11.31 H new ATOM 1295 N TYR A 179 15.304 -8.556 -7.617 1.00 10.39 N ATOM 1296 CA TYR A 179 15.035 -7.333 -8.364 1.00 10.56 C ATOM 1297 C TYR A 179 15.731 -7.379 -9.710 1.00 10.32 C ATOM 1298 O TYR A 179 16.597 -8.223 -9.936 1.00 12.37 O ATOM 1299 CB TYR A 179 15.476 -6.098 -7.566 1.00 9.97 C ATOM 1300 CG TYR A 179 16.938 -6.105 -7.179 1.00 9.29 C ATOM 1301 CD1 TYR A 179 17.345 -6.637 -5.960 1.00 10.53 C ATOM 1302 CD2 TYR A 179 17.912 -5.584 -8.026 1.00 10.99 C ATOM 1303 CE1 TYR A 179 18.679 -6.655 -5.590 1.00 10.57 C ATOM 1304 CE2 TYR A 179 19.257 -5.606 -7.666 1.00 10.47 C ATOM 1305 CZ TYR A 179 19.627 -6.141 -6.444 1.00 11.81 C ATOM 1306 OH TYR A 179 20.951 -6.165 -6.055 1.00 13.72 O ATOM 0 H TYR A 179 16.091 -8.884 -7.729 1.00 10.39 H new ATOM 0 HA TYR A 179 14.079 -7.267 -8.512 1.00 10.56 H new ATOM 0 HB2 TYR A 179 15.294 -5.303 -8.091 1.00 9.97 H new ATOM 0 HB3 TYR A 179 14.938 -6.036 -6.761 1.00 9.97 H new ATOM 0 HD1 TYR A 179 16.707 -6.988 -5.381 1.00 10.53 H new ATOM 0 HD2 TYR A 179 17.661 -5.217 -8.843 1.00 10.99 H new ATOM 0 HE1 TYR A 179 18.932 -7.012 -4.770 1.00 10.57 H new ATOM 0 HE2 TYR A 179 19.902 -5.264 -8.242 1.00 10.47 H new ATOM 0 HH TYR A 179 21.438 -5.942 -6.702 1.00 13.72 H new ATOM 1307 N THR A 180 15.345 -6.477 -10.605 1.00 9.93 N ATOM 1308 CA THR A 180 15.989 -6.373 -11.908 1.00 11.83 C ATOM 1309 C THR A 180 16.851 -5.118 -11.914 1.00 10.95 C ATOM 1310 O THR A 180 16.641 -4.213 -11.107 1.00 10.62 O ATOM 1311 CB THR A 180 14.954 -6.296 -13.044 1.00 12.73 C ATOM 1312 OG1 THR A 180 14.121 -5.149 -12.843 1.00 15.15 O ATOM 1313 CG2 THR A 180 14.079 -7.540 -13.054 1.00 14.81 C ATOM 0 H THR A 180 14.709 -5.913 -10.476 1.00 9.93 H new ATOM 0 HA THR A 180 16.530 -7.164 -12.058 1.00 11.83 H new ATOM 0 HB THR A 180 15.424 -6.231 -13.890 1.00 12.73 H new ATOM 0 HG1 THR A 180 13.390 -5.260 -13.241 1.00 15.15 H new ATOM 0 HG21 THR A 180 13.433 -7.476 -13.775 1.00 14.81 H new ATOM 0 HG22 THR A 180 14.633 -8.325 -13.186 1.00 14.81 H new ATOM 0 HG23 THR A 180 13.612 -7.614 -12.207 1.00 14.81 H new ATOM 1314 N GLY A 181 17.822 -5.062 -12.824 1.00 12.91 N ATOM 1315 CA GLY A 181 18.685 -3.897 -12.927 1.00 13.66 C ATOM 1316 C GLY A 181 19.453 -3.620 -11.647 1.00 10.20 C ATOM 1317 O GLY A 181 19.861 -4.546 -10.946 1.00 12.18 O ATOM 0 H GLY A 181 17.994 -5.688 -13.388 1.00 12.91 H new ATOM 0 HA2 GLY A 181 19.313 -4.028 -13.654 1.00 13.66 H new ATOM 0 HA3 GLY A 181 18.148 -3.121 -13.152 1.00 13.66 H new ATOM 1318 N SER A 182 19.652 -2.345 -11.339 1.00 10.27 N ATOM 1319 CA SER A 182 20.408 -1.975 -10.150 1.00 10.73 C ATOM 1320 C SER A 182 19.537 -1.273 -9.112 1.00 9.62 C ATOM 1321 O SER A 182 18.429 -0.800 -9.412 1.00 11.11 O ATOM 1322 CB SER A 182 21.601 -1.088 -10.511 1.00 15.39 C ATOM 1323 OG SER A 182 21.172 0.042 -11.236 1.00 22.88 O ATOM 0 H SER A 182 19.360 -1.682 -11.802 1.00 10.27 H new ATOM 0 HA SER A 182 20.734 -2.801 -9.759 1.00 10.73 H new ATOM 0 HB2 SER A 182 22.058 -0.807 -9.703 1.00 15.39 H new ATOM 0 HB3 SER A 182 22.240 -1.594 -11.037 1.00 15.39 H new ATOM 0 HG SER A 182 21.835 0.521 -11.427 1.00 22.88 H new ATOM 1324 N ILE A 183 20.031 -1.231 -7.881 1.00 9.02 N ATOM 1325 CA ILE A 183 19.363 -0.502 -6.818 1.00 10.05 C ATOM 1326 C ILE A 183 19.884 0.929 -6.816 1.00 10.06 C ATOM 1327 O ILE A 183 21.095 1.147 -6.788 1.00 10.26 O ATOM 1328 CB ILE A 183 19.619 -1.149 -5.444 1.00 8.16 C ATOM 1329 CG1 ILE A 183 19.253 -2.636 -5.478 1.00 10.32 C ATOM 1330 CG2 ILE A 183 18.856 -0.405 -4.359 1.00 9.98 C ATOM 1331 CD1 ILE A 183 19.494 -3.368 -4.159 1.00 9.35 C ATOM 0 H ILE A 183 20.758 -1.622 -7.641 1.00 9.02 H new ATOM 0 HA ILE A 183 18.406 -0.519 -6.977 1.00 10.05 H new ATOM 0 HB ILE A 183 20.564 -1.085 -5.235 1.00 8.16 H new ATOM 0 HG12 ILE A 183 18.318 -2.723 -5.719 1.00 10.32 H new ATOM 0 HG13 ILE A 183 19.768 -3.070 -6.176 1.00 10.32 H new ATOM 0 HG21 ILE A 183 19.026 -0.822 -3.500 1.00 9.98 H new ATOM 0 HG22 ILE A 183 19.149 0.519 -4.333 1.00 9.98 H new ATOM 0 HG23 ILE A 183 17.906 -0.437 -4.551 1.00 9.98 H new ATOM 0 HD11 ILE A 183 19.241 -4.300 -4.255 1.00 9.35 H new ATOM 0 HD12 ILE A 183 20.433 -3.311 -3.924 1.00 9.35 H new ATOM 0 HD13 ILE A 183 18.961 -2.959 -3.460 1.00 9.35 H new ATOM 1332 N THR A 184 18.978 1.901 -6.886 1.00 8.99 N ATOM 1333 CA THR A 184 19.359 3.304 -6.781 1.00 8.17 C ATOM 1334 C THR A 184 19.119 3.799 -5.368 1.00 8.07 C ATOM 1335 O THR A 184 17.993 3.730 -4.858 1.00 8.82 O ATOM 1336 CB THR A 184 18.589 4.180 -7.784 1.00 9.21 C ATOM 1337 OG1 THR A 184 18.948 3.785 -9.114 1.00 13.54 O ATOM 1338 CG2 THR A 184 18.937 5.655 -7.589 1.00 9.52 C ATOM 0 H THR A 184 18.135 1.767 -6.994 1.00 8.99 H new ATOM 0 HA THR A 184 20.303 3.372 -6.994 1.00 8.17 H new ATOM 0 HB THR A 184 17.637 4.063 -7.640 1.00 9.21 H new ATOM 0 HG1 THR A 184 18.294 3.405 -9.480 1.00 13.54 H new ATOM 0 HG21 THR A 184 18.443 6.191 -8.229 1.00 9.52 H new ATOM 0 HG22 THR A 184 18.700 5.927 -6.689 1.00 9.52 H new ATOM 0 HG23 THR A 184 19.889 5.784 -7.726 1.00 9.52 H new ATOM 1339 N TYR A 185 20.182 4.268 -4.725 1.00 7.80 N ATOM 1340 CA TYR A 185 20.097 4.755 -3.363 1.00 7.40 C ATOM 1341 C TYR A 185 19.901 6.259 -3.323 1.00 10.46 C ATOM 1342 O TYR A 185 20.385 6.995 -4.190 1.00 11.55 O ATOM 1343 CB TYR A 185 21.328 4.339 -2.553 1.00 9.01 C ATOM 1344 CG TYR A 185 21.360 2.858 -2.252 1.00 7.95 C ATOM 1345 CD1 TYR A 185 20.858 2.358 -1.055 1.00 8.86 C ATOM 1346 CD2 TYR A 185 21.882 1.955 -3.173 1.00 9.12 C ATOM 1347 CE1 TYR A 185 20.892 0.999 -0.780 1.00 9.42 C ATOM 1348 CE2 TYR A 185 21.921 0.598 -2.906 1.00 8.81 C ATOM 1349 CZ TYR A 185 21.421 0.128 -1.708 1.00 8.30 C ATOM 1350 OH TYR A 185 21.461 -1.221 -1.422 1.00 9.88 O ATOM 0 H TYR A 185 20.969 4.311 -5.068 1.00 7.80 H new ATOM 0 HA TYR A 185 19.317 4.347 -2.954 1.00 7.40 H new ATOM 0 HB2 TYR A 185 22.129 4.582 -3.043 1.00 9.01 H new ATOM 0 HB3 TYR A 185 21.344 4.834 -1.719 1.00 9.01 H new ATOM 0 HD1 TYR A 185 20.494 2.943 -0.430 1.00 8.86 H new ATOM 0 HD2 TYR A 185 22.211 2.270 -3.984 1.00 9.12 H new ATOM 0 HE1 TYR A 185 20.559 0.677 0.027 1.00 9.42 H new ATOM 0 HE2 TYR A 185 22.281 0.008 -3.528 1.00 8.81 H new ATOM 0 HH TYR A 185 21.804 -1.634 -2.068 1.00 9.88 H new ATOM 1351 N THR A 186 19.202 6.711 -2.298 1.00 8.48 N ATOM 1352 CA THR A 186 18.824 8.107 -2.166 1.00 8.61 C ATOM 1353 C THR A 186 18.874 8.513 -0.690 1.00 7.19 C ATOM 1354 O THR A 186 18.698 7.677 0.207 1.00 8.27 O ATOM 1355 CB THR A 186 17.423 8.330 -2.822 1.00 9.43 C ATOM 1356 OG1 THR A 186 17.176 9.727 -3.023 1.00 9.13 O ATOM 1357 CG2 THR A 186 16.298 7.709 -1.992 1.00 9.93 C ATOM 0 H THR A 186 18.930 6.212 -1.652 1.00 8.48 H new ATOM 0 HA THR A 186 19.449 8.681 -2.636 1.00 8.61 H new ATOM 0 HB THR A 186 17.435 7.883 -3.683 1.00 9.43 H new ATOM 0 HG1 THR A 186 16.889 10.066 -2.310 1.00 9.13 H new ATOM 0 HG21 THR A 186 15.447 7.868 -2.430 1.00 9.93 H new ATOM 0 HG22 THR A 186 16.446 6.754 -1.910 1.00 9.93 H new ATOM 0 HG23 THR A 186 16.287 8.111 -1.109 1.00 9.93 H new ATOM 1358 N ALA A 187 19.131 9.794 -0.440 1.00 8.55 N ATOM 1359 CA ALA A 187 19.325 10.280 0.922 1.00 9.62 C ATOM 1360 C ALA A 187 18.069 10.233 1.785 1.00 9.62 C ATOM 1361 O ALA A 187 16.949 10.386 1.294 1.00 10.07 O ATOM 1362 CB ALA A 187 19.908 11.695 0.908 1.00 12.20 C ATOM 0 H ALA A 187 19.197 10.399 -1.047 1.00 8.55 H new ATOM 0 HA ALA A 187 19.954 9.667 1.334 1.00 9.62 H new ATOM 0 HB1 ALA A 187 20.031 12.004 1.819 1.00 12.20 H new ATOM 0 HB2 ALA A 187 20.764 11.688 0.451 1.00 12.20 H new ATOM 0 HB3 ALA A 187 19.299 12.291 0.445 1.00 12.20 H new ATOM 1363 N VAL A 188 18.274 10.041 3.082 1.00 10.59 N ATOM 1364 CA VAL A 188 17.194 9.987 4.055 1.00 10.19 C ATOM 1365 C VAL A 188 17.397 11.051 5.125 1.00 10.39 C ATOM 1366 O VAL A 188 18.523 11.271 5.580 1.00 11.88 O ATOM 1367 CB VAL A 188 17.115 8.579 4.698 1.00 9.93 C ATOM 1368 CG1 VAL A 188 16.312 8.593 5.997 1.00 10.55 C ATOM 1369 CG2 VAL A 188 16.521 7.586 3.707 1.00 10.07 C ATOM 0 H VAL A 188 19.056 9.937 3.426 1.00 10.59 H new ATOM 0 HA VAL A 188 16.356 10.162 3.599 1.00 10.19 H new ATOM 0 HB VAL A 188 18.017 8.302 4.922 1.00 9.93 H new ATOM 0 HG11 VAL A 188 16.284 7.698 6.370 1.00 10.55 H new ATOM 0 HG12 VAL A 188 16.733 9.194 6.631 1.00 10.55 H new ATOM 0 HG13 VAL A 188 15.408 8.896 5.816 1.00 10.55 H new ATOM 0 HG21 VAL A 188 16.475 6.708 4.117 1.00 10.07 H new ATOM 0 HG22 VAL A 188 15.629 7.873 3.457 1.00 10.07 H new ATOM 0 HG23 VAL A 188 17.081 7.544 2.916 1.00 10.07 H new ATOM 1370 N SER A 189 16.321 11.729 5.506 1.00 9.40 N ATOM 1371 CA SER A 189 16.329 12.554 6.702 1.00 9.37 C ATOM 1372 C SER A 189 15.598 11.803 7.798 1.00 11.23 C ATOM 1373 O SER A 189 14.482 11.330 7.582 1.00 10.88 O ATOM 1374 CB SER A 189 15.615 13.876 6.455 1.00 14.00 C ATOM 1375 OG SER A 189 15.461 14.575 7.680 1.00 14.97 O ATOM 0 H SER A 189 15.573 11.723 5.082 1.00 9.40 H new ATOM 0 HA SER A 189 17.247 12.741 6.954 1.00 9.37 H new ATOM 0 HB2 SER A 189 16.122 14.414 5.827 1.00 14.00 H new ATOM 0 HB3 SER A 189 14.747 13.714 6.054 1.00 14.00 H new ATOM 0 HG SER A 189 14.815 15.109 7.619 1.00 14.97 H new ATOM 1376 N THR A 190 16.216 11.698 8.970 1.00 12.09 N ATOM 1377 CA THR A 190 15.588 11.043 10.114 1.00 12.54 C ATOM 1378 C THR A 190 15.010 12.062 11.095 1.00 11.65 C ATOM 1379 O THR A 190 14.592 11.711 12.198 1.00 14.07 O ATOM 1380 CB THR A 190 16.593 10.167 10.872 1.00 14.76 C ATOM 1381 OG1 THR A 190 17.646 10.994 11.382 1.00 15.90 O ATOM 1382 CG2 THR A 190 17.190 9.120 9.952 1.00 16.15 C ATOM 0 H THR A 190 17.006 12.002 9.125 1.00 12.09 H new ATOM 0 HA THR A 190 14.873 10.493 9.757 1.00 12.54 H new ATOM 0 HB THR A 190 16.131 9.720 11.599 1.00 14.76 H new ATOM 0 HG1 THR A 190 17.412 11.324 12.118 1.00 15.90 H new ATOM 0 HG21 THR A 190 17.822 8.576 10.447 1.00 16.15 H new ATOM 0 HG22 THR A 190 16.483 8.555 9.602 1.00 16.15 H new ATOM 0 HG23 THR A 190 17.647 9.558 9.217 1.00 16.15 H new ATOM 1383 N LYS A 191 14.986 13.325 10.682 1.00 13.00 N ATOM 1384 CA LYS A 191 14.587 14.422 11.564 1.00 16.15 C ATOM 1385 C LYS A 191 13.179 14.298 12.140 1.00 15.86 C ATOM 1386 O LYS A 191 12.919 14.764 13.251 1.00 20.12 O ATOM 1387 CB LYS A 191 14.755 15.765 10.852 1.00 18.78 C ATOM 0 H LYS A 191 15.199 13.572 9.886 1.00 13.00 H new ATOM 0 HA LYS A 191 15.183 14.370 12.327 1.00 16.15 H new ATOM 1388 N GLN A 192 12.268 13.685 11.388 1.00 13.42 N ATOM 1389 CA GLN A 192 10.910 13.465 11.868 1.00 14.43 C ATOM 1390 C GLN A 192 10.683 12.020 12.328 1.00 11.61 C ATOM 1391 O GLN A 192 9.558 11.635 12.637 1.00 13.76 O ATOM 1392 CB GLN A 192 9.889 13.838 10.790 1.00 15.20 C ATOM 1393 CG GLN A 192 9.863 15.319 10.428 1.00 18.92 C ATOM 1394 CD GLN A 192 8.742 15.648 9.462 1.00 28.08 C ATOM 1395 OE1 GLN A 192 7.571 15.690 9.842 1.00 34.21 O ATOM 1396 NE2 GLN A 192 9.093 15.866 8.201 1.00 31.66 N ATOM 0 H GLN A 192 12.418 13.389 10.595 1.00 13.42 H new ATOM 0 HA GLN A 192 10.787 14.041 12.639 1.00 14.43 H new ATOM 0 HB2 GLN A 192 10.079 13.324 9.989 1.00 15.20 H new ATOM 0 HB3 GLN A 192 9.006 13.575 11.093 1.00 15.20 H new ATOM 0 HG2 GLN A 192 9.758 15.847 11.235 1.00 18.92 H new ATOM 0 HG3 GLN A 192 10.713 15.570 10.033 1.00 18.92 H new ATOM 0 HE21 GLN A 192 9.921 15.828 7.973 1.00 31.66 H new ATOM 0 HE22 GLN A 192 8.492 16.045 7.612 1.00 31.66 H new ATOM 1397 N GLY A 193 11.752 11.231 12.365 1.00 11.25 N ATOM 1398 CA GLY A 193 11.667 9.843 12.792 1.00 10.51 C ATOM 1399 C GLY A 193 11.265 8.851 11.716 1.00 10.39 C ATOM 1400 O GLY A 193 11.131 7.661 12.010 1.00 9.35 O ATOM 0 H GLY A 193 12.543 11.486 12.144 1.00 11.25 H new ATOM 0 HA2 GLY A 193 12.529 9.577 13.149 1.00 10.51 H new ATOM 0 HA3 GLY A 193 11.028 9.783 13.520 1.00 10.51 H new ATOM 1401 N PHE A 194 11.092 9.330 10.482 1.00 9.00 N ATOM 1402 CA PHE A 194 10.627 8.499 9.372 1.00 9.39 C ATOM 1403 C PHE A 194 11.744 8.214 8.381 1.00 9.00 C ATOM 1404 O PHE A 194 12.795 8.867 8.396 1.00 9.10 O ATOM 1405 CB PHE A 194 9.507 9.201 8.588 1.00 10.38 C ATOM 1406 CG PHE A 194 8.293 9.546 9.402 1.00 9.48 C ATOM 1407 CD1 PHE A 194 7.870 10.863 9.511 1.00 13.20 C ATOM 1408 CD2 PHE A 194 7.556 8.558 10.031 1.00 11.66 C ATOM 1409 CE1 PHE A 194 6.740 11.187 10.248 1.00 13.23 C ATOM 1410 CE2 PHE A 194 6.434 8.871 10.774 1.00 12.33 C ATOM 1411 CZ PHE A 194 6.022 10.190 10.880 1.00 13.58 C ATOM 0 H PHE A 194 11.242 10.149 10.266 1.00 9.00 H new ATOM 0 HA PHE A 194 10.308 7.674 9.769 1.00 9.39 H new ATOM 0 HB2 PHE A 194 9.863 10.015 8.199 1.00 10.38 H new ATOM 0 HB3 PHE A 194 9.237 8.630 7.852 1.00 10.38 H new ATOM 0 HD1 PHE A 194 8.350 11.536 9.085 1.00 13.20 H new ATOM 0 HD2 PHE A 194 7.820 7.670 9.952 1.00 11.66 H new ATOM 0 HE1 PHE A 194 6.466 12.073 10.316 1.00 13.23 H new ATOM 0 HE2 PHE A 194 5.956 8.198 11.202 1.00 12.33 H new ATOM 0 HZ PHE A 194 5.264 10.403 11.375 1.00 13.58 H new ATOM 1412 N TRP A 195 11.496 7.245 7.499 1.00 8.16 N ATOM 1413 CA TRP A 195 12.332 7.031 6.329 1.00 8.80 C ATOM 1414 C TRP A 195 11.916 8.069 5.280 1.00 7.71 C ATOM 1415 O TRP A 195 11.183 7.766 4.318 1.00 8.66 O ATOM 1416 CB TRP A 195 12.183 5.591 5.815 1.00 8.19 C ATOM 1417 CG TRP A 195 12.728 4.567 6.783 1.00 7.10 C ATOM 1418 CD1 TRP A 195 12.044 3.934 7.777 1.00 7.90 C ATOM 1419 CD2 TRP A 195 14.084 4.082 6.854 1.00 7.79 C ATOM 1420 NE1 TRP A 195 12.886 3.078 8.459 1.00 8.37 N ATOM 1421 CE2 TRP A 195 14.140 3.150 7.910 1.00 8.46 C ATOM 1422 CE3 TRP A 195 15.249 4.337 6.113 1.00 8.70 C ATOM 1423 CZ2 TRP A 195 15.322 2.471 8.252 1.00 9.63 C ATOM 1424 CZ3 TRP A 195 16.417 3.655 6.450 1.00 9.06 C ATOM 1425 CH2 TRP A 195 16.442 2.734 7.505 1.00 9.13 C ATOM 0 H TRP A 195 10.838 6.696 7.566 1.00 8.16 H new ATOM 0 HA TRP A 195 13.272 7.144 6.542 1.00 8.80 H new ATOM 0 HB2 TRP A 195 11.245 5.406 5.649 1.00 8.19 H new ATOM 0 HB3 TRP A 195 12.644 5.505 4.966 1.00 8.19 H new ATOM 0 HD1 TRP A 195 11.143 4.060 7.968 1.00 7.90 H new ATOM 0 HE1 TRP A 195 12.660 2.579 9.122 1.00 8.37 H new ATOM 0 HE3 TRP A 195 15.242 4.948 5.412 1.00 8.70 H new ATOM 0 HZ2 TRP A 195 15.344 1.866 8.958 1.00 9.63 H new ATOM 0 HZ3 TRP A 195 17.194 3.815 5.965 1.00 9.06 H new ATOM 0 HH2 TRP A 195 17.235 2.291 7.703 1.00 9.13 H new ATOM 1426 N GLU A 196 12.351 9.310 5.504 1.00 9.22 N ATOM 1427 CA GLU A 196 11.936 10.445 4.689 1.00 9.95 C ATOM 1428 C GLU A 196 12.960 10.721 3.605 1.00 8.52 C ATOM 1429 O GLU A 196 14.163 10.789 3.871 1.00 10.05 O ATOM 1430 CB GLU A 196 11.762 11.672 5.580 1.00 10.53 C ATOM 1431 CG GLU A 196 11.094 12.856 4.906 1.00 11.94 C ATOM 1432 CD GLU A 196 10.774 13.971 5.882 1.00 18.34 C ATOM 1433 OE1 GLU A 196 10.259 15.018 5.437 1.00 20.80 O ATOM 1434 OE2 GLU A 196 11.039 13.811 7.095 1.00 17.69 O ATOM 0 H GLU A 196 12.897 9.515 6.136 1.00 9.22 H new ATOM 0 HA GLU A 196 11.090 10.238 4.261 1.00 9.95 H new ATOM 0 HB2 GLU A 196 11.239 11.421 6.357 1.00 10.53 H new ATOM 0 HB3 GLU A 196 12.634 11.949 5.902 1.00 10.53 H new ATOM 0 HG2 GLU A 196 11.674 13.197 4.208 1.00 11.94 H new ATOM 0 HG3 GLU A 196 10.276 12.561 4.476 1.00 11.94 H new ATOM 1435 N TRP A 197 12.490 10.879 2.377 1.00 9.41 N ATOM 1436 CA TRP A 197 13.367 11.011 1.230 1.00 9.00 C ATOM 1437 C TRP A 197 12.719 11.946 0.219 1.00 8.34 C ATOM 1438 O TRP A 197 11.601 12.408 0.431 1.00 9.28 O ATOM 1439 CB TRP A 197 13.652 9.628 0.619 1.00 7.57 C ATOM 1440 CG TRP A 197 12.429 8.961 0.037 1.00 7.93 C ATOM 1441 CD1 TRP A 197 11.366 8.433 0.720 1.00 8.64 C ATOM 1442 CD2 TRP A 197 12.160 8.750 -1.354 1.00 7.86 C ATOM 1443 NE1 TRP A 197 10.445 7.920 -0.170 1.00 8.30 N ATOM 1444 CE2 TRP A 197 10.908 8.107 -1.446 1.00 7.83 C ATOM 1445 CE3 TRP A 197 12.850 9.060 -2.532 1.00 8.31 C ATOM 1446 CZ2 TRP A 197 10.341 7.760 -2.669 1.00 8.99 C ATOM 1447 CZ3 TRP A 197 12.290 8.709 -3.740 1.00 8.87 C ATOM 1448 CH2 TRP A 197 11.048 8.063 -3.801 1.00 8.44 C ATOM 0 H TRP A 197 11.652 10.913 2.187 1.00 9.41 H new ATOM 0 HA TRP A 197 14.218 11.389 1.502 1.00 9.00 H new ATOM 0 HB2 TRP A 197 14.322 9.722 -0.076 1.00 7.57 H new ATOM 0 HB3 TRP A 197 14.031 9.053 1.302 1.00 7.57 H new ATOM 0 HD1 TRP A 197 11.278 8.422 1.646 1.00 8.64 H new ATOM 0 HE1 TRP A 197 9.701 7.544 0.042 1.00 8.30 H new ATOM 0 HE3 TRP A 197 13.671 9.495 -2.499 1.00 8.31 H new ATOM 0 HZ2 TRP A 197 9.513 7.338 -2.715 1.00 8.99 H new ATOM 0 HZ3 TRP A 197 12.743 8.904 -4.528 1.00 8.87 H new ATOM 0 HH2 TRP A 197 10.696 7.835 -4.631 1.00 8.44 H new ATOM 1449 N THR A 198 13.423 12.239 -0.867 1.00 7.99 N ATOM 1450 CA THR A 198 12.921 13.173 -1.865 1.00 8.73 C ATOM 1451 C THR A 198 12.905 12.541 -3.244 1.00 9.21 C ATOM 1452 O THR A 198 13.953 12.274 -3.837 1.00 9.86 O ATOM 1453 CB THR A 198 13.767 14.461 -1.894 1.00 9.38 C ATOM 1454 OG1 THR A 198 13.710 15.089 -0.611 1.00 12.36 O ATOM 1455 CG2 THR A 198 13.228 15.433 -2.938 1.00 10.91 C ATOM 0 H THR A 198 14.196 11.907 -1.045 1.00 7.99 H new ATOM 0 HA THR A 198 12.012 13.402 -1.615 1.00 8.73 H new ATOM 0 HB THR A 198 14.681 14.227 -2.119 1.00 9.38 H new ATOM 0 HG1 THR A 198 14.222 14.687 -0.079 1.00 12.36 H new ATOM 0 HG21 THR A 198 13.771 16.237 -2.943 1.00 10.91 H new ATOM 0 HG22 THR A 198 13.259 15.017 -3.814 1.00 10.91 H new ATOM 0 HG23 THR A 198 12.311 15.664 -2.722 1.00 10.91 H new ATOM 1456 N SER A 199 11.704 12.282 -3.751 1.00 8.35 N ATOM 1457 CA SER A 199 11.559 11.803 -5.112 1.00 8.50 C ATOM 1458 C SER A 199 11.892 12.927 -6.089 1.00 8.25 C ATOM 1459 O SER A 199 11.656 14.103 -5.797 1.00 10.06 O ATOM 1460 CB SER A 199 10.132 11.299 -5.343 1.00 8.06 C ATOM 1461 OG SER A 199 9.901 10.978 -6.697 1.00 8.52 O ATOM 0 H SER A 199 10.965 12.378 -3.322 1.00 8.35 H new ATOM 0 HA SER A 199 12.172 11.066 -5.259 1.00 8.50 H new ATOM 0 HB2 SER A 199 9.973 10.516 -4.793 1.00 8.06 H new ATOM 0 HB3 SER A 199 9.500 11.978 -5.059 1.00 8.06 H new ATOM 0 HG SER A 199 10.509 10.468 -6.972 1.00 8.52 H new ATOM 1462 N THR A 200 12.422 12.556 -7.246 1.00 8.25 N ATOM 1463 CA THR A 200 12.867 13.519 -8.249 1.00 8.99 C ATOM 1464 C THR A 200 11.795 13.884 -9.277 1.00 10.45 C ATOM 1465 O THR A 200 12.043 14.711 -10.159 1.00 10.28 O ATOM 1466 CB THR A 200 14.109 12.993 -8.976 1.00 8.87 C ATOM 1467 OG1 THR A 200 13.850 11.655 -9.423 1.00 10.27 O ATOM 1468 CG2 THR A 200 15.318 12.994 -8.033 1.00 11.29 C ATOM 0 H THR A 200 12.535 11.735 -7.475 1.00 8.25 H new ATOM 0 HA THR A 200 13.074 14.331 -7.761 1.00 8.99 H new ATOM 0 HB THR A 200 14.306 13.566 -9.733 1.00 8.87 H new ATOM 0 HG1 THR A 200 14.560 11.315 -9.716 1.00 10.27 H new ATOM 0 HG21 THR A 200 16.097 12.659 -8.505 1.00 11.29 H new ATOM 0 HG22 THR A 200 15.490 13.898 -7.727 1.00 11.29 H new ATOM 0 HG23 THR A 200 15.134 12.425 -7.269 1.00 11.29 H new ATOM 1469 N GLY A 201 10.611 13.282 -9.179 1.00 7.63 N ATOM 1470 CA GLY A 201 9.517 13.697 -10.039 1.00 8.76 C ATOM 1471 C GLY A 201 8.573 12.581 -10.408 1.00 7.16 C ATOM 1472 O GLY A 201 8.577 11.520 -9.781 1.00 8.51 O ATOM 0 H GLY A 201 10.427 12.645 -8.632 1.00 7.63 H new ATOM 0 HA2 GLY A 201 9.016 14.399 -9.594 1.00 8.76 H new ATOM 0 HA3 GLY A 201 9.883 14.081 -10.851 1.00 8.76 H new ATOM 1473 N TYR A 202 7.755 12.815 -11.428 1.00 7.99 N ATOM 1474 CA TYR A 202 6.746 11.834 -11.785 1.00 7.99 C ATOM 1475 C TYR A 202 6.326 11.927 -13.244 1.00 8.06 C ATOM 1476 O TYR A 202 6.557 12.939 -13.925 1.00 8.96 O ATOM 1477 CB TYR A 202 5.503 12.012 -10.900 1.00 8.40 C ATOM 1478 CG TYR A 202 4.727 13.270 -11.217 1.00 7.79 C ATOM 1479 CD1 TYR A 202 5.121 14.504 -10.708 1.00 9.80 C ATOM 1480 CD2 TYR A 202 3.606 13.227 -12.040 1.00 10.34 C ATOM 1481 CE1 TYR A 202 4.416 15.660 -11.014 1.00 11.66 C ATOM 1482 CE2 TYR A 202 2.898 14.372 -12.337 1.00 12.49 C ATOM 1483 CZ TYR A 202 3.308 15.576 -11.828 1.00 11.12 C ATOM 1484 OH TYR A 202 2.587 16.713 -12.142 1.00 15.32 O ATOM 0 H TYR A 202 7.768 13.523 -11.917 1.00 7.99 H new ATOM 0 HA TYR A 202 7.145 10.961 -11.645 1.00 7.99 H new ATOM 0 HB2 TYR A 202 4.922 11.243 -11.009 1.00 8.40 H new ATOM 0 HB3 TYR A 202 5.775 12.032 -9.969 1.00 8.40 H new ATOM 0 HD1 TYR A 202 5.867 14.555 -10.155 1.00 9.80 H new ATOM 0 HD2 TYR A 202 3.330 12.413 -12.395 1.00 10.34 H new ATOM 0 HE1 TYR A 202 4.689 16.481 -10.673 1.00 11.66 H new ATOM 0 HE2 TYR A 202 2.145 14.327 -12.881 1.00 12.49 H new ATOM 0 HH TYR A 202 2.358 16.686 -12.950 1.00 15.32 H new ATOM 1485 N ALA A 203 5.677 10.868 -13.715 1.00 7.78 N ATOM 1486 CA ALA A 203 5.007 10.879 -15.007 1.00 8.23 C ATOM 1487 C ALA A 203 3.676 10.161 -14.856 1.00 8.42 C ATOM 1488 O ALA A 203 3.518 9.288 -13.988 1.00 8.82 O ATOM 1489 CB ALA A 203 5.851 10.194 -16.072 1.00 9.49 C ATOM 0 H ALA A 203 5.613 10.122 -13.292 1.00 7.78 H new ATOM 0 HA ALA A 203 4.870 11.796 -15.290 1.00 8.23 H new ATOM 0 HB1 ALA A 203 5.382 10.216 -16.921 1.00 9.49 H new ATOM 0 HB2 ALA A 203 6.699 10.657 -16.160 1.00 9.49 H new ATOM 0 HB3 ALA A 203 6.011 9.272 -15.815 1.00 9.49 H new ATOM 1490 N VAL A 204 2.720 10.528 -15.702 1.00 9.02 N ATOM 1491 CA VAL A 204 1.418 9.877 -15.740 1.00 8.63 C ATOM 1492 C VAL A 204 1.307 9.105 -17.048 1.00 10.19 C ATOM 1493 O VAL A 204 1.424 9.690 -18.134 1.00 11.19 O ATOM 1494 CB VAL A 204 0.272 10.910 -15.650 1.00 9.91 C ATOM 1495 CG1 VAL A 204 -1.079 10.218 -15.791 1.00 11.52 C ATOM 1496 CG2 VAL A 204 0.351 11.683 -14.333 1.00 10.56 C ATOM 0 H VAL A 204 2.810 11.165 -16.273 1.00 9.02 H new ATOM 0 HA VAL A 204 1.340 9.280 -14.980 1.00 8.63 H new ATOM 0 HB VAL A 204 0.367 11.543 -16.379 1.00 9.91 H new ATOM 0 HG11 VAL A 204 -1.788 10.877 -15.733 1.00 11.52 H new ATOM 0 HG12 VAL A 204 -1.125 9.769 -16.650 1.00 11.52 H new ATOM 0 HG13 VAL A 204 -1.185 9.566 -15.080 1.00 11.52 H new ATOM 0 HG21 VAL A 204 -0.374 12.327 -14.291 1.00 10.56 H new ATOM 0 HG22 VAL A 204 0.277 11.064 -13.590 1.00 10.56 H new ATOM 0 HG23 VAL A 204 1.200 12.149 -14.282 1.00 10.56 H new ATOM 1497 N GLY A 205 1.094 7.799 -16.959 1.00 9.43 N ATOM 1498 CA GLY A 205 1.001 6.973 -18.150 1.00 11.35 C ATOM 1499 C GLY A 205 2.234 7.118 -19.015 1.00 11.07 C ATOM 1500 O GLY A 205 3.356 7.060 -18.520 1.00 11.72 O ATOM 0 H GLY A 205 1.001 7.373 -16.218 1.00 9.43 H new ATOM 0 HA2 GLY A 205 0.890 6.044 -17.894 1.00 11.35 H new ATOM 0 HA3 GLY A 205 0.214 7.223 -18.659 1.00 11.35 H new ATOM 1501 N SER A 206 2.023 7.330 -20.311 1.00 14.33 N ATOM 1502 CA SER A 206 3.128 7.449 -21.255 1.00 14.34 C ATOM 1503 C SER A 206 3.579 8.899 -21.417 1.00 15.60 C ATOM 1504 O SER A 206 4.356 9.217 -22.321 1.00 18.79 O ATOM 1505 CB SER A 206 2.721 6.874 -22.612 1.00 17.94 C ATOM 1506 OG SER A 206 1.596 7.560 -23.129 1.00 22.23 O ATOM 0 H SER A 206 1.243 7.408 -20.665 1.00 14.33 H new ATOM 0 HA SER A 206 3.876 6.944 -20.900 1.00 14.34 H new ATOM 0 HB2 SER A 206 3.462 6.944 -23.234 1.00 17.94 H new ATOM 0 HB3 SER A 206 2.516 5.930 -22.520 1.00 17.94 H new ATOM 0 HG SER A 206 1.808 8.353 -23.305 1.00 22.23 H new ATOM 1507 N GLY A 207 3.099 9.772 -20.536 1.00 13.57 N ATOM 1508 CA GLY A 207 3.413 11.188 -20.591 1.00 14.77 C ATOM 1509 C GLY A 207 4.853 11.514 -20.247 1.00 15.52 C ATOM 1510 O GLY A 207 5.611 10.664 -19.777 1.00 14.63 O ATOM 0 H GLY A 207 2.579 9.554 -19.887 1.00 13.57 H new ATOM 0 HA2 GLY A 207 3.220 11.518 -21.483 1.00 14.77 H new ATOM 0 HA3 GLY A 207 2.829 11.663 -19.980 1.00 14.77 H new ATOM 1511 N THR A 208 5.235 12.763 -20.482 1.00 15.72 N ATOM 1512 CA THR A 208 6.592 13.196 -20.202 1.00 15.83 C ATOM 1513 C THR A 208 6.844 13.267 -18.702 1.00 15.78 C ATOM 1514 O THR A 208 5.947 13.582 -17.916 1.00 17.01 O ATOM 1515 CB THR A 208 6.883 14.564 -20.839 1.00 22.51 C ATOM 1516 OG1 THR A 208 5.967 15.532 -20.320 1.00 26.44 O ATOM 1517 CG2 THR A 208 6.725 14.486 -22.349 1.00 23.62 C ATOM 0 H THR A 208 4.722 13.374 -20.803 1.00 15.72 H new ATOM 0 HA THR A 208 7.189 12.538 -20.591 1.00 15.83 H new ATOM 0 HB THR A 208 7.794 14.822 -20.628 1.00 22.51 H new ATOM 0 HG1 THR A 208 6.203 15.754 -19.545 1.00 26.44 H new ATOM 0 HG21 THR A 208 6.911 15.354 -22.739 1.00 23.62 H new ATOM 0 HG22 THR A 208 7.346 13.832 -22.706 1.00 23.62 H new ATOM 0 HG23 THR A 208 5.817 14.222 -22.566 1.00 23.62 H new ATOM 1518 N PHE A 209 8.075 12.972 -18.314 1.00 13.36 N ATOM 1519 CA PHE A 209 8.457 13.027 -16.916 1.00 12.76 C ATOM 1520 C PHE A 209 8.630 14.473 -16.461 1.00 13.31 C ATOM 1521 O PHE A 209 9.323 15.264 -17.110 1.00 15.46 O ATOM 1522 CB PHE A 209 9.747 12.239 -16.704 1.00 13.03 C ATOM 1523 CG PHE A 209 10.171 12.139 -15.266 1.00 12.50 C ATOM 1524 CD1 PHE A 209 11.067 13.044 -14.731 1.00 11.95 C ATOM 1525 CD2 PHE A 209 9.675 11.132 -14.451 1.00 12.56 C ATOM 1526 CE1 PHE A 209 11.472 12.953 -13.411 1.00 12.71 C ATOM 1527 CE2 PHE A 209 10.082 11.030 -13.130 1.00 11.35 C ATOM 1528 CZ PHE A 209 10.973 11.941 -12.609 1.00 12.05 C ATOM 0 H PHE A 209 8.706 12.737 -18.849 1.00 13.36 H new ATOM 0 HA PHE A 209 7.752 12.628 -16.382 1.00 12.76 H new ATOM 0 HB2 PHE A 209 9.631 11.344 -17.061 1.00 13.03 H new ATOM 0 HB3 PHE A 209 10.459 12.658 -17.213 1.00 13.03 H new ATOM 0 HD1 PHE A 209 11.404 13.726 -15.267 1.00 11.95 H new ATOM 0 HD2 PHE A 209 9.064 10.520 -14.794 1.00 12.56 H new ATOM 0 HE1 PHE A 209 12.077 13.569 -13.064 1.00 12.71 H new ATOM 0 HE2 PHE A 209 9.753 10.345 -12.594 1.00 11.35 H new ATOM 0 HZ PHE A 209 11.239 11.877 -11.720 1.00 12.05 H new ATOM 1529 N LYS A 210 7.985 14.814 -15.350 1.00 11.14 N ATOM 1530 CA LYS A 210 8.077 16.130 -14.732 1.00 11.71 C ATOM 1531 C LYS A 210 9.116 16.090 -13.620 1.00 10.13 C ATOM 1532 O LYS A 210 8.932 15.382 -12.624 1.00 10.85 O ATOM 1533 CB LYS A 210 6.713 16.513 -14.146 1.00 11.83 C ATOM 1534 CG LYS A 210 6.703 17.799 -13.334 1.00 14.57 C ATOM 1535 CD LYS A 210 6.856 19.015 -14.226 1.00 16.55 C ATOM 1536 CE LYS A 210 6.474 20.292 -13.496 1.00 15.15 C ATOM 1537 NZ LYS A 210 6.653 21.447 -14.421 1.00 14.81 N ATOM 0 H LYS A 210 7.469 14.273 -14.925 1.00 11.14 H new ATOM 0 HA LYS A 210 8.338 16.786 -15.397 1.00 11.71 H new ATOM 0 HB2 LYS A 210 6.076 16.600 -14.873 1.00 11.83 H new ATOM 0 HB3 LYS A 210 6.403 15.787 -13.582 1.00 11.83 H new ATOM 0 HG2 LYS A 210 5.873 17.863 -12.836 1.00 14.57 H new ATOM 0 HG3 LYS A 210 7.423 17.779 -12.684 1.00 14.57 H new ATOM 0 HD2 LYS A 210 7.774 19.079 -14.534 1.00 16.55 H new ATOM 0 HD3 LYS A 210 6.299 18.912 -15.014 1.00 16.55 H new ATOM 0 HE2 LYS A 210 5.554 20.243 -13.194 1.00 15.15 H new ATOM 0 HE3 LYS A 210 7.026 20.405 -12.707 1.00 15.15 H new ATOM 0 HZ1 LYS A 210 7.105 22.092 -14.007 1.00 14.81 H new ATOM 0 HZ2 LYS A 210 7.105 21.184 -15.141 1.00 14.81 H new ATOM 0 HZ3 LYS A 210 5.856 21.756 -14.668 1.00 14.81 H new ATOM 1538 N SER A 211 10.205 16.831 -13.792 1.00 11.00 N ATOM 1539 CA ASER A 211 11.241 16.916 -12.769 0.62 11.65 C ATOM 1540 CA BSER A 211 11.245 16.921 -12.777 0.38 11.68 C ATOM 1541 C SER A 211 10.817 17.874 -11.669 1.00 13.36 C ATOM 1542 O SER A 211 10.673 19.078 -11.895 1.00 16.99 O ATOM 1543 CB ASER A 211 12.566 17.378 -13.375 0.62 13.69 C ATOM 1544 CB BSER A 211 12.554 17.400 -13.405 0.38 13.68 C ATOM 1545 OG ASER A 211 13.107 16.384 -14.222 0.62 14.95 O ATOM 1546 OG BSER A 211 13.502 17.744 -12.411 0.38 15.60 O ATOM 0 H ASER A 211 10.364 17.295 -14.498 0.62 11.00 H new ATOM 0 H BSER A 211 10.361 17.295 -14.499 0.38 11.00 H new ATOM 0 HA ASER A 211 11.365 16.031 -12.391 0.62 11.68 H new ATOM 0 HA BSER A 211 11.385 16.040 -12.395 0.38 11.68 H new ATOM 0 HB2ASER A 211 12.428 18.196 -13.877 0.62 13.68 H new ATOM 0 HB2BSER A 211 12.917 16.703 -13.974 0.38 13.68 H new ATOM 0 HB3ASER A 211 13.196 17.583 -12.667 0.62 13.68 H new ATOM 0 HB3BSER A 211 12.382 18.168 -13.971 0.38 13.68 H new ATOM 0 HG ASER A 211 13.833 16.656 -14.546 0.62 15.60 H new ATOM 0 HG BSER A 211 13.409 17.237 -11.748 0.38 15.60 H new ATOM 1547 N THR A 212 10.611 17.337 -10.474 1.00 12.68 N ATOM 1548 CA THR A 212 10.171 18.138 -9.350 1.00 12.63 C ATOM 1549 C THR A 212 10.428 17.388 -8.053 1.00 13.91 C ATOM 1550 O THR A 212 10.206 16.184 -7.972 1.00 13.59 O ATOM 1551 CB THR A 212 8.669 18.510 -9.480 1.00 12.04 C ATOM 1552 OG1 THR A 212 8.288 19.362 -8.394 1.00 17.85 O ATOM 1553 CG2 THR A 212 7.787 17.264 -9.489 1.00 13.57 C ATOM 0 H THR A 212 10.722 16.503 -10.295 1.00 12.68 H new ATOM 0 HA THR A 212 10.678 18.965 -9.343 1.00 12.63 H new ATOM 0 HB THR A 212 8.545 18.974 -10.323 1.00 12.04 H new ATOM 0 HG1 THR A 212 7.969 18.897 -7.771 1.00 17.85 H new ATOM 0 HG21 THR A 212 6.857 17.526 -9.571 1.00 13.57 H new ATOM 0 HG22 THR A 212 8.031 16.700 -10.240 1.00 13.57 H new ATOM 0 HG23 THR A 212 7.912 16.773 -8.662 1.00 13.57 H new ATOM 1554 N SER A 213 10.906 18.095 -7.039 1.00 10.88 N ATOM 1555 CA SER A 213 11.226 17.462 -5.760 1.00 10.90 C ATOM 1556 C SER A 213 9.976 17.189 -4.944 1.00 12.14 C ATOM 1557 O SER A 213 9.192 18.097 -4.655 1.00 14.80 O ATOM 1558 CB SER A 213 12.196 18.324 -4.952 1.00 13.88 C ATOM 1559 OG SER A 213 13.449 18.416 -5.602 1.00 15.54 O ATOM 0 H SER A 213 11.054 18.942 -7.067 1.00 10.88 H new ATOM 0 HA SER A 213 11.650 16.613 -5.959 1.00 10.90 H new ATOM 0 HB2 SER A 213 11.823 19.212 -4.832 1.00 13.88 H new ATOM 0 HB3 SER A 213 12.313 17.944 -4.067 1.00 13.88 H new ATOM 0 HG SER A 213 13.967 18.894 -5.145 1.00 15.54 H new ATOM 1560 N ILE A 214 9.791 15.930 -4.564 1.00 9.42 N ATOM 1561 CA ILE A 214 8.644 15.546 -3.749 1.00 11.05 C ATOM 1562 C ILE A 214 9.144 14.833 -2.500 1.00 9.83 C ATOM 1563 O ILE A 214 9.567 13.673 -2.556 1.00 9.68 O ATOM 1564 CB ILE A 214 7.649 14.657 -4.526 1.00 10.55 C ATOM 1565 CG1 ILE A 214 7.199 15.353 -5.815 1.00 13.50 C ATOM 1566 CG2 ILE A 214 6.440 14.331 -3.658 1.00 12.17 C ATOM 1567 CD1 ILE A 214 6.326 14.485 -6.710 1.00 14.88 C ATOM 0 H ILE A 214 10.318 15.282 -4.768 1.00 9.42 H new ATOM 0 HA ILE A 214 8.160 16.349 -3.500 1.00 11.05 H new ATOM 0 HB ILE A 214 8.098 13.830 -4.761 1.00 10.55 H new ATOM 0 HG12 ILE A 214 6.710 16.158 -5.584 1.00 13.50 H new ATOM 0 HG13 ILE A 214 7.983 15.630 -6.314 1.00 13.50 H new ATOM 0 HG21 ILE A 214 5.824 13.773 -4.158 1.00 12.17 H new ATOM 0 HG22 ILE A 214 6.731 13.859 -2.862 1.00 12.17 H new ATOM 0 HG23 ILE A 214 5.995 15.154 -3.401 1.00 12.17 H new ATOM 0 HD11 ILE A 214 6.078 14.985 -7.504 1.00 14.88 H new ATOM 0 HD12 ILE A 214 6.818 13.690 -6.969 1.00 14.88 H new ATOM 0 HD13 ILE A 214 5.525 14.226 -6.228 1.00 14.88 H new ATOM 1568 N ASP A 215 9.110 15.538 -1.381 1.00 9.90 N ATOM 1569 CA ASP A 215 9.563 14.999 -0.111 1.00 10.22 C ATOM 1570 C ASP A 215 8.477 14.104 0.466 1.00 9.82 C ATOM 1571 O ASP A 215 7.322 14.507 0.543 1.00 12.17 O ATOM 1572 CB ASP A 215 9.831 16.146 0.865 1.00 12.31 C ATOM 1573 CG ASP A 215 10.330 15.662 2.200 1.00 17.47 C ATOM 1574 OD1 ASP A 215 9.515 15.127 2.978 1.00 19.86 O ATOM 1575 OD2 ASP A 215 11.539 15.818 2.473 1.00 28.24 O ATOM 0 H ASP A 215 8.822 16.347 -1.337 1.00 9.90 H new ATOM 0 HA ASP A 215 10.377 14.489 -0.248 1.00 10.22 H new ATOM 0 HB2 ASP A 215 10.484 16.750 0.478 1.00 12.31 H new ATOM 0 HB3 ASP A 215 9.015 16.655 0.993 1.00 12.31 H new ATOM 1576 N GLY A 216 8.824 12.897 0.888 1.00 8.78 N ATOM 1577 CA GLY A 216 7.818 12.044 1.478 1.00 9.02 C ATOM 1578 C GLY A 216 8.439 10.902 2.235 1.00 8.55 C ATOM 1579 O GLY A 216 9.657 10.794 2.308 1.00 9.79 O ATOM 0 H GLY A 216 9.615 12.563 0.843 1.00 8.78 H new ATOM 0 HA2 GLY A 216 7.260 12.565 2.077 1.00 9.02 H new ATOM 0 HA3 GLY A 216 7.239 11.696 0.782 1.00 9.02 H new ATOM 1580 N ILE A 217 7.599 10.051 2.805 1.00 7.46 N ATOM 1581 CA ILE A 217 8.103 8.939 3.601 1.00 8.35 C ATOM 1582 C ILE A 217 7.801 7.590 2.957 1.00 8.59 C ATOM 1583 O ILE A 217 6.770 7.419 2.307 1.00 9.92 O ATOM 1584 CB ILE A 217 7.571 8.986 5.040 1.00 8.34 C ATOM 1585 CG1 ILE A 217 6.059 8.762 5.087 1.00 10.68 C ATOM 1586 CG2 ILE A 217 7.932 10.314 5.691 1.00 11.22 C ATOM 1587 CD1 ILE A 217 5.543 8.477 6.505 1.00 12.47 C ATOM 0 H ILE A 217 6.742 10.097 2.746 1.00 7.46 H new ATOM 0 HA ILE A 217 9.067 9.038 3.634 1.00 8.35 H new ATOM 0 HB ILE A 217 7.991 8.266 5.536 1.00 8.34 H new ATOM 0 HG12 ILE A 217 5.609 9.546 4.735 1.00 10.68 H new ATOM 0 HG13 ILE A 217 5.828 8.019 4.508 1.00 10.68 H new ATOM 0 HG21 ILE A 217 7.591 10.333 6.599 1.00 11.22 H new ATOM 0 HG22 ILE A 217 8.897 10.416 5.706 1.00 11.22 H new ATOM 0 HG23 ILE A 217 7.539 11.041 5.183 1.00 11.22 H new ATOM 0 HD11 ILE A 217 4.583 8.343 6.479 1.00 12.47 H new ATOM 0 HD12 ILE A 217 5.971 7.678 6.851 1.00 12.47 H new ATOM 0 HD13 ILE A 217 5.749 9.229 7.082 1.00 12.47 H new ATOM 1588 N ALA A 218 8.714 6.639 3.110 1.00 8.36 N ATOM 1589 CA ALA A 218 8.474 5.269 2.672 1.00 8.86 C ATOM 1590 C ALA A 218 7.776 4.539 3.810 1.00 9.50 C ATOM 1591 O ALA A 218 8.387 4.287 4.854 1.00 9.81 O ATOM 1592 CB ALA A 218 9.782 4.590 2.314 1.00 10.78 C ATOM 0 H ALA A 218 9.485 6.767 3.468 1.00 8.36 H new ATOM 0 HA ALA A 218 7.918 5.257 1.877 1.00 8.86 H new ATOM 0 HB1 ALA A 218 9.606 3.681 2.025 1.00 10.78 H new ATOM 0 HB2 ALA A 218 10.215 5.079 1.597 1.00 10.78 H new ATOM 0 HB3 ALA A 218 10.362 4.575 3.091 1.00 10.78 H new ATOM 1593 N ASP A 219 6.502 4.203 3.610 1.00 8.75 N ATOM 1594 CA ASP A 219 5.639 3.743 4.696 1.00 7.86 C ATOM 1595 C ASP A 219 4.863 2.472 4.343 1.00 8.41 C ATOM 1596 O ASP A 219 3.794 2.515 3.707 1.00 8.61 O ATOM 1597 CB ASP A 219 4.677 4.865 5.078 1.00 10.22 C ATOM 1598 CG ASP A 219 3.846 4.532 6.281 1.00 10.63 C ATOM 1599 OD1 ASP A 219 3.039 5.394 6.675 1.00 14.10 O ATOM 1600 OD2 ASP A 219 3.994 3.422 6.838 1.00 12.40 O ATOM 0 H ASP A 219 6.115 4.235 2.843 1.00 8.75 H new ATOM 0 HA ASP A 219 6.207 3.515 5.448 1.00 7.86 H new ATOM 0 HB2 ASP A 219 5.183 5.674 5.253 1.00 10.22 H new ATOM 0 HB3 ASP A 219 4.092 5.053 4.328 1.00 10.22 H new ATOM 1601 N THR A 220 5.391 1.329 4.753 1.00 8.44 N ATOM 1602 CA THR A 220 4.739 0.062 4.443 1.00 7.97 C ATOM 1603 C THR A 220 3.412 -0.104 5.165 1.00 8.47 C ATOM 1604 O THR A 220 2.608 -0.953 4.785 1.00 8.43 O ATOM 1605 CB THR A 220 5.618 -1.137 4.823 1.00 7.75 C ATOM 1606 OG1 THR A 220 5.961 -1.043 6.214 1.00 7.46 O ATOM 1607 CG2 THR A 220 6.893 -1.173 3.981 1.00 9.25 C ATOM 0 H THR A 220 6.118 1.262 5.207 1.00 8.44 H new ATOM 0 HA THR A 220 4.589 0.084 3.485 1.00 7.97 H new ATOM 0 HB THR A 220 5.122 -1.953 4.654 1.00 7.75 H new ATOM 0 HG1 THR A 220 5.510 -1.600 6.652 1.00 7.46 H new ATOM 0 HG21 THR A 220 7.430 -1.938 4.240 1.00 9.25 H new ATOM 0 HG22 THR A 220 6.659 -1.245 3.042 1.00 9.25 H new ATOM 0 HG23 THR A 220 7.400 -0.359 4.126 1.00 9.25 H new ATOM 1608 N GLY A 221 3.181 0.693 6.205 1.00 7.35 N ATOM 1609 CA GLY A 221 1.959 0.590 6.982 1.00 9.70 C ATOM 1610 C GLY A 221 0.805 1.444 6.489 1.00 8.40 C ATOM 1611 O GLY A 221 -0.262 1.451 7.098 1.00 10.28 O ATOM 0 H GLY A 221 3.725 1.302 6.475 1.00 7.35 H new ATOM 0 HA2 GLY A 221 1.675 -0.338 6.990 1.00 9.70 H new ATOM 0 HA3 GLY A 221 2.155 0.835 7.900 1.00 9.70 H new ATOM 1612 N THR A 222 1.017 2.174 5.400 1.00 7.94 N ATOM 1613 CA THR A 222 -0.049 2.949 4.783 1.00 7.65 C ATOM 1614 C THR A 222 -0.379 2.311 3.441 1.00 7.85 C ATOM 1615 O THR A 222 0.523 1.967 2.675 1.00 8.07 O ATOM 1616 CB THR A 222 0.398 4.393 4.584 1.00 8.36 C ATOM 1617 OG1 THR A 222 0.522 5.011 5.873 1.00 11.51 O ATOM 1618 CG2 THR A 222 -0.616 5.176 3.740 1.00 10.11 C ATOM 0 H THR A 222 1.777 2.233 5.001 1.00 7.94 H new ATOM 0 HA THR A 222 -0.834 2.953 5.353 1.00 7.65 H new ATOM 0 HB THR A 222 1.247 4.399 4.115 1.00 8.36 H new ATOM 0 HG1 THR A 222 1.332 5.163 6.034 1.00 11.51 H new ATOM 0 HG21 THR A 222 -0.308 6.089 3.629 1.00 10.11 H new ATOM 0 HG22 THR A 222 -0.705 4.757 2.870 1.00 10.11 H new ATOM 0 HG23 THR A 222 -1.477 5.178 4.187 1.00 10.11 H new ATOM 1619 N THR A 223 -1.668 2.128 3.171 1.00 7.78 N ATOM 1620 CA THR A 223 -2.097 1.419 1.966 1.00 7.53 C ATOM 1621 C THR A 223 -1.822 2.168 0.669 1.00 6.77 C ATOM 1622 O THR A 223 -1.325 1.585 -0.300 1.00 8.40 O ATOM 1623 CB THR A 223 -3.599 1.115 2.022 1.00 8.58 C ATOM 1624 OG1 THR A 223 -3.927 0.583 3.309 1.00 11.49 O ATOM 1625 CG2 THR A 223 -4.009 0.126 0.922 1.00 10.07 C ATOM 0 H THR A 223 -2.310 2.406 3.671 1.00 7.78 H new ATOM 0 HA THR A 223 -1.569 0.606 1.957 1.00 7.53 H new ATOM 0 HB THR A 223 -4.087 1.940 1.874 1.00 8.58 H new ATOM 0 HG1 THR A 223 -3.732 -0.234 3.333 1.00 11.49 H new ATOM 0 HG21 THR A 223 -4.962 -0.048 0.981 1.00 10.07 H new ATOM 0 HG22 THR A 223 -3.803 0.505 0.053 1.00 10.07 H new ATOM 0 HG23 THR A 223 -3.522 -0.705 1.036 1.00 10.07 H new ATOM 1626 N LEU A 224 -2.147 3.454 0.657 1.00 6.61 N ATOM 1627 CA LEU A 224 -2.189 4.220 -0.582 1.00 7.07 C ATOM 1628 C LEU A 224 -0.991 5.141 -0.782 1.00 7.13 C ATOM 1629 O LEU A 224 -0.123 5.278 0.086 1.00 7.75 O ATOM 1630 CB LEU A 224 -3.500 5.009 -0.668 1.00 8.74 C ATOM 1631 CG LEU A 224 -4.769 4.165 -0.498 1.00 7.95 C ATOM 1632 CD1 LEU A 224 -6.009 5.028 -0.700 1.00 10.01 C ATOM 1633 CD2 LEU A 224 -4.781 2.972 -1.453 1.00 9.91 C ATOM 0 H LEU A 224 -2.348 3.905 1.361 1.00 6.61 H new ATOM 0 HA LEU A 224 -2.145 3.574 -1.304 1.00 7.07 H new ATOM 0 HB2 LEU A 224 -3.492 5.700 0.013 1.00 8.74 H new ATOM 0 HB3 LEU A 224 -3.537 5.458 -1.527 1.00 8.74 H new ATOM 0 HG LEU A 224 -4.775 3.815 0.407 1.00 7.95 H new ATOM 0 HD11 LEU A 224 -6.804 4.483 -0.590 1.00 10.01 H new ATOM 0 HD12 LEU A 224 -6.015 5.744 -0.046 1.00 10.01 H new ATOM 0 HD13 LEU A 224 -5.998 5.407 -1.593 1.00 10.01 H new ATOM 0 HD21 LEU A 224 -5.594 2.460 -1.321 1.00 9.91 H new ATOM 0 HD22 LEU A 224 -4.745 3.290 -2.369 1.00 9.91 H new ATOM 0 HD23 LEU A 224 -4.012 2.408 -1.276 1.00 9.91 H new ATOM 1634 N LEU A 225 -0.939 5.751 -1.959 1.00 6.49 N ATOM 1635 CA LEU A 225 0.083 6.719 -2.321 1.00 7.66 C ATOM 1636 C LEU A 225 -0.528 8.109 -2.176 1.00 6.36 C ATOM 1637 O LEU A 225 -1.475 8.449 -2.899 1.00 7.49 O ATOM 1638 CB LEU A 225 0.525 6.468 -3.764 1.00 6.06 C ATOM 1639 CG LEU A 225 1.511 7.445 -4.409 1.00 5.90 C ATOM 1640 CD1 LEU A 225 2.726 7.673 -3.538 1.00 7.65 C ATOM 1641 CD2 LEU A 225 1.915 6.960 -5.802 1.00 7.21 C ATOM 0 H LEU A 225 -1.512 5.609 -2.584 1.00 6.49 H new ATOM 0 HA LEU A 225 0.862 6.641 -1.748 1.00 7.66 H new ATOM 0 HB2 LEU A 225 0.920 5.583 -3.801 1.00 6.06 H new ATOM 0 HB3 LEU A 225 -0.272 6.446 -4.317 1.00 6.06 H new ATOM 0 HG LEU A 225 1.061 8.300 -4.501 1.00 5.90 H new ATOM 0 HD11 LEU A 225 3.327 8.295 -3.977 1.00 7.65 H new ATOM 0 HD12 LEU A 225 2.448 8.040 -2.684 1.00 7.65 H new ATOM 0 HD13 LEU A 225 3.183 6.830 -3.393 1.00 7.65 H new ATOM 0 HD21 LEU A 225 2.539 7.590 -6.196 1.00 7.21 H new ATOM 0 HD22 LEU A 225 2.336 6.089 -5.732 1.00 7.21 H new ATOM 0 HD23 LEU A 225 1.126 6.893 -6.363 1.00 7.21 H new ATOM 1642 N TYR A 226 -0.006 8.903 -1.240 1.00 6.53 N ATOM 1643 CA TYR A 226 -0.517 10.244 -0.968 1.00 7.03 C ATOM 1644 C TYR A 226 0.491 11.281 -1.427 1.00 6.60 C ATOM 1645 O TYR A 226 1.622 11.322 -0.923 1.00 7.21 O ATOM 1646 CB TYR A 226 -0.812 10.422 0.525 1.00 7.84 C ATOM 1647 CG TYR A 226 -1.934 9.544 1.021 1.00 7.70 C ATOM 1648 CD1 TYR A 226 -3.253 9.981 0.972 1.00 8.31 C ATOM 1649 CD2 TYR A 226 -1.680 8.269 1.523 1.00 8.08 C ATOM 1650 CE1 TYR A 226 -4.282 9.180 1.413 1.00 8.49 C ATOM 1651 CE2 TYR A 226 -2.704 7.459 1.964 1.00 8.56 C ATOM 1652 CZ TYR A 226 -4.002 7.916 1.908 1.00 9.20 C ATOM 1653 OH TYR A 226 -5.001 7.084 2.358 1.00 10.09 O ATOM 0 H TYR A 226 0.658 8.676 -0.743 1.00 6.53 H new ATOM 0 HA TYR A 226 -1.346 10.363 -1.458 1.00 7.03 H new ATOM 0 HB2 TYR A 226 -0.009 10.227 1.032 1.00 7.84 H new ATOM 0 HB3 TYR A 226 -1.037 11.350 0.695 1.00 7.84 H new ATOM 0 HD1 TYR A 226 -3.443 10.827 0.636 1.00 8.31 H new ATOM 0 HD2 TYR A 226 -0.804 7.959 1.561 1.00 8.08 H new ATOM 0 HE1 TYR A 226 -5.160 9.485 1.379 1.00 8.49 H new ATOM 0 HE2 TYR A 226 -2.520 6.610 2.297 1.00 8.56 H new ATOM 0 HH TYR A 226 -5.745 7.371 2.095 1.00 10.09 H new ATOM 1654 N LEU A 227 0.087 12.119 -2.375 1.00 6.41 N ATOM 1655 CA LEU A 227 0.991 13.056 -3.036 1.00 6.49 C ATOM 1656 C LEU A 227 0.348 14.438 -3.111 1.00 6.77 C ATOM 1657 O LEU A 227 -0.842 14.577 -2.865 1.00 6.87 O ATOM 1658 CB LEU A 227 1.313 12.531 -4.429 1.00 7.30 C ATOM 1659 CG LEU A 227 2.172 11.271 -4.468 1.00 7.62 C ATOM 1660 CD1 LEU A 227 2.322 10.789 -5.905 1.00 10.45 C ATOM 1661 CD2 LEU A 227 3.530 11.543 -3.838 1.00 10.92 C ATOM 0 H LEU A 227 -0.725 12.161 -2.655 1.00 6.41 H new ATOM 0 HA LEU A 227 1.814 13.136 -2.529 1.00 6.49 H new ATOM 0 HB2 LEU A 227 0.480 12.351 -4.891 1.00 7.30 H new ATOM 0 HB3 LEU A 227 1.767 13.230 -4.925 1.00 7.30 H new ATOM 0 HG LEU A 227 1.737 10.571 -3.956 1.00 7.62 H new ATOM 0 HD11 LEU A 227 2.869 9.988 -5.922 1.00 10.45 H new ATOM 0 HD12 LEU A 227 1.447 10.590 -6.273 1.00 10.45 H new ATOM 0 HD13 LEU A 227 2.746 11.481 -6.436 1.00 10.45 H new ATOM 0 HD21 LEU A 227 4.068 10.736 -3.868 1.00 10.92 H new ATOM 0 HD22 LEU A 227 3.979 12.249 -4.329 1.00 10.92 H new ATOM 0 HD23 LEU A 227 3.410 11.817 -2.915 1.00 10.92 H new ATOM 1662 N PRO A 228 1.123 15.470 -3.471 1.00 6.99 N ATOM 1663 CA PRO A 228 0.537 16.814 -3.509 1.00 6.72 C ATOM 1664 C PRO A 228 -0.648 16.895 -4.470 1.00 6.75 C ATOM 1665 O PRO A 228 -0.711 16.174 -5.474 1.00 7.07 O ATOM 1666 CB PRO A 228 1.698 17.687 -3.996 1.00 8.23 C ATOM 1667 CG PRO A 228 2.941 16.946 -3.548 1.00 9.61 C ATOM 1668 CD PRO A 228 2.574 15.487 -3.730 1.00 9.05 C ATOM 0 HA PRO A 228 0.181 17.088 -2.649 1.00 6.72 H new ATOM 0 HB2 PRO A 228 1.679 17.795 -4.960 1.00 8.23 H new ATOM 0 HB3 PRO A 228 1.658 18.576 -3.610 1.00 8.23 H new ATOM 0 HG2 PRO A 228 3.713 17.189 -4.083 1.00 9.61 H new ATOM 0 HG3 PRO A 228 3.162 17.146 -2.625 1.00 9.61 H new ATOM 0 HD2 PRO A 228 2.782 15.174 -4.624 1.00 9.05 H new ATOM 0 HD3 PRO A 228 3.055 14.916 -3.111 1.00 9.05 H new ATOM 1669 N ALA A 229 -1.580 17.789 -4.157 1.00 7.10 N ATOM 1670 CA ALA A 229 -2.815 17.908 -4.917 1.00 7.18 C ATOM 1671 C ALA A 229 -2.585 18.163 -6.401 1.00 7.13 C ATOM 1672 O ALA A 229 -3.361 17.700 -7.240 1.00 7.53 O ATOM 1673 CB ALA A 229 -3.675 19.001 -4.329 1.00 8.00 C ATOM 0 H ALA A 229 -1.513 18.341 -3.501 1.00 7.10 H new ATOM 0 HA ALA A 229 -3.269 17.053 -4.851 1.00 7.18 H new ATOM 0 HB1 ALA A 229 -4.497 19.076 -4.839 1.00 8.00 H new ATOM 0 HB2 ALA A 229 -3.886 18.786 -3.407 1.00 8.00 H new ATOM 0 HB3 ALA A 229 -3.196 19.844 -4.363 1.00 8.00 H new ATOM 1674 N THR A 230 -1.537 18.907 -6.735 1.00 7.28 N ATOM 1675 CA THR A 230 -1.231 19.189 -8.137 1.00 7.62 C ATOM 1676 C THR A 230 -0.929 17.896 -8.895 1.00 7.21 C ATOM 1677 O THR A 230 -1.415 17.676 -10.012 1.00 8.18 O ATOM 1678 CB THR A 230 -0.013 20.102 -8.237 1.00 7.50 C ATOM 1679 OG1 THR A 230 1.008 19.592 -7.369 1.00 10.76 O ATOM 1680 CG2 THR A 230 -0.368 21.530 -7.820 1.00 10.58 C ATOM 0 H THR A 230 -0.992 19.258 -6.170 1.00 7.28 H new ATOM 0 HA THR A 230 -2.006 19.622 -8.528 1.00 7.62 H new ATOM 0 HB THR A 230 0.297 20.122 -9.156 1.00 7.50 H new ATOM 0 HG1 THR A 230 1.719 20.024 -7.488 1.00 10.76 H new ATOM 0 HG21 THR A 230 0.419 22.093 -7.891 1.00 10.58 H new ATOM 0 HG22 THR A 230 -1.064 21.874 -8.402 1.00 10.58 H new ATOM 0 HG23 THR A 230 -0.684 21.530 -6.903 1.00 10.58 H new ATOM 1681 N VAL A 231 -0.128 17.041 -8.270 1.00 7.49 N ATOM 1682 CA VAL A 231 0.296 15.781 -8.878 1.00 8.33 C ATOM 1683 C VAL A 231 -0.896 14.838 -9.039 1.00 7.13 C ATOM 1684 O VAL A 231 -1.094 14.206 -10.093 1.00 7.81 O ATOM 1685 CB VAL A 231 1.390 15.118 -8.013 1.00 6.99 C ATOM 1686 CG1 VAL A 231 1.799 13.785 -8.609 1.00 9.40 C ATOM 1687 CG2 VAL A 231 2.603 16.049 -7.873 1.00 10.24 C ATOM 0 H VAL A 231 0.186 17.173 -7.481 1.00 7.49 H new ATOM 0 HA VAL A 231 0.661 15.967 -9.757 1.00 8.33 H new ATOM 0 HB VAL A 231 1.029 14.957 -7.127 1.00 6.99 H new ATOM 0 HG11 VAL A 231 2.486 13.380 -8.056 1.00 9.40 H new ATOM 0 HG12 VAL A 231 1.028 13.198 -8.648 1.00 9.40 H new ATOM 0 HG13 VAL A 231 2.145 13.923 -9.505 1.00 9.40 H new ATOM 0 HG21 VAL A 231 3.280 15.619 -7.328 1.00 10.24 H new ATOM 0 HG22 VAL A 231 2.968 16.239 -8.751 1.00 10.24 H new ATOM 0 HG23 VAL A 231 2.328 16.878 -7.451 1.00 10.24 H new ATOM 1688 N VAL A 232 -1.704 14.762 -7.996 1.00 6.77 N ATOM 1689 CA VAL A 232 -2.854 13.871 -7.973 1.00 7.21 C ATOM 1690 C VAL A 232 -3.910 14.310 -9.000 1.00 7.15 C ATOM 1691 O VAL A 232 -4.517 13.480 -9.688 1.00 7.16 O ATOM 1692 CB VAL A 232 -3.415 13.778 -6.533 1.00 7.16 C ATOM 1693 CG1 VAL A 232 -4.686 12.940 -6.471 1.00 10.26 C ATOM 1694 CG2 VAL A 232 -2.348 13.212 -5.592 1.00 8.58 C ATOM 0 H VAL A 232 -1.603 15.226 -7.279 1.00 6.77 H new ATOM 0 HA VAL A 232 -2.578 12.979 -8.235 1.00 7.21 H new ATOM 0 HB VAL A 232 -3.650 14.674 -6.246 1.00 7.16 H new ATOM 0 HG11 VAL A 232 -5.006 12.905 -5.556 1.00 10.26 H new ATOM 0 HG12 VAL A 232 -5.365 13.340 -7.036 1.00 10.26 H new ATOM 0 HG13 VAL A 232 -4.496 12.041 -6.781 1.00 10.26 H new ATOM 0 HG21 VAL A 232 -2.706 13.157 -4.692 1.00 8.58 H new ATOM 0 HG22 VAL A 232 -2.089 12.327 -5.892 1.00 8.58 H new ATOM 0 HG23 VAL A 232 -1.572 13.794 -5.595 1.00 8.58 H new ATOM 1695 N SER A 233 -4.116 15.620 -9.121 1.00 6.51 N ATOM 1696 CA SER A 233 -5.041 16.147 -10.120 1.00 7.17 C ATOM 1697 C SER A 233 -4.563 15.793 -11.525 1.00 5.79 C ATOM 1698 O SER A 233 -5.366 15.399 -12.373 1.00 6.92 O ATOM 1699 CB SER A 233 -5.173 17.661 -9.949 1.00 6.53 C ATOM 1700 OG SER A 233 -6.109 18.190 -10.883 1.00 8.08 O ATOM 0 H SER A 233 -3.732 16.217 -8.636 1.00 6.51 H new ATOM 0 HA SER A 233 -5.914 15.744 -9.993 1.00 7.17 H new ATOM 0 HB2 SER A 233 -5.459 17.866 -9.045 1.00 6.53 H new ATOM 0 HB3 SER A 233 -4.309 18.083 -10.075 1.00 6.53 H new ATOM 0 HG SER A 233 -6.685 17.606 -11.063 1.00 8.08 H new ATOM 1701 N ALA A 234 -3.262 15.936 -11.773 1.00 6.81 N ATOM 1702 CA ALA A 234 -2.713 15.572 -13.078 1.00 7.56 C ATOM 1703 C ALA A 234 -2.920 14.098 -13.407 1.00 8.44 C ATOM 1704 O ALA A 234 -3.147 13.750 -14.558 1.00 8.75 O ATOM 1705 CB ALA A 234 -1.245 15.941 -13.168 1.00 7.70 C ATOM 0 H ALA A 234 -2.688 16.237 -11.208 1.00 6.81 H new ATOM 0 HA ALA A 234 -3.204 16.082 -13.741 1.00 7.56 H new ATOM 0 HB1 ALA A 234 -0.901 15.691 -14.040 1.00 7.70 H new ATOM 0 HB2 ALA A 234 -1.143 16.897 -13.042 1.00 7.70 H new ATOM 0 HB3 ALA A 234 -0.750 15.471 -12.479 1.00 7.70 H new ATOM 1706 N TYR A 235 -2.826 13.231 -12.404 1.00 7.45 N ATOM 1707 CA TYR A 235 -3.056 11.810 -12.638 1.00 6.12 C ATOM 1708 C TYR A 235 -4.520 11.536 -13.011 1.00 6.40 C ATOM 1709 O TYR A 235 -4.817 10.959 -14.068 1.00 6.84 O ATOM 1710 CB TYR A 235 -2.630 10.961 -11.419 1.00 6.30 C ATOM 1711 CG TYR A 235 -2.941 9.510 -11.666 1.00 5.89 C ATOM 1712 CD1 TYR A 235 -4.122 8.952 -11.212 1.00 6.34 C ATOM 1713 CD2 TYR A 235 -2.087 8.716 -12.429 1.00 6.80 C ATOM 1714 CE1 TYR A 235 -4.446 7.636 -11.488 1.00 5.89 C ATOM 1715 CE2 TYR A 235 -2.399 7.394 -12.705 1.00 6.92 C ATOM 1716 CZ TYR A 235 -3.584 6.866 -12.236 1.00 5.70 C ATOM 1717 OH TYR A 235 -3.910 5.554 -12.524 1.00 7.15 O ATOM 0 H TYR A 235 -2.633 13.440 -11.592 1.00 7.45 H new ATOM 0 HA TYR A 235 -2.502 11.548 -13.390 1.00 6.12 H new ATOM 0 HB2 TYR A 235 -1.681 11.072 -11.254 1.00 6.30 H new ATOM 0 HB3 TYR A 235 -3.094 11.268 -10.624 1.00 6.30 H new ATOM 0 HD1 TYR A 235 -4.709 9.471 -10.712 1.00 6.34 H new ATOM 0 HD2 TYR A 235 -1.296 9.078 -12.758 1.00 6.80 H new ATOM 0 HE1 TYR A 235 -5.241 7.273 -11.170 1.00 5.89 H new ATOM 0 HE2 TYR A 235 -1.815 6.868 -13.202 1.00 6.92 H new ATOM 0 HH TYR A 235 -3.360 5.244 -13.078 1.00 7.15 H new ATOM 1718 N TRP A 236 -5.437 11.982 -12.161 1.00 5.97 N ATOM 1719 CA TRP A 236 -6.851 11.656 -12.344 1.00 7.25 C ATOM 1720 C TRP A 236 -7.485 12.352 -13.547 1.00 6.77 C ATOM 1721 O TRP A 236 -8.475 11.868 -14.092 1.00 7.66 O ATOM 1722 CB TRP A 236 -7.650 11.870 -11.044 1.00 6.75 C ATOM 1723 CG TRP A 236 -7.270 10.829 -10.027 1.00 6.50 C ATOM 1724 CD1 TRP A 236 -6.549 11.027 -8.885 1.00 6.55 C ATOM 1725 CD2 TRP A 236 -7.528 9.420 -10.100 1.00 5.64 C ATOM 1726 NE1 TRP A 236 -6.361 9.835 -8.236 1.00 7.13 N ATOM 1727 CE2 TRP A 236 -6.947 8.829 -8.959 1.00 5.32 C ATOM 1728 CE3 TRP A 236 -8.199 8.604 -11.020 1.00 7.00 C ATOM 1729 CZ2 TRP A 236 -7.010 7.456 -8.711 1.00 6.54 C ATOM 1730 CZ3 TRP A 236 -8.265 7.241 -10.771 1.00 6.27 C ATOM 1731 CH2 TRP A 236 -7.680 6.682 -9.620 1.00 7.35 C ATOM 0 H TRP A 236 -5.266 12.472 -11.475 1.00 5.97 H new ATOM 0 HA TRP A 236 -6.889 10.710 -12.554 1.00 7.25 H new ATOM 0 HB2 TRP A 236 -7.475 12.756 -10.691 1.00 6.75 H new ATOM 0 HB3 TRP A 236 -8.601 11.820 -11.228 1.00 6.75 H new ATOM 0 HD1 TRP A 236 -6.232 11.850 -8.591 1.00 6.55 H new ATOM 0 HE1 TRP A 236 -5.941 9.734 -7.492 1.00 7.13 H new ATOM 0 HE3 TRP A 236 -8.591 8.968 -11.781 1.00 7.00 H new ATOM 0 HZ2 TRP A 236 -6.612 7.082 -7.958 1.00 6.54 H new ATOM 0 HZ3 TRP A 236 -8.704 6.687 -11.376 1.00 6.27 H new ATOM 0 HH2 TRP A 236 -7.750 5.766 -9.473 1.00 7.35 H new ATOM 1732 N ALA A 237 -6.877 13.443 -14.000 1.00 7.12 N ATOM 1733 CA ALA A 237 -7.353 14.106 -15.213 1.00 7.78 C ATOM 1734 C ALA A 237 -7.212 13.202 -16.431 1.00 8.61 C ATOM 1735 O ALA A 237 -7.846 13.453 -17.459 1.00 9.73 O ATOM 1736 CB ALA A 237 -6.603 15.391 -15.436 1.00 8.71 C ATOM 0 H ALA A 237 -6.196 13.813 -13.627 1.00 7.12 H new ATOM 0 HA ALA A 237 -8.295 14.304 -15.092 1.00 7.78 H new ATOM 0 HB1 ALA A 237 -6.928 15.820 -16.243 1.00 8.71 H new ATOM 0 HB2 ALA A 237 -6.740 15.981 -14.679 1.00 8.71 H new ATOM 0 HB3 ALA A 237 -5.656 15.201 -15.530 1.00 8.71 H new ATOM 1737 N GLN A 238 -6.382 12.166 -16.333 1.00 8.50 N ATOM 1738 CA GLN A 238 -6.204 11.236 -17.447 1.00 8.39 C ATOM 1739 C GLN A 238 -7.199 10.076 -17.425 1.00 11.84 C ATOM 1740 O GLN A 238 -7.136 9.178 -18.270 1.00 14.03 O ATOM 1741 CB GLN A 238 -4.762 10.728 -17.494 1.00 9.86 C ATOM 1742 CG GLN A 238 -3.757 11.837 -17.774 1.00 9.04 C ATOM 1743 CD GLN A 238 -4.088 12.618 -19.039 1.00 9.31 C ATOM 1744 OE1 GLN A 238 -4.330 12.034 -20.099 1.00 11.32 O ATOM 1745 NE2 GLN A 238 -4.118 13.939 -18.929 1.00 10.99 N ATOM 0 H GLN A 238 -5.915 11.984 -15.634 1.00 8.50 H new ATOM 0 HA GLN A 238 -6.389 11.732 -18.260 1.00 8.39 H new ATOM 0 HB2 GLN A 238 -4.544 10.305 -16.649 1.00 9.86 H new ATOM 0 HB3 GLN A 238 -4.685 10.046 -18.180 1.00 9.86 H new ATOM 0 HG2 GLN A 238 -3.732 12.445 -17.019 1.00 9.04 H new ATOM 0 HG3 GLN A 238 -2.870 11.453 -17.857 1.00 9.04 H new ATOM 0 HE21 GLN A 238 -3.944 14.312 -18.174 1.00 10.99 H new ATOM 0 HE22 GLN A 238 -4.312 14.423 -19.613 1.00 10.99 H new ATOM 1746 N VAL A 239 -8.132 10.104 -16.478 1.00 8.31 N ATOM 1747 CA VAL A 239 -9.113 9.039 -16.324 1.00 9.29 C ATOM 1748 C VAL A 239 -10.506 9.614 -16.524 1.00 8.28 C ATOM 1749 O VAL A 239 -10.985 10.407 -15.719 1.00 9.11 O ATOM 1750 CB VAL A 239 -9.015 8.384 -14.928 1.00 8.26 C ATOM 1751 CG1 VAL A 239 -10.072 7.289 -14.770 1.00 10.90 C ATOM 1752 CG2 VAL A 239 -7.622 7.809 -14.704 1.00 10.71 C ATOM 0 H VAL A 239 -8.213 10.742 -15.907 1.00 8.31 H new ATOM 0 HA VAL A 239 -8.934 8.355 -16.988 1.00 9.29 H new ATOM 0 HB VAL A 239 -9.179 9.068 -14.260 1.00 8.26 H new ATOM 0 HG11 VAL A 239 -9.995 6.890 -13.889 1.00 10.90 H new ATOM 0 HG12 VAL A 239 -10.956 7.675 -14.874 1.00 10.90 H new ATOM 0 HG13 VAL A 239 -9.936 6.607 -15.446 1.00 10.90 H new ATOM 0 HG21 VAL A 239 -7.577 7.402 -13.825 1.00 10.71 H new ATOM 0 HG22 VAL A 239 -7.436 7.139 -15.380 1.00 10.71 H new ATOM 0 HG23 VAL A 239 -6.965 8.520 -14.765 1.00 10.71 H new ATOM 1753 N SER A 240 -11.162 9.226 -17.612 1.00 10.25 N ATOM 1754 CA ASER A 240 -12.491 9.742 -17.922 0.61 11.29 C ATOM 1755 CA BSER A 240 -12.479 9.762 -17.918 0.39 11.30 C ATOM 1756 C SER A 240 -13.464 9.477 -16.791 1.00 9.70 C ATOM 1757 O SER A 240 -13.617 8.342 -16.360 1.00 10.47 O ATOM 1758 CB ASER A 240 -13.031 9.113 -19.209 0.61 14.62 C ATOM 1759 CB BSER A 240 -13.000 9.194 -19.240 0.39 14.59 C ATOM 1760 OG ASER A 240 -12.305 9.553 -20.339 0.61 17.78 O ATOM 1761 OG BSER A 240 -14.154 9.893 -19.666 0.39 17.04 O ATOM 0 H ASER A 240 -10.855 8.663 -18.185 0.61 10.25 H new ATOM 0 H BSER A 240 -10.863 8.656 -18.182 0.39 10.25 H new ATOM 0 HA ASER A 240 -12.405 10.701 -18.043 0.61 11.30 H new ATOM 0 HA BSER A 240 -12.394 10.724 -18.007 0.39 11.30 H new ATOM 0 HB2ASER A 240 -12.980 8.146 -19.145 0.61 14.59 H new ATOM 0 HB2BSER A 240 -12.310 9.257 -19.918 0.39 14.59 H new ATOM 0 HB3ASER A 240 -13.968 9.341 -19.315 0.61 14.59 H new ATOM 0 HB3BSER A 240 -13.208 8.253 -19.133 0.39 14.59 H new ATOM 0 HG ASER A 240 -11.835 8.922 -20.633 0.61 17.04 H new ATOM 0 HG BSER A 240 -14.425 9.570 -20.392 0.39 17.04 H new ATOM 1762 N GLY A 241 -14.120 10.528 -16.318 1.00 10.85 N ATOM 1763 CA GLY A 241 -15.118 10.386 -15.280 1.00 11.59 C ATOM 1764 C GLY A 241 -14.591 10.391 -13.852 1.00 9.18 C ATOM 1765 O GLY A 241 -15.378 10.335 -12.906 1.00 12.37 O ATOM 0 H GLY A 241 -13.998 11.335 -16.589 1.00 10.85 H new ATOM 0 HA2 GLY A 241 -15.761 11.106 -15.372 1.00 11.59 H new ATOM 0 HA3 GLY A 241 -15.598 9.556 -15.427 1.00 11.59 H new ATOM 1766 N ALA A 242 -13.272 10.469 -13.677 1.00 8.49 N ATOM 1767 CA ALA A 242 -12.712 10.512 -12.329 1.00 9.13 C ATOM 1768 C ALA A 242 -13.016 11.856 -11.690 1.00 10.42 C ATOM 1769 O ALA A 242 -13.042 12.881 -12.365 1.00 13.31 O ATOM 1770 CB ALA A 242 -11.216 10.271 -12.370 1.00 10.54 C ATOM 0 H ALA A 242 -12.694 10.498 -14.313 1.00 8.49 H new ATOM 0 HA ALA A 242 -13.118 9.811 -11.796 1.00 9.13 H new ATOM 0 HB1 ALA A 242 -10.858 10.302 -11.469 1.00 10.54 H new ATOM 0 HB2 ALA A 242 -11.039 9.400 -12.758 1.00 10.54 H new ATOM 0 HB3 ALA A 242 -10.792 10.957 -12.910 1.00 10.54 H new ATOM 1771 N LYS A 243 -13.237 11.855 -10.380 1.00 10.13 N ATOM 1772 CA LYS A 243 -13.532 13.096 -9.677 1.00 10.93 C ATOM 1773 C LYS A 243 -13.151 12.952 -8.222 1.00 9.65 C ATOM 1774 O LYS A 243 -13.108 11.845 -7.698 1.00 9.67 O ATOM 1775 CB LYS A 243 -15.006 13.439 -9.801 1.00 16.93 C ATOM 0 H LYS A 243 -13.221 11.153 -9.884 1.00 10.13 H new ATOM 0 HA LYS A 243 -13.017 13.816 -10.075 1.00 10.93 H new ATOM 1776 N SER A 244 -12.893 14.075 -7.562 1.00 10.57 N ATOM 1777 CA SER A 244 -12.701 14.050 -6.119 1.00 11.50 C ATOM 1778 C SER A 244 -14.045 14.189 -5.429 1.00 11.18 C ATOM 1779 O SER A 244 -14.781 15.145 -5.672 1.00 15.40 O ATOM 1780 CB SER A 244 -11.769 15.168 -5.669 1.00 13.38 C ATOM 1781 OG SER A 244 -11.548 15.073 -4.272 1.00 17.36 O ATOM 0 H SER A 244 -12.826 14.852 -7.925 1.00 10.57 H new ATOM 0 HA SER A 244 -12.293 13.204 -5.877 1.00 11.50 H new ATOM 0 HB2 SER A 244 -10.925 15.108 -6.144 1.00 13.38 H new ATOM 0 HB3 SER A 244 -12.156 16.031 -5.886 1.00 13.38 H new ATOM 0 HG SER A 244 -10.724 15.009 -4.122 1.00 17.36 H new ATOM 1782 N SER A 245 -14.358 13.222 -4.576 1.00 12.54 N ATOM 1783 CA SER A 245 -15.626 13.183 -3.871 1.00 13.23 C ATOM 1784 C SER A 245 -15.435 13.477 -2.390 1.00 14.18 C ATOM 1785 O SER A 245 -14.784 12.719 -1.675 1.00 15.34 O ATOM 1786 CB SER A 245 -16.268 11.810 -4.037 1.00 15.78 C ATOM 1787 OG SER A 245 -17.366 11.674 -3.156 1.00 17.24 O ATOM 0 H SER A 245 -13.834 12.566 -4.390 1.00 12.54 H new ATOM 0 HA SER A 245 -16.204 13.864 -4.250 1.00 13.23 H new ATOM 0 HB2 SER A 245 -16.564 11.693 -4.953 1.00 15.78 H new ATOM 0 HB3 SER A 245 -15.614 11.116 -3.859 1.00 15.78 H new ATOM 0 HG SER A 245 -17.993 11.276 -3.549 1.00 17.24 H new ATOM 1788 N SER A 246 -16.018 14.574 -1.923 1.00 21.49 N ATOM 1789 CA SER A 246 -15.949 14.911 -0.507 1.00 19.37 C ATOM 1790 C SER A 246 -16.701 13.886 0.346 1.00 19.83 C ATOM 1791 O SER A 246 -16.272 13.546 1.449 1.00 23.56 O ATOM 1792 CB SER A 246 -16.498 16.321 -0.260 1.00 23.86 C ATOM 1793 OG SER A 246 -17.784 16.483 -0.834 1.00 33.67 O ATOM 0 H SER A 246 -16.456 15.134 -2.406 1.00 21.49 H new ATOM 0 HA SER A 246 -15.016 14.891 -0.243 1.00 19.37 H new ATOM 0 HB2 SER A 246 -16.544 16.489 0.694 1.00 23.86 H new ATOM 0 HB3 SER A 246 -15.890 16.977 -0.635 1.00 23.86 H new ATOM 0 HG SER A 246 -18.038 15.753 -1.164 1.00 33.67 H new ATOM 1794 N SER A 247 -17.813 13.383 -0.179 1.00 18.09 N ATOM 1795 CA SER A 247 -18.636 12.435 0.561 1.00 19.37 C ATOM 1796 C SER A 247 -17.941 11.092 0.734 1.00 18.10 C ATOM 1797 O SER A 247 -18.097 10.433 1.759 1.00 20.29 O ATOM 1798 CB SER A 247 -19.997 12.249 -0.115 1.00 19.10 C ATOM 1799 OG SER A 247 -19.856 11.818 -1.455 1.00 24.27 O ATOM 0 H SER A 247 -18.108 13.578 -0.963 1.00 18.09 H new ATOM 0 HA SER A 247 -18.776 12.809 1.445 1.00 19.37 H new ATOM 0 HB2 SER A 247 -20.520 11.600 0.381 1.00 19.10 H new ATOM 0 HB3 SER A 247 -20.488 13.086 -0.093 1.00 19.10 H new ATOM 0 HG SER A 247 -19.047 11.855 -1.678 1.00 24.27 H new ATOM 1800 N VAL A 248 -17.178 10.681 -0.273 1.00 14.19 N ATOM 1801 CA VAL A 248 -16.460 9.418 -0.195 1.00 15.58 C ATOM 1802 C VAL A 248 -15.126 9.592 0.534 1.00 17.18 C ATOM 1803 O VAL A 248 -14.689 8.700 1.258 1.00 19.84 O ATOM 1804 CB VAL A 248 -16.258 8.799 -1.593 1.00 13.32 C ATOM 1805 CG1 VAL A 248 -15.450 7.520 -1.498 1.00 19.75 C ATOM 1806 CG2 VAL A 248 -17.614 8.535 -2.249 1.00 17.35 C ATOM 0 H VAL A 248 -17.064 11.117 -1.006 1.00 14.19 H new ATOM 0 HA VAL A 248 -17.002 8.800 0.320 1.00 15.58 H new ATOM 0 HB VAL A 248 -15.764 9.426 -2.144 1.00 13.32 H new ATOM 0 HG11 VAL A 248 -15.333 7.145 -2.385 1.00 19.75 H new ATOM 0 HG12 VAL A 248 -14.582 7.714 -1.112 1.00 19.75 H new ATOM 0 HG13 VAL A 248 -15.918 6.882 -0.937 1.00 19.75 H new ATOM 0 HG21 VAL A 248 -17.479 8.146 -3.127 1.00 17.35 H new ATOM 0 HG22 VAL A 248 -18.126 7.921 -1.699 1.00 17.35 H new ATOM 0 HG23 VAL A 248 -18.099 9.370 -2.337 1.00 17.35 H new ATOM 1807 N GLY A 249 -14.495 10.749 0.357 1.00 13.85 N ATOM 1808 CA GLY A 249 -13.234 11.034 1.018 1.00 17.71 C ATOM 1809 C GLY A 249 -12.012 10.927 0.123 1.00 15.67 C ATOM 1810 O GLY A 249 -10.913 10.642 0.598 1.00 15.75 O ATOM 0 H GLY A 249 -14.785 11.384 -0.146 1.00 13.85 H new ATOM 0 HA2 GLY A 249 -13.272 11.930 1.388 1.00 17.71 H new ATOM 0 HA3 GLY A 249 -13.128 10.423 1.764 1.00 17.71 H new ATOM 1811 N GLY A 250 -12.195 11.153 -1.173 1.00 10.67 N ATOM 1812 CA GLY A 250 -11.072 11.166 -2.091 1.00 11.10 C ATOM 1813 C GLY A 250 -11.505 10.991 -3.530 1.00 7.91 C ATOM 1814 O GLY A 250 -12.694 11.062 -3.869 1.00 8.53 O ATOM 0 H GLY A 250 -12.960 11.300 -1.537 1.00 10.67 H new ATOM 0 HA2 GLY A 250 -10.592 12.004 -1.999 1.00 11.10 H new ATOM 0 HA3 GLY A 250 -10.454 10.457 -1.853 1.00 11.10 H new ATOM 1815 N TYR A 251 -10.524 10.777 -4.388 1.00 7.16 N ATOM 1816 CA TYR A 251 -10.775 10.523 -5.798 1.00 6.99 C ATOM 1817 C TYR A 251 -11.401 9.164 -6.027 1.00 6.17 C ATOM 1818 O TYR A 251 -10.954 8.137 -5.491 1.00 7.05 O ATOM 1819 CB TYR A 251 -9.477 10.632 -6.601 1.00 7.70 C ATOM 1820 CG TYR A 251 -9.078 12.055 -6.917 1.00 7.56 C ATOM 1821 CD1 TYR A 251 -8.273 12.791 -6.046 1.00 9.11 C ATOM 1822 CD2 TYR A 251 -9.498 12.663 -8.089 1.00 8.95 C ATOM 1823 CE1 TYR A 251 -7.900 14.098 -6.349 1.00 9.66 C ATOM 1824 CE2 TYR A 251 -9.135 13.968 -8.397 1.00 10.24 C ATOM 1825 CZ TYR A 251 -8.338 14.672 -7.526 1.00 10.52 C ATOM 1826 OH TYR A 251 -7.977 15.966 -7.838 1.00 12.67 O ATOM 0 H TYR A 251 -9.692 10.774 -4.171 1.00 7.16 H new ATOM 0 HA TYR A 251 -11.403 11.197 -6.101 1.00 6.99 H new ATOM 0 HB2 TYR A 251 -8.761 10.206 -6.104 1.00 7.70 H new ATOM 0 HB3 TYR A 251 -9.577 10.140 -7.431 1.00 7.70 H new ATOM 0 HD1 TYR A 251 -7.982 12.403 -5.252 1.00 9.11 H new ATOM 0 HD2 TYR A 251 -10.034 12.188 -8.682 1.00 8.95 H new ATOM 0 HE1 TYR A 251 -7.361 14.580 -5.764 1.00 9.66 H new ATOM 0 HE2 TYR A 251 -9.429 14.362 -9.186 1.00 10.24 H new ATOM 0 HH TYR A 251 -7.816 16.022 -8.661 1.00 12.67 H new ATOM 1827 N VAL A 252 -12.455 9.189 -6.836 1.00 6.95 N ATOM 1828 CA VAL A 252 -13.142 7.987 -7.280 1.00 7.85 C ATOM 1829 C VAL A 252 -13.180 8.005 -8.794 1.00 7.26 C ATOM 1830 O VAL A 252 -12.987 9.049 -9.418 1.00 8.06 O ATOM 1831 CB VAL A 252 -14.562 7.904 -6.703 1.00 9.04 C ATOM 1832 CG1 VAL A 252 -14.494 7.796 -5.180 1.00 10.61 C ATOM 1833 CG2 VAL A 252 -15.379 9.107 -7.136 1.00 11.85 C ATOM 0 H VAL A 252 -12.794 9.916 -7.146 1.00 6.95 H new ATOM 0 HA VAL A 252 -12.665 7.204 -6.962 1.00 7.85 H new ATOM 0 HB VAL A 252 -15.003 7.111 -7.046 1.00 9.04 H new ATOM 0 HG11 VAL A 252 -15.393 7.744 -4.819 1.00 10.61 H new ATOM 0 HG12 VAL A 252 -14.000 6.998 -4.934 1.00 10.61 H new ATOM 0 HG13 VAL A 252 -14.046 8.577 -4.820 1.00 10.61 H new ATOM 0 HG21 VAL A 252 -16.273 9.042 -6.765 1.00 11.85 H new ATOM 0 HG22 VAL A 252 -14.955 9.919 -6.816 1.00 11.85 H new ATOM 0 HG23 VAL A 252 -15.432 9.131 -8.104 1.00 11.85 H new ATOM 1834 N PHE A 253 -13.391 6.839 -9.390 1.00 7.47 N ATOM 1835 CA PHE A 253 -13.366 6.735 -10.843 1.00 7.08 C ATOM 1836 C PHE A 253 -14.316 5.619 -11.276 1.00 8.02 C ATOM 1837 O PHE A 253 -14.638 4.733 -10.484 1.00 7.17 O ATOM 1838 CB PHE A 253 -11.936 6.474 -11.345 1.00 8.70 C ATOM 1839 CG PHE A 253 -11.399 5.138 -10.953 1.00 6.26 C ATOM 1840 CD1 PHE A 253 -10.792 4.945 -9.716 1.00 7.68 C ATOM 1841 CD2 PHE A 253 -11.507 4.056 -11.812 1.00 7.71 C ATOM 1842 CE1 PHE A 253 -10.312 3.706 -9.350 1.00 8.63 C ATOM 1843 CE2 PHE A 253 -11.030 2.812 -11.455 1.00 8.93 C ATOM 1844 CZ PHE A 253 -10.429 2.632 -10.227 1.00 8.70 C ATOM 0 H PHE A 253 -13.549 6.102 -8.976 1.00 7.47 H new ATOM 0 HA PHE A 253 -13.660 7.572 -11.235 1.00 7.08 H new ATOM 0 HB2 PHE A 253 -11.922 6.549 -12.312 1.00 8.70 H new ATOM 0 HB3 PHE A 253 -11.349 7.164 -10.999 1.00 8.70 H new ATOM 0 HD1 PHE A 253 -10.709 5.661 -9.129 1.00 7.68 H new ATOM 0 HD2 PHE A 253 -11.908 4.171 -12.643 1.00 7.71 H new ATOM 0 HE1 PHE A 253 -9.911 3.588 -8.519 1.00 8.63 H new ATOM 0 HE2 PHE A 253 -11.114 2.095 -12.042 1.00 8.93 H new ATOM 0 HZ PHE A 253 -10.103 1.795 -9.986 1.00 8.70 H new ATOM 1845 N PRO A 254 -14.770 5.650 -12.536 1.00 7.85 N ATOM 1846 CA PRO A 254 -15.673 4.591 -13.007 1.00 9.13 C ATOM 1847 C PRO A 254 -14.993 3.236 -12.966 1.00 7.81 C ATOM 1848 O PRO A 254 -13.880 3.087 -13.455 1.00 8.28 O ATOM 1849 CB PRO A 254 -15.930 4.983 -14.464 1.00 9.23 C ATOM 1850 CG PRO A 254 -15.648 6.448 -14.533 1.00 10.66 C ATOM 1851 CD PRO A 254 -14.528 6.678 -13.562 1.00 8.24 C ATOM 0 HA PRO A 254 -16.475 4.516 -12.466 1.00 9.13 H new ATOM 0 HB2 PRO A 254 -15.354 4.487 -15.067 1.00 9.23 H new ATOM 0 HB3 PRO A 254 -16.845 4.790 -14.722 1.00 9.23 H new ATOM 0 HG2 PRO A 254 -15.394 6.714 -15.431 1.00 10.66 H new ATOM 0 HG3 PRO A 254 -16.432 6.968 -14.294 1.00 10.66 H new ATOM 0 HD2 PRO A 254 -13.660 6.571 -13.982 1.00 8.24 H new ATOM 0 HD3 PRO A 254 -14.554 7.573 -13.188 1.00 8.24 H new ATOM 1852 N CYS A 255 -15.656 2.235 -12.402 1.00 7.37 N ATOM 1853 CA CYS A 255 -15.056 0.919 -12.322 1.00 10.85 C ATOM 1854 C CYS A 255 -14.737 0.345 -13.713 1.00 10.30 C ATOM 1855 O CYS A 255 -13.891 -0.543 -13.830 1.00 13.26 O ATOM 1856 CB CYS A 255 -15.933 -0.021 -11.489 1.00 10.64 C ATOM 1857 SG CYS A 255 -15.975 0.389 -9.712 1.00 12.03 S ATOM 0 H CYS A 255 -16.444 2.298 -12.064 1.00 7.37 H new ATOM 0 HA CYS A 255 -14.204 1.005 -11.867 1.00 10.85 H new ATOM 0 HB2 CYS A 255 -16.838 0.001 -11.838 1.00 10.64 H new ATOM 0 HB3 CYS A 255 -15.610 -0.929 -11.595 1.00 10.64 H new ATOM 1858 N SER A 256 -15.386 0.873 -14.753 1.00 9.27 N ATOM 1859 CA SER A 256 -15.134 0.448 -16.135 1.00 9.95 C ATOM 1860 C SER A 256 -13.846 1.008 -16.741 1.00 11.84 C ATOM 1861 O SER A 256 -13.483 0.650 -17.860 1.00 12.25 O ATOM 1862 CB SER A 256 -16.312 0.833 -17.037 1.00 10.06 C ATOM 1863 OG SER A 256 -16.536 2.233 -17.010 1.00 10.51 O ATOM 0 H SER A 256 -15.984 1.487 -14.679 1.00 9.27 H new ATOM 0 HA SER A 256 -15.030 -0.515 -16.089 1.00 9.95 H new ATOM 0 HB2 SER A 256 -16.134 0.548 -17.947 1.00 10.06 H new ATOM 0 HB3 SER A 256 -17.112 0.368 -16.746 1.00 10.06 H new ATOM 0 HG SER A 256 -17.195 2.402 -16.517 1.00 10.51 H new ATOM 1864 N ALA A 257 -13.155 1.884 -16.019 1.00 10.56 N ATOM 1865 CA ALA A 257 -11.947 2.520 -16.551 1.00 10.06 C ATOM 1866 C ALA A 257 -10.739 1.587 -16.620 1.00 13.22 C ATOM 1867 O ALA A 257 -10.593 0.673 -15.811 1.00 14.62 O ATOM 1868 CB ALA A 257 -11.587 3.738 -15.709 1.00 12.96 C ATOM 0 H ALA A 257 -13.365 2.125 -15.221 1.00 10.56 H new ATOM 0 HA ALA A 257 -12.159 2.777 -17.462 1.00 10.06 H new ATOM 0 HB1 ALA A 257 -10.787 4.154 -16.067 1.00 12.96 H new ATOM 0 HB2 ALA A 257 -12.319 4.374 -15.731 1.00 12.96 H new ATOM 0 HB3 ALA A 257 -11.426 3.462 -14.793 1.00 12.96 H new ATOM 1869 N THR A 258 -9.862 1.845 -17.582 1.00 13.44 N ATOM 1870 CA THR A 258 -8.524 1.268 -17.570 1.00 14.67 C ATOM 1871 C THR A 258 -7.582 2.367 -17.087 1.00 13.01 C ATOM 1872 O THR A 258 -7.459 3.401 -17.734 1.00 14.43 O ATOM 1873 CB THR A 258 -8.105 0.810 -18.978 1.00 15.29 C ATOM 1874 OG1 THR A 258 -9.056 -0.140 -19.471 1.00 19.92 O ATOM 1875 CG2 THR A 258 -6.723 0.171 -18.951 1.00 17.12 C ATOM 0 H THR A 258 -10.023 2.355 -18.255 1.00 13.44 H new ATOM 0 HA THR A 258 -8.497 0.489 -16.993 1.00 14.67 H new ATOM 0 HB THR A 258 -8.076 1.586 -19.559 1.00 15.29 H new ATOM 0 HG1 THR A 258 -9.579 0.240 -20.007 1.00 19.92 H new ATOM 0 HG21 THR A 258 -6.479 -0.110 -19.847 1.00 17.12 H new ATOM 0 HG22 THR A 258 -6.075 0.815 -18.627 1.00 17.12 H new ATOM 0 HG23 THR A 258 -6.734 -0.600 -18.362 1.00 17.12 H new ATOM 1876 N LEU A 259 -6.933 2.163 -15.942 1.00 9.79 N ATOM 1877 CA LEU A 259 -6.112 3.218 -15.337 1.00 9.12 C ATOM 1878 C LEU A 259 -4.728 3.307 -15.970 1.00 7.86 C ATOM 1879 O LEU A 259 -4.119 2.284 -16.294 1.00 8.25 O ATOM 1880 CB LEU A 259 -5.953 2.991 -13.828 1.00 8.96 C ATOM 1881 CG LEU A 259 -7.244 2.984 -13.013 1.00 7.69 C ATOM 1882 CD1 LEU A 259 -6.914 2.667 -11.562 1.00 10.22 C ATOM 1883 CD2 LEU A 259 -7.949 4.329 -13.107 1.00 9.72 C ATOM 0 H LEU A 259 -6.953 1.426 -15.500 1.00 9.79 H new ATOM 0 HA LEU A 259 -6.579 4.053 -15.498 1.00 9.12 H new ATOM 0 HB2 LEU A 259 -5.501 2.144 -13.692 1.00 8.96 H new ATOM 0 HB3 LEU A 259 -5.372 3.682 -13.474 1.00 8.96 H new ATOM 0 HG LEU A 259 -7.840 2.307 -13.369 1.00 7.69 H new ATOM 0 HD11 LEU A 259 -7.730 2.661 -11.038 1.00 10.22 H new ATOM 0 HD12 LEU A 259 -6.490 1.796 -11.509 1.00 10.22 H new ATOM 0 HD13 LEU A 259 -6.311 3.341 -11.212 1.00 10.22 H new ATOM 0 HD21 LEU A 259 -8.765 4.304 -12.584 1.00 9.72 H new ATOM 0 HD22 LEU A 259 -7.366 5.025 -12.764 1.00 9.72 H new ATOM 0 HD23 LEU A 259 -8.165 4.517 -14.034 1.00 9.72 H new ATOM 1884 N PRO A 260 -4.216 4.530 -16.123 1.00 8.02 N ATOM 1885 CA PRO A 260 -2.829 4.708 -16.564 1.00 7.76 C ATOM 1886 C PRO A 260 -1.845 4.382 -15.444 1.00 7.98 C ATOM 1887 O PRO A 260 -2.184 4.438 -14.261 1.00 7.70 O ATOM 1888 CB PRO A 260 -2.759 6.197 -16.910 1.00 9.52 C ATOM 1889 CG PRO A 260 -3.792 6.828 -16.045 1.00 10.57 C ATOM 1890 CD PRO A 260 -4.896 5.815 -15.880 1.00 8.69 C ATOM 0 HA PRO A 260 -2.596 4.125 -17.303 1.00 7.76 H new ATOM 0 HB2 PRO A 260 -1.878 6.560 -16.731 1.00 9.52 H new ATOM 0 HB3 PRO A 260 -2.943 6.351 -17.850 1.00 9.52 H new ATOM 0 HG2 PRO A 260 -3.418 7.073 -15.184 1.00 10.57 H new ATOM 0 HG3 PRO A 260 -4.129 7.642 -16.450 1.00 10.57 H new ATOM 0 HD2 PRO A 260 -5.286 5.852 -14.992 1.00 8.69 H new ATOM 0 HD3 PRO A 260 -5.616 5.964 -16.512 1.00 8.69 H new ATOM 1891 N SER A 261 -0.630 4.019 -15.824 1.00 6.89 N ATOM 1892 CA SER A 261 0.438 3.841 -14.859 1.00 6.55 C ATOM 1893 C SER A 261 0.837 5.184 -14.247 1.00 7.20 C ATOM 1894 O SER A 261 0.453 6.248 -14.731 1.00 7.38 O ATOM 1895 CB SER A 261 1.652 3.202 -15.540 1.00 8.12 C ATOM 1896 OG SER A 261 2.172 4.051 -16.556 1.00 9.11 O ATOM 0 H SER A 261 -0.404 3.870 -16.640 1.00 6.89 H new ATOM 0 HA SER A 261 0.122 3.258 -14.151 1.00 6.55 H new ATOM 0 HB2 SER A 261 2.340 3.023 -14.880 1.00 8.12 H new ATOM 0 HB3 SER A 261 1.399 2.348 -15.925 1.00 8.12 H new ATOM 0 HG SER A 261 2.648 3.600 -17.082 1.00 9.11 H new ATOM 1897 N PHE A 262 1.617 5.120 -13.174 1.00 6.88 N ATOM 1898 CA PHE A 262 2.199 6.298 -12.543 1.00 6.43 C ATOM 1899 C PHE A 262 3.665 6.001 -12.272 1.00 6.94 C ATOM 1900 O PHE A 262 3.985 4.987 -11.641 1.00 7.73 O ATOM 1901 CB PHE A 262 1.494 6.618 -11.222 1.00 7.42 C ATOM 1902 CG PHE A 262 1.976 7.887 -10.567 1.00 6.62 C ATOM 1903 CD1 PHE A 262 1.397 9.111 -10.884 1.00 8.05 C ATOM 1904 CD2 PHE A 262 3.002 7.863 -9.640 1.00 7.05 C ATOM 1905 CE1 PHE A 262 1.839 10.278 -10.288 1.00 7.97 C ATOM 1906 CE2 PHE A 262 3.446 9.034 -9.044 1.00 7.41 C ATOM 1907 CZ PHE A 262 2.856 10.238 -9.368 1.00 7.47 C ATOM 0 H PHE A 262 1.826 4.381 -12.787 1.00 6.88 H new ATOM 0 HA PHE A 262 2.098 7.064 -13.129 1.00 6.43 H new ATOM 0 HB2 PHE A 262 0.540 6.689 -11.383 1.00 7.42 H new ATOM 0 HB3 PHE A 262 1.623 5.878 -10.608 1.00 7.42 H new ATOM 0 HD1 PHE A 262 0.705 9.145 -11.504 1.00 8.05 H new ATOM 0 HD2 PHE A 262 3.399 7.053 -9.414 1.00 7.05 H new ATOM 0 HE1 PHE A 262 1.446 11.091 -10.511 1.00 7.97 H new ATOM 0 HE2 PHE A 262 4.141 9.007 -8.426 1.00 7.41 H new ATOM 0 HZ PHE A 262 3.148 11.023 -8.963 1.00 7.47 H new ATOM 1908 N THR A 263 4.542 6.882 -12.735 1.00 6.25 N ATOM 1909 CA THR A 263 5.975 6.712 -12.542 1.00 8.51 C ATOM 1910 C THR A 263 6.483 7.706 -11.513 1.00 7.53 C ATOM 1911 O THR A 263 6.106 8.882 -11.562 1.00 8.19 O ATOM 1912 CB THR A 263 6.721 6.967 -13.866 1.00 8.09 C ATOM 1913 OG1 THR A 263 6.286 6.027 -14.847 1.00 10.19 O ATOM 1914 CG2 THR A 263 8.218 6.826 -13.686 1.00 9.55 C ATOM 0 H THR A 263 4.325 7.592 -13.168 1.00 6.25 H new ATOM 0 HA THR A 263 6.135 5.805 -12.238 1.00 8.51 H new ATOM 0 HB THR A 263 6.524 7.873 -14.153 1.00 8.09 H new ATOM 0 HG1 THR A 263 6.637 6.212 -15.588 1.00 10.19 H new ATOM 0 HG21 THR A 263 8.663 6.991 -14.532 1.00 9.55 H new ATOM 0 HG22 THR A 263 8.527 7.468 -13.028 1.00 9.55 H new ATOM 0 HG23 THR A 263 8.424 5.928 -13.382 1.00 9.55 H new ATOM 1915 N PHE A 264 7.315 7.256 -10.571 1.00 8.12 N ATOM 1916 CA PHE A 264 8.015 8.185 -9.684 1.00 7.52 C ATOM 1917 C PHE A 264 9.529 8.061 -9.813 1.00 8.38 C ATOM 1918 O PHE A 264 10.060 6.991 -10.123 1.00 8.21 O ATOM 1919 CB PHE A 264 7.548 8.100 -8.222 1.00 8.15 C ATOM 1920 CG PHE A 264 7.827 6.789 -7.533 1.00 8.33 C ATOM 1921 CD1 PHE A 264 8.975 6.620 -6.770 1.00 9.29 C ATOM 1922 CD2 PHE A 264 6.901 5.757 -7.574 1.00 8.69 C ATOM 1923 CE1 PHE A 264 9.213 5.421 -6.097 1.00 8.92 C ATOM 1924 CE2 PHE A 264 7.132 4.560 -6.902 1.00 9.22 C ATOM 1925 CZ PHE A 264 8.289 4.395 -6.164 1.00 8.42 C ATOM 0 H PHE A 264 7.486 6.425 -10.431 1.00 8.12 H new ATOM 0 HA PHE A 264 7.772 9.075 -9.984 1.00 7.52 H new ATOM 0 HB2 PHE A 264 7.976 8.810 -7.719 1.00 8.15 H new ATOM 0 HB3 PHE A 264 6.593 8.267 -8.193 1.00 8.15 H new ATOM 0 HD1 PHE A 264 9.592 7.313 -6.707 1.00 9.29 H new ATOM 0 HD2 PHE A 264 6.114 5.866 -8.058 1.00 8.69 H new ATOM 0 HE1 PHE A 264 9.994 5.312 -5.603 1.00 8.92 H new ATOM 0 HE2 PHE A 264 6.508 3.872 -6.950 1.00 9.22 H new ATOM 0 HZ PHE A 264 8.445 3.596 -5.714 1.00 8.42 H new ATOM 1926 N GLY A 265 10.219 9.184 -9.631 1.00 7.43 N ATOM 1927 CA GLY A 265 11.664 9.199 -9.748 1.00 7.72 C ATOM 1928 C GLY A 265 12.390 8.905 -8.452 1.00 6.80 C ATOM 1929 O GLY A 265 12.009 9.359 -7.379 1.00 7.51 O ATOM 0 H GLY A 265 9.866 9.944 -9.440 1.00 7.43 H new ATOM 0 HA2 GLY A 265 11.932 8.546 -10.413 1.00 7.72 H new ATOM 0 HA3 GLY A 265 11.944 10.068 -10.075 1.00 7.72 H new ATOM 1930 N VAL A 266 13.470 8.138 -8.581 1.00 8.21 N ATOM 1931 CA VAL A 266 14.428 7.926 -7.502 1.00 8.63 C ATOM 1932 C VAL A 266 15.771 8.276 -8.109 1.00 8.65 C ATOM 1933 O VAL A 266 16.303 7.512 -8.904 1.00 9.61 O ATOM 1934 CB VAL A 266 14.424 6.470 -7.009 1.00 8.79 C ATOM 1935 CG1 VAL A 266 15.388 6.319 -5.852 1.00 9.68 C ATOM 1936 CG2 VAL A 266 13.012 6.044 -6.596 1.00 10.00 C ATOM 0 H VAL A 266 13.668 7.722 -9.307 1.00 8.21 H new ATOM 0 HA VAL A 266 14.213 8.466 -6.726 1.00 8.63 H new ATOM 0 HB VAL A 266 14.711 5.892 -7.733 1.00 8.79 H new ATOM 0 HG11 VAL A 266 15.383 5.399 -5.544 1.00 9.68 H new ATOM 0 HG12 VAL A 266 16.282 6.557 -6.143 1.00 9.68 H new ATOM 0 HG13 VAL A 266 15.118 6.904 -5.127 1.00 9.68 H new ATOM 0 HG21 VAL A 266 13.028 5.124 -6.288 1.00 10.00 H new ATOM 0 HG22 VAL A 266 12.697 6.618 -5.881 1.00 10.00 H new ATOM 0 HG23 VAL A 266 12.415 6.119 -7.357 1.00 10.00 H new ATOM 1937 N GLY A 267 16.296 9.450 -7.770 1.00 8.95 N ATOM 1938 CA GLY A 267 17.451 9.970 -8.482 1.00 11.15 C ATOM 1939 C GLY A 267 17.160 9.963 -9.974 1.00 10.77 C ATOM 1940 O GLY A 267 16.093 10.404 -10.412 1.00 10.03 O ATOM 0 H GLY A 267 16.001 9.953 -7.138 1.00 8.95 H new ATOM 0 HA2 GLY A 267 17.650 10.871 -8.184 1.00 11.15 H new ATOM 0 HA3 GLY A 267 18.233 9.429 -8.291 1.00 11.15 H new ATOM 1941 N SER A 268 18.091 9.445 -10.764 1.00 11.04 N ATOM 1942 CA SER A 268 17.893 9.347 -12.205 1.00 13.06 C ATOM 1943 C SER A 268 17.084 8.114 -12.618 1.00 10.46 C ATOM 1944 O SER A 268 16.762 7.940 -13.792 1.00 13.96 O ATOM 1945 CB SER A 268 19.243 9.357 -12.922 1.00 17.81 C ATOM 1946 OG SER A 268 20.015 8.238 -12.530 1.00 24.21 O ATOM 0 H SER A 268 18.847 9.143 -10.486 1.00 11.04 H new ATOM 0 HA SER A 268 17.373 10.122 -12.470 1.00 13.06 H new ATOM 0 HB2 SER A 268 19.106 9.343 -13.882 1.00 17.81 H new ATOM 0 HB3 SER A 268 19.720 10.176 -12.715 1.00 17.81 H new ATOM 0 HG SER A 268 19.634 7.843 -11.894 1.00 24.21 H new ATOM 1947 N ALA A 269 16.753 7.261 -11.655 1.00 10.54 N ATOM 1948 CA ALA A 269 15.982 6.055 -11.933 1.00 9.74 C ATOM 1949 C ALA A 269 14.476 6.302 -11.863 1.00 8.88 C ATOM 1950 O ALA A 269 14.021 7.334 -11.380 1.00 9.48 O ATOM 1951 CB ALA A 269 16.376 4.941 -10.978 1.00 12.82 C ATOM 0 H ALA A 269 16.967 7.363 -10.828 1.00 10.54 H new ATOM 0 HA ALA A 269 16.190 5.787 -12.842 1.00 9.74 H new ATOM 0 HB1 ALA A 269 15.855 4.147 -11.175 1.00 12.82 H new ATOM 0 HB2 ALA A 269 17.320 4.743 -11.083 1.00 12.82 H new ATOM 0 HB3 ALA A 269 16.205 5.221 -10.065 1.00 12.82 H new ATOM 1952 N ARG A 270 13.715 5.334 -12.351 1.00 9.21 N ATOM 1953 CA ARG A 270 12.273 5.476 -12.430 1.00 9.11 C ATOM 1954 C ARG A 270 11.614 4.186 -11.975 1.00 10.74 C ATOM 1955 O ARG A 270 12.034 3.095 -12.370 1.00 12.58 O ATOM 1956 CB ARG A 270 11.858 5.795 -13.866 1.00 10.98 C ATOM 1957 CG ARG A 270 12.598 6.969 -14.498 1.00 12.08 C ATOM 1958 CD ARG A 270 12.149 8.290 -13.906 1.00 11.33 C ATOM 1959 NE ARG A 270 12.809 9.436 -14.530 1.00 11.89 N ATOM 1960 CZ ARG A 270 13.736 10.184 -13.936 1.00 12.23 C ATOM 1961 NH1 ARG A 270 14.134 9.926 -12.703 1.00 11.60 N ATOM 1962 NH2 ARG A 270 14.269 11.211 -14.585 1.00 13.81 N ATOM 0 H ARG A 270 14.017 4.584 -12.643 1.00 9.21 H new ATOM 0 HA ARG A 270 11.989 6.203 -11.854 1.00 9.11 H new ATOM 0 HB2 ARG A 270 12.000 5.007 -14.413 1.00 10.98 H new ATOM 0 HB3 ARG A 270 10.906 5.983 -13.880 1.00 10.98 H new ATOM 0 HG2 ARG A 270 13.553 6.861 -14.365 1.00 12.08 H new ATOM 0 HG3 ARG A 270 12.444 6.973 -15.456 1.00 12.08 H new ATOM 0 HD2 ARG A 270 11.189 8.378 -14.010 1.00 11.33 H new ATOM 0 HD3 ARG A 270 12.333 8.294 -12.954 1.00 11.33 H new ATOM 0 HE ARG A 270 12.583 9.640 -15.334 1.00 11.89 H new ATOM 0 HH11 ARG A 270 13.793 9.265 -12.270 1.00 11.60 H new ATOM 0 HH12 ARG A 270 14.734 10.419 -12.333 1.00 11.60 H new ATOM 0 HH21 ARG A 270 14.015 11.392 -15.387 1.00 13.81 H new ATOM 0 HH22 ARG A 270 14.868 11.696 -14.204 1.00 13.81 H new ATOM 1963 N ILE A 271 10.588 4.315 -11.141 1.00 8.00 N ATOM 1964 CA ILE A 271 9.774 3.183 -10.720 1.00 7.62 C ATOM 1965 C ILE A 271 8.387 3.375 -11.312 1.00 7.89 C ATOM 1966 O ILE A 271 7.764 4.422 -11.125 1.00 8.46 O ATOM 1967 CB ILE A 271 9.681 3.082 -9.187 1.00 7.09 C ATOM 1968 CG1 ILE A 271 11.069 2.871 -8.562 1.00 9.04 C ATOM 1969 CG2 ILE A 271 8.723 1.975 -8.782 1.00 8.89 C ATOM 1970 CD1 ILE A 271 11.716 1.552 -8.936 1.00 11.37 C ATOM 0 H ILE A 271 10.344 5.067 -10.802 1.00 8.00 H new ATOM 0 HA ILE A 271 10.181 2.360 -11.032 1.00 7.62 H new ATOM 0 HB ILE A 271 9.332 3.921 -8.849 1.00 7.09 H new ATOM 0 HG12 ILE A 271 11.651 3.596 -8.837 1.00 9.04 H new ATOM 0 HG13 ILE A 271 10.990 2.920 -7.596 1.00 9.04 H new ATOM 0 HG21 ILE A 271 8.676 1.925 -7.814 1.00 8.89 H new ATOM 0 HG22 ILE A 271 7.841 2.164 -9.139 1.00 8.89 H new ATOM 0 HG23 ILE A 271 9.039 1.128 -9.134 1.00 8.89 H new ATOM 0 HD11 ILE A 271 12.585 1.485 -8.509 1.00 11.37 H new ATOM 0 HD12 ILE A 271 11.153 0.820 -8.639 1.00 11.37 H new ATOM 0 HD13 ILE A 271 11.825 1.506 -9.899 1.00 11.37 H new ATOM 1971 N VAL A 272 7.916 2.361 -12.025 1.00 6.19 N ATOM 1972 CA VAL A 272 6.617 2.423 -12.684 1.00 7.23 C ATOM 1973 C VAL A 272 5.580 1.614 -11.915 1.00 7.82 C ATOM 1974 O VAL A 272 5.733 0.408 -11.708 1.00 8.93 O ATOM 1975 CB VAL A 272 6.698 1.898 -14.131 1.00 8.33 C ATOM 1976 CG1 VAL A 272 5.317 1.974 -14.795 1.00 10.26 C ATOM 1977 CG2 VAL A 272 7.729 2.686 -14.929 1.00 11.01 C ATOM 0 H VAL A 272 8.337 1.620 -12.141 1.00 6.19 H new ATOM 0 HA VAL A 272 6.349 3.355 -12.702 1.00 7.23 H new ATOM 0 HB VAL A 272 6.980 0.970 -14.113 1.00 8.33 H new ATOM 0 HG11 VAL A 272 5.376 1.642 -15.705 1.00 10.26 H new ATOM 0 HG12 VAL A 272 4.687 1.433 -14.294 1.00 10.26 H new ATOM 0 HG13 VAL A 272 5.014 2.895 -14.807 1.00 10.26 H new ATOM 0 HG21 VAL A 272 7.767 2.343 -15.836 1.00 11.01 H new ATOM 0 HG22 VAL A 272 7.477 3.622 -14.948 1.00 11.01 H new ATOM 0 HG23 VAL A 272 8.600 2.594 -14.512 1.00 11.01 H new ATOM 1978 N ILE A 273 4.528 2.297 -11.473 1.00 6.53 N ATOM 1979 CA ILE A 273 3.394 1.652 -10.824 1.00 6.32 C ATOM 1980 C ILE A 273 2.332 1.361 -11.897 1.00 7.49 C ATOM 1981 O ILE A 273 1.766 2.292 -12.472 1.00 6.90 O ATOM 1982 CB ILE A 273 2.763 2.591 -9.768 1.00 6.55 C ATOM 1983 CG1 ILE A 273 3.805 3.071 -8.752 1.00 6.23 C ATOM 1984 CG2 ILE A 273 1.568 1.914 -9.092 1.00 8.53 C ATOM 1985 CD1 ILE A 273 3.263 4.158 -7.843 1.00 7.34 C ATOM 0 H ILE A 273 4.453 3.151 -11.542 1.00 6.53 H new ATOM 0 HA ILE A 273 3.696 0.840 -10.389 1.00 6.32 H new ATOM 0 HB ILE A 273 2.433 3.382 -10.222 1.00 6.55 H new ATOM 0 HG12 ILE A 273 4.100 2.319 -8.214 1.00 6.23 H new ATOM 0 HG13 ILE A 273 4.584 3.405 -9.224 1.00 6.23 H new ATOM 0 HG21 ILE A 273 1.185 2.515 -8.434 1.00 8.53 H new ATOM 0 HG22 ILE A 273 0.899 1.697 -9.760 1.00 8.53 H new ATOM 0 HG23 ILE A 273 1.862 1.100 -8.653 1.00 8.53 H new ATOM 0 HD11 ILE A 273 3.953 4.431 -7.218 1.00 7.34 H new ATOM 0 HD12 ILE A 273 2.990 4.921 -8.377 1.00 7.34 H new ATOM 0 HD13 ILE A 273 2.499 3.818 -7.352 1.00 7.34 H new ATOM 1986 N PRO A 274 2.068 0.079 -12.199 1.00 6.88 N ATOM 1987 CA PRO A 274 1.050 -0.206 -13.216 1.00 7.75 C ATOM 1988 C PRO A 274 -0.312 0.316 -12.806 1.00 7.72 C ATOM 1989 O PRO A 274 -0.621 0.397 -11.621 1.00 7.19 O ATOM 1990 CB PRO A 274 1.036 -1.738 -13.284 1.00 9.28 C ATOM 1991 CG PRO A 274 2.406 -2.157 -12.778 1.00 9.88 C ATOM 1992 CD PRO A 274 2.712 -1.145 -11.694 1.00 8.21 C ATOM 0 HA PRO A 274 1.248 0.219 -14.065 1.00 7.75 H new ATOM 0 HB2 PRO A 274 0.328 -2.109 -12.734 1.00 9.28 H new ATOM 0 HB3 PRO A 274 0.884 -2.049 -14.190 1.00 9.28 H new ATOM 0 HG2 PRO A 274 2.396 -3.062 -12.428 1.00 9.88 H new ATOM 0 HG3 PRO A 274 3.070 -2.134 -13.485 1.00 9.88 H new ATOM 0 HD2 PRO A 274 2.348 -1.415 -10.836 1.00 8.21 H new ATOM 0 HD3 PRO A 274 3.667 -1.025 -11.572 1.00 8.21 H new ATOM 1993 N GLY A 275 -1.135 0.652 -13.793 1.00 7.30 N ATOM 1994 CA GLY A 275 -2.447 1.192 -13.514 1.00 7.59 C ATOM 1995 C GLY A 275 -3.292 0.315 -12.609 1.00 8.17 C ATOM 1996 O GLY A 275 -4.005 0.818 -11.746 1.00 7.99 O ATOM 0 H GLY A 275 -0.948 0.573 -14.629 1.00 7.30 H new ATOM 0 HA2 GLY A 275 -2.347 2.065 -13.103 1.00 7.59 H new ATOM 0 HA3 GLY A 275 -2.917 1.325 -14.352 1.00 7.59 H new ATOM 1997 N ASP A 276 -3.220 -1.001 -12.764 1.00 7.59 N ATOM 1998 CA AASP A 276 -4.032 -1.904 -11.953 0.60 9.86 C ATOM 1999 CA BASP A 276 -4.096 -1.819 -11.941 0.40 9.83 C ATOM 2000 C ASP A 276 -3.744 -1.769 -10.450 1.00 7.88 C ATOM 2001 O ASP A 276 -4.603 -2.046 -9.613 1.00 9.01 O ATOM 2002 CB AASP A 276 -3.829 -3.362 -12.396 0.60 11.21 C ATOM 2003 CB BASP A 276 -4.271 -3.250 -12.483 0.40 11.42 C ATOM 2004 CG AASP A 276 -4.444 -3.666 -13.761 0.60 14.10 C ATOM 2005 CG BASP A 276 -2.978 -4.036 -12.533 0.40 11.68 C ATOM 2006 OD1AASP A 276 -5.195 -2.828 -14.309 0.60 14.23 O ATOM 2007 OD1BASP A 276 -1.913 -3.498 -12.171 0.40 14.01 O ATOM 2008 OD2AASP A 276 -4.179 -4.769 -14.282 0.60 21.21 O ATOM 2009 OD2BASP A 276 -3.035 -5.213 -12.951 0.40 18.07 O ATOM 0 H AASP A 276 -2.708 -1.393 -13.333 0.60 7.59 H new ATOM 0 H BASP A 276 -2.702 -1.421 -13.307 0.40 7.59 H new ATOM 0 HA AASP A 276 -4.957 -1.648 -12.095 0.60 9.83 H new ATOM 0 HA BASP A 276 -4.974 -1.411 -12.008 0.40 9.83 H new ATOM 0 HB2AASP A 276 -2.879 -3.556 -12.425 0.60 11.42 H new ATOM 0 HB2BASP A 276 -4.908 -3.724 -11.926 0.40 11.42 H new ATOM 0 HB3AASP A 276 -4.219 -3.953 -11.733 0.60 11.42 H new ATOM 0 HB3BASP A 276 -4.650 -3.207 -13.375 0.40 11.42 H new ATOM 2010 N TYR A 277 -2.515 -1.370 -10.108 1.00 7.24 N ATOM 2011 CA TYR A 277 -2.136 -1.222 -8.696 1.00 6.59 C ATOM 2012 C TYR A 277 -2.905 -0.078 -8.030 1.00 7.92 C ATOM 2013 O TYR A 277 -2.936 0.034 -6.807 1.00 8.42 O ATOM 2014 CB TYR A 277 -0.643 -0.918 -8.523 1.00 7.30 C ATOM 2015 CG TYR A 277 0.343 -2.022 -8.842 1.00 6.58 C ATOM 2016 CD1 TYR A 277 0.041 -3.041 -9.740 1.00 8.93 C ATOM 2017 CD2 TYR A 277 1.603 -2.020 -8.244 1.00 7.43 C ATOM 2018 CE1 TYR A 277 0.969 -4.025 -10.026 1.00 8.41 C ATOM 2019 CE2 TYR A 277 2.535 -3.000 -8.524 1.00 8.10 C ATOM 2020 CZ TYR A 277 2.212 -3.995 -9.415 1.00 8.06 C ATOM 2021 OH TYR A 277 3.142 -4.976 -9.695 1.00 10.56 O ATOM 0 H TYR A 277 -1.892 -1.182 -10.670 1.00 7.24 H new ATOM 0 HA TYR A 277 -2.351 -2.072 -8.281 1.00 6.59 H new ATOM 0 HB2 TYR A 277 -0.427 -0.155 -9.082 1.00 7.30 H new ATOM 0 HB3 TYR A 277 -0.499 -0.646 -7.603 1.00 7.30 H new ATOM 0 HD1 TYR A 277 -0.793 -3.060 -10.152 1.00 8.93 H new ATOM 0 HD2 TYR A 277 1.820 -1.344 -7.644 1.00 7.43 H new ATOM 0 HE1 TYR A 277 0.760 -4.704 -10.626 1.00 8.41 H new ATOM 0 HE2 TYR A 277 3.370 -2.987 -8.115 1.00 8.10 H new ATOM 0 HH TYR A 277 3.899 -4.730 -9.425 1.00 10.56 H new ATOM 2022 N ILE A 278 -3.480 0.796 -8.847 1.00 6.84 N ATOM 2023 CA ILE A 278 -4.115 2.012 -8.389 1.00 6.83 C ATOM 2024 C ILE A 278 -5.640 1.836 -8.233 1.00 6.57 C ATOM 2025 O ILE A 278 -6.337 2.745 -7.793 1.00 7.26 O ATOM 2026 CB ILE A 278 -3.699 3.156 -9.349 1.00 7.43 C ATOM 2027 CG1 ILE A 278 -2.177 3.328 -9.279 1.00 7.40 C ATOM 2028 CG2 ILE A 278 -4.374 4.476 -9.002 1.00 6.95 C ATOM 2029 CD1 ILE A 278 -1.575 4.074 -10.465 1.00 8.52 C ATOM 0 H ILE A 278 -3.510 0.692 -9.700 1.00 6.84 H new ATOM 0 HA ILE A 278 -3.815 2.244 -7.496 1.00 6.83 H new ATOM 0 HB ILE A 278 -3.981 2.914 -10.245 1.00 7.43 H new ATOM 0 HG12 ILE A 278 -1.953 3.803 -8.464 1.00 7.40 H new ATOM 0 HG13 ILE A 278 -1.765 2.452 -9.219 1.00 7.40 H new ATOM 0 HG21 ILE A 278 -4.086 5.161 -9.626 1.00 6.95 H new ATOM 0 HG22 ILE A 278 -5.337 4.372 -9.059 1.00 6.95 H new ATOM 0 HG23 ILE A 278 -4.130 4.737 -8.100 1.00 6.95 H new ATOM 0 HD11 ILE A 278 -0.614 4.143 -10.350 1.00 8.52 H new ATOM 0 HD12 ILE A 278 -1.768 3.591 -11.283 1.00 8.52 H new ATOM 0 HD13 ILE A 278 -1.959 4.963 -10.517 1.00 8.52 H new ATOM 2030 N ASP A 279 -6.142 0.640 -8.533 1.00 7.16 N ATOM 2031 CA ASP A 279 -7.570 0.329 -8.397 1.00 8.32 C ATOM 2032 C ASP A 279 -7.863 -0.314 -7.032 1.00 7.18 C ATOM 2033 O ASP A 279 -7.398 -1.422 -6.747 1.00 8.92 O ATOM 2034 CB ASP A 279 -7.983 -0.600 -9.551 1.00 9.98 C ATOM 2035 CG ASP A 279 -9.411 -1.115 -9.435 1.00 10.86 C ATOM 2036 OD1 ASP A 279 -9.722 -2.101 -10.138 1.00 21.96 O ATOM 2037 OD2 ASP A 279 -10.214 -0.564 -8.667 1.00 10.89 O ATOM 0 H ASP A 279 -5.667 -0.016 -8.821 1.00 7.16 H new ATOM 0 HA ASP A 279 -8.089 1.147 -8.443 1.00 8.32 H new ATOM 0 HB2 ASP A 279 -7.886 -0.124 -10.391 1.00 9.98 H new ATOM 0 HB3 ASP A 279 -7.376 -1.356 -9.581 1.00 9.98 H new ATOM 2038 N PHE A 280 -8.643 0.383 -6.200 1.00 7.18 N ATOM 2039 CA PHE A 280 -9.048 -0.162 -4.904 1.00 7.57 C ATOM 2040 C PHE A 280 -10.512 -0.561 -4.818 1.00 10.14 C ATOM 2041 O PHE A 280 -11.058 -0.756 -3.735 1.00 10.51 O ATOM 2042 CB PHE A 280 -8.548 0.708 -3.748 1.00 10.12 C ATOM 2043 CG PHE A 280 -7.117 0.453 -3.467 1.00 7.78 C ATOM 2044 CD1 PHE A 280 -6.144 0.948 -4.319 1.00 7.35 C ATOM 2045 CD2 PHE A 280 -6.735 -0.384 -2.427 1.00 9.68 C ATOM 2046 CE1 PHE A 280 -4.819 0.651 -4.116 1.00 8.87 C ATOM 2047 CE2 PHE A 280 -5.405 -0.682 -2.223 1.00 8.40 C ATOM 2048 CZ PHE A 280 -4.453 -0.160 -3.067 1.00 8.33 C ATOM 0 H PHE A 280 -8.946 1.170 -6.368 1.00 7.18 H new ATOM 0 HA PHE A 280 -8.596 -1.015 -4.811 1.00 7.57 H new ATOM 0 HB2 PHE A 280 -8.676 1.645 -3.966 1.00 10.12 H new ATOM 0 HB3 PHE A 280 -9.074 0.527 -2.953 1.00 10.12 H new ATOM 0 HD1 PHE A 280 -6.390 1.487 -5.036 1.00 7.35 H new ATOM 0 HD2 PHE A 280 -7.381 -0.746 -1.864 1.00 9.68 H new ATOM 0 HE1 PHE A 280 -4.171 0.997 -4.686 1.00 8.87 H new ATOM 0 HE2 PHE A 280 -5.153 -1.233 -1.518 1.00 8.40 H new ATOM 0 HZ PHE A 280 -3.555 -0.357 -2.927 1.00 8.33 H new ATOM 2049 N GLY A 281 -11.113 -0.729 -5.987 1.00 8.50 N ATOM 2050 CA GLY A 281 -12.389 -1.403 -6.086 1.00 8.96 C ATOM 2051 C GLY A 281 -13.571 -0.550 -5.685 1.00 7.31 C ATOM 2052 O GLY A 281 -13.430 0.621 -5.335 1.00 7.96 O ATOM 0 H GLY A 281 -10.793 -0.457 -6.737 1.00 8.50 H new ATOM 0 HA2 GLY A 281 -12.515 -1.704 -7.000 1.00 8.96 H new ATOM 0 HA3 GLY A 281 -12.370 -2.195 -5.527 1.00 8.96 H new ATOM 2053 N PRO A 282 -14.773 -1.143 -5.747 1.00 7.65 N ATOM 2054 CA PRO A 282 -16.003 -0.393 -5.481 1.00 7.86 C ATOM 2055 C PRO A 282 -15.990 0.307 -4.122 1.00 9.23 C ATOM 2056 O PRO A 282 -15.508 -0.247 -3.129 1.00 10.14 O ATOM 2057 CB PRO A 282 -17.081 -1.479 -5.541 1.00 9.39 C ATOM 2058 CG PRO A 282 -16.533 -2.448 -6.550 1.00 10.40 C ATOM 2059 CD PRO A 282 -15.054 -2.513 -6.218 1.00 10.07 C ATOM 0 HA PRO A 282 -16.139 0.330 -6.114 1.00 7.86 H new ATOM 0 HB2 PRO A 282 -17.216 -1.899 -4.677 1.00 9.39 H new ATOM 0 HB3 PRO A 282 -17.938 -1.119 -5.818 1.00 9.39 H new ATOM 0 HG2 PRO A 282 -16.954 -3.318 -6.474 1.00 10.40 H new ATOM 0 HG3 PRO A 282 -16.681 -2.140 -7.458 1.00 10.40 H new ATOM 0 HD2 PRO A 282 -14.866 -3.176 -5.535 1.00 10.07 H new ATOM 0 HD3 PRO A 282 -14.520 -2.745 -6.993 1.00 10.07 H new ATOM 2060 N ILE A 283 -16.535 1.516 -4.069 1.00 8.11 N ATOM 2061 CA ILE A 283 -16.537 2.298 -2.835 1.00 9.65 C ATOM 2062 C ILE A 283 -17.433 1.649 -1.787 1.00 12.91 C ATOM 2063 O ILE A 283 -17.204 1.791 -0.580 1.00 16.70 O ATOM 2064 CB ILE A 283 -16.958 3.755 -3.087 1.00 10.99 C ATOM 2065 CG1 ILE A 283 -18.356 3.831 -3.708 1.00 10.62 C ATOM 2066 CG2 ILE A 283 -15.940 4.456 -3.989 1.00 12.37 C ATOM 2067 CD1 ILE A 283 -18.881 5.249 -3.807 1.00 15.36 C ATOM 0 H ILE A 283 -16.911 1.905 -4.738 1.00 8.11 H new ATOM 0 HA ILE A 283 -15.628 2.312 -2.496 1.00 9.65 H new ATOM 0 HB ILE A 283 -16.985 4.209 -2.230 1.00 10.99 H new ATOM 0 HG12 ILE A 283 -18.333 3.437 -4.594 1.00 10.62 H new ATOM 0 HG13 ILE A 283 -18.970 3.300 -3.177 1.00 10.62 H new ATOM 0 HG21 ILE A 283 -16.218 5.373 -4.139 1.00 12.37 H new ATOM 0 HG22 ILE A 283 -15.069 4.448 -3.561 1.00 12.37 H new ATOM 0 HG23 ILE A 283 -15.886 3.991 -4.839 1.00 12.37 H new ATOM 0 HD11 ILE A 283 -19.765 5.240 -4.205 1.00 15.36 H new ATOM 0 HD12 ILE A 283 -18.930 5.639 -2.920 1.00 15.36 H new ATOM 0 HD13 ILE A 283 -18.284 5.778 -4.359 1.00 15.36 H new ATOM 2068 N SER A 284 -18.454 0.948 -2.263 1.00 9.41 N ATOM 2069 CA SER A 284 -19.333 0.141 -1.419 1.00 11.44 C ATOM 2070 C SER A 284 -19.726 -1.061 -2.236 1.00 9.85 C ATOM 2071 O SER A 284 -19.690 -1.022 -3.466 1.00 9.82 O ATOM 2072 CB SER A 284 -20.594 0.915 -1.024 1.00 12.54 C ATOM 2073 OG SER A 284 -20.301 1.987 -0.154 1.00 16.42 O ATOM 0 H SER A 284 -18.661 0.926 -3.097 1.00 9.41 H new ATOM 0 HA SER A 284 -18.874 -0.105 -0.600 1.00 11.44 H new ATOM 0 HB2 SER A 284 -21.028 1.256 -1.822 1.00 12.54 H new ATOM 0 HB3 SER A 284 -21.222 0.313 -0.595 1.00 12.54 H new ATOM 0 HG SER A 284 -19.472 2.027 -0.027 1.00 16.42 H new ATOM 2074 N THR A 285 -20.116 -2.142 -1.575 1.00 12.83 N ATOM 2075 CA THR A 285 -20.433 -3.362 -2.291 1.00 13.60 C ATOM 2076 C THR A 285 -21.441 -3.127 -3.427 1.00 10.66 C ATOM 2077 O THR A 285 -22.520 -2.563 -3.219 1.00 10.75 O ATOM 2078 CB THR A 285 -20.964 -4.433 -1.326 1.00 16.71 C ATOM 2079 OG1 THR A 285 -20.035 -4.592 -0.244 1.00 22.28 O ATOM 2080 CG2 THR A 285 -21.144 -5.744 -2.045 1.00 17.35 C ATOM 0 H THR A 285 -20.202 -2.188 -0.721 1.00 12.83 H new ATOM 0 HA THR A 285 -19.608 -3.675 -2.694 1.00 13.60 H new ATOM 0 HB THR A 285 -21.825 -4.153 -0.979 1.00 16.71 H new ATOM 0 HG1 THR A 285 -20.441 -4.874 0.435 1.00 22.28 H new ATOM 0 HG21 THR A 285 -21.479 -6.410 -1.425 1.00 17.35 H new ATOM 0 HG22 THR A 285 -21.777 -5.631 -2.771 1.00 17.35 H new ATOM 0 HG23 THR A 285 -20.291 -6.037 -2.403 1.00 17.35 H new ATOM 2081 N GLY A 286 -21.081 -3.551 -4.633 1.00 11.85 N ATOM 2082 CA GLY A 286 -21.959 -3.445 -5.783 1.00 11.63 C ATOM 2083 C GLY A 286 -21.949 -2.117 -6.533 1.00 9.43 C ATOM 2084 O GLY A 286 -22.589 -1.983 -7.567 1.00 10.01 O ATOM 0 H GLY A 286 -20.318 -3.909 -4.805 1.00 11.85 H new ATOM 0 HA2 GLY A 286 -21.724 -4.148 -6.409 1.00 11.63 H new ATOM 0 HA3 GLY A 286 -22.866 -3.619 -5.488 1.00 11.63 H new ATOM 2085 N SER A 287 -21.214 -1.135 -6.020 1.00 8.71 N ATOM 2086 CA SER A 287 -21.136 0.168 -6.668 1.00 6.80 C ATOM 2087 C SER A 287 -20.285 0.102 -7.925 1.00 6.53 C ATOM 2088 O SER A 287 -19.338 -0.679 -8.004 1.00 8.82 O ATOM 2089 CB SER A 287 -20.528 1.184 -5.707 1.00 7.85 C ATOM 2090 OG SER A 287 -20.419 2.453 -6.331 1.00 7.18 O ATOM 0 H SER A 287 -20.753 -1.204 -5.297 1.00 8.71 H new ATOM 0 HA SER A 287 -22.035 0.437 -6.914 1.00 6.80 H new ATOM 0 HB2 SER A 287 -21.078 1.255 -4.911 1.00 7.85 H new ATOM 0 HB3 SER A 287 -19.652 0.882 -5.420 1.00 7.85 H new ATOM 0 HG SER A 287 -21.097 2.915 -6.148 1.00 7.18 H new ATOM 2091 N SER A 288 -20.606 0.939 -8.902 1.00 7.76 N ATOM 2092 CA SER A 288 -19.772 1.083 -10.091 1.00 7.32 C ATOM 2093 C SER A 288 -18.791 2.243 -9.969 1.00 9.45 C ATOM 2094 O SER A 288 -18.121 2.585 -10.943 1.00 9.20 O ATOM 2095 CB SER A 288 -20.617 1.250 -11.350 1.00 10.29 C ATOM 2096 OG SER A 288 -21.248 2.511 -11.355 1.00 12.80 O ATOM 0 H SER A 288 -21.307 1.437 -8.897 1.00 7.76 H new ATOM 0 HA SER A 288 -19.260 0.262 -10.165 1.00 7.32 H new ATOM 0 HB2 SER A 288 -20.057 1.159 -12.137 1.00 10.29 H new ATOM 0 HB3 SER A 288 -21.285 0.548 -11.394 1.00 10.29 H new ATOM 0 HG SER A 288 -22.079 2.409 -11.426 1.00 12.80 H new ATOM 2097 N SER A 289 -18.738 2.866 -8.790 1.00 7.34 N ATOM 2098 CA ASER A 289 -17.721 3.869 -8.487 0.49 7.69 C ATOM 2099 CA BSER A 289 -17.711 3.858 -8.497 0.51 7.69 C ATOM 2100 C SER A 289 -16.603 3.187 -7.707 1.00 7.28 C ATOM 2101 O SER A 289 -16.866 2.509 -6.707 1.00 8.49 O ATOM 2102 CB ASER A 289 -18.329 5.007 -7.663 0.49 9.78 C ATOM 2103 CB BSER A 289 -18.298 5.013 -7.695 0.51 9.78 C ATOM 2104 OG ASER A 289 -17.379 6.026 -7.394 0.49 8.86 O ATOM 2105 OG BSER A 289 -19.231 5.729 -8.476 0.51 12.67 O ATOM 0 H ASER A 289 -19.290 2.718 -8.147 0.49 7.34 H new ATOM 0 H BSER A 289 -19.291 2.725 -8.147 0.51 7.34 H new ATOM 0 HA ASER A 289 -17.370 4.250 -9.307 0.49 7.69 H new ATOM 0 HA BSER A 289 -17.358 4.216 -9.327 0.51 7.69 H new ATOM 0 HB2ASER A 289 -19.083 5.386 -8.141 0.49 9.78 H new ATOM 0 HB2BSER A 289 -18.730 4.673 -6.896 0.51 9.78 H new ATOM 0 HB3ASER A 289 -18.671 4.654 -6.827 0.49 9.78 H new ATOM 0 HB3BSER A 289 -17.588 5.606 -7.404 0.51 9.78 H new ATOM 0 HG ASER A 289 -17.150 6.393 -8.114 0.49 12.67 H new ATOM 0 HG BSER A 289 -19.391 6.469 -8.113 0.51 12.67 H new ATOM 2106 N CYS A 290 -15.369 3.361 -8.165 1.00 7.07 N ATOM 2107 CA CYS A 290 -14.210 2.724 -7.551 1.00 7.26 C ATOM 2108 C CYS A 290 -13.293 3.739 -6.885 1.00 7.87 C ATOM 2109 O CYS A 290 -13.203 4.887 -7.315 1.00 8.24 O ATOM 2110 CB CYS A 290 -13.423 1.947 -8.608 1.00 7.97 C ATOM 2111 SG CYS A 290 -14.075 0.293 -8.986 1.00 10.90 S ATOM 0 H CYS A 290 -15.179 3.854 -8.844 1.00 7.07 H new ATOM 0 HA CYS A 290 -14.537 2.119 -6.867 1.00 7.26 H new ATOM 0 HB2 CYS A 290 -13.405 2.468 -9.426 1.00 7.97 H new ATOM 0 HB3 CYS A 290 -12.505 1.858 -8.308 1.00 7.97 H new ATOM 2112 N PHE A 291 -12.602 3.304 -5.837 1.00 7.56 N ATOM 2113 CA PHE A 291 -11.751 4.208 -5.072 1.00 7.58 C ATOM 2114 C PHE A 291 -10.334 4.198 -5.615 1.00 6.34 C ATOM 2115 O PHE A 291 -9.770 3.139 -5.863 1.00 7.25 O ATOM 2116 CB PHE A 291 -11.747 3.832 -3.588 1.00 9.37 C ATOM 2117 CG PHE A 291 -11.232 4.932 -2.696 1.00 8.56 C ATOM 2118 CD1 PHE A 291 -11.972 6.085 -2.512 1.00 11.26 C ATOM 2119 CD2 PHE A 291 -9.997 4.825 -2.063 1.00 10.12 C ATOM 2120 CE1 PHE A 291 -11.507 7.110 -1.704 1.00 12.03 C ATOM 2121 CE2 PHE A 291 -9.532 5.846 -1.247 1.00 12.27 C ATOM 2122 CZ PHE A 291 -10.283 6.987 -1.073 1.00 11.59 C ATOM 0 H PHE A 291 -12.612 2.492 -5.553 1.00 7.56 H new ATOM 0 HA PHE A 291 -12.113 5.103 -5.161 1.00 7.58 H new ATOM 0 HB2 PHE A 291 -12.649 3.600 -3.317 1.00 9.37 H new ATOM 0 HB3 PHE A 291 -11.201 3.040 -3.463 1.00 9.37 H new ATOM 0 HD1 PHE A 291 -12.794 6.174 -2.937 1.00 11.26 H new ATOM 0 HD2 PHE A 291 -9.479 4.063 -2.188 1.00 10.12 H new ATOM 0 HE1 PHE A 291 -12.017 7.879 -1.586 1.00 12.03 H new ATOM 0 HE2 PHE A 291 -8.712 5.760 -0.817 1.00 12.27 H new ATOM 0 HZ PHE A 291 -9.967 7.674 -0.532 1.00 11.59 H new ATOM 2123 N GLY A 292 -9.757 5.384 -5.781 1.00 6.33 N ATOM 2124 CA GLY A 292 -8.416 5.493 -6.328 1.00 7.47 C ATOM 2125 C GLY A 292 -7.290 5.219 -5.347 1.00 6.33 C ATOM 2126 O GLY A 292 -7.387 5.502 -4.152 1.00 7.28 O ATOM 0 H GLY A 292 -10.127 6.135 -5.583 1.00 6.33 H new ATOM 0 HA2 GLY A 292 -8.335 4.875 -7.071 1.00 7.47 H new ATOM 0 HA3 GLY A 292 -8.301 6.386 -6.688 1.00 7.47 H new ATOM 2127 N GLY A 293 -6.197 4.681 -5.865 1.00 6.50 N ATOM 2128 CA GLY A 293 -5.056 4.360 -5.022 1.00 7.36 C ATOM 2129 C GLY A 293 -4.025 5.467 -4.884 1.00 5.85 C ATOM 2130 O GLY A 293 -3.047 5.317 -4.136 1.00 6.71 O ATOM 0 H GLY A 293 -6.095 4.494 -6.698 1.00 6.50 H new ATOM 0 HA2 GLY A 293 -5.380 4.127 -4.138 1.00 7.36 H new ATOM 0 HA3 GLY A 293 -4.618 3.572 -5.380 1.00 7.36 H new ATOM 2131 N ILE A 294 -4.232 6.555 -5.623 1.00 6.57 N ATOM 2132 CA ILE A 294 -3.426 7.764 -5.518 1.00 6.77 C ATOM 2133 C ILE A 294 -4.351 8.858 -5.020 1.00 6.06 C ATOM 2134 O ILE A 294 -5.399 9.113 -5.623 1.00 6.86 O ATOM 2135 CB ILE A 294 -2.811 8.155 -6.873 1.00 6.57 C ATOM 2136 CG1 ILE A 294 -1.812 7.084 -7.314 1.00 6.84 C ATOM 2137 CG2 ILE A 294 -2.125 9.503 -6.779 1.00 9.82 C ATOM 2138 CD1 ILE A 294 -1.160 7.340 -8.669 1.00 9.47 C ATOM 0 H ILE A 294 -4.858 6.610 -6.210 1.00 6.57 H new ATOM 0 HA ILE A 294 -2.683 7.622 -4.910 1.00 6.77 H new ATOM 0 HB ILE A 294 -3.521 8.220 -7.531 1.00 6.57 H new ATOM 0 HG12 ILE A 294 -1.116 7.012 -6.642 1.00 6.84 H new ATOM 0 HG13 ILE A 294 -2.267 6.228 -7.344 1.00 6.84 H new ATOM 0 HG21 ILE A 294 -1.744 9.733 -7.641 1.00 9.82 H new ATOM 0 HG22 ILE A 294 -2.772 10.178 -6.521 1.00 9.82 H new ATOM 0 HG23 ILE A 294 -1.420 9.462 -6.114 1.00 9.82 H new ATOM 0 HD11 ILE A 294 -0.544 6.619 -8.873 1.00 9.47 H new ATOM 0 HD12 ILE A 294 -1.845 7.384 -9.355 1.00 9.47 H new ATOM 0 HD13 ILE A 294 -0.676 8.180 -8.642 1.00 9.47 H new ATOM 2139 N GLN A 295 -3.995 9.468 -3.895 1.00 6.10 N ATOM 2140 CA GLN A 295 -4.858 10.435 -3.224 1.00 6.26 C ATOM 2141 C GLN A 295 -4.031 11.631 -2.786 1.00 6.12 C ATOM 2142 O GLN A 295 -2.806 11.546 -2.679 1.00 6.38 O ATOM 2143 CB GLN A 295 -5.543 9.784 -2.014 1.00 6.86 C ATOM 2144 CG GLN A 295 -6.497 8.628 -2.365 1.00 7.13 C ATOM 2145 CD GLN A 295 -7.730 9.068 -3.149 1.00 7.46 C ATOM 2146 OE1 GLN A 295 -8.040 10.253 -3.231 1.00 7.51 O ATOM 2147 NE2 GLN A 295 -8.449 8.097 -3.718 1.00 7.55 N ATOM 0 H GLN A 295 -3.244 9.333 -3.498 1.00 6.10 H new ATOM 0 HA GLN A 295 -5.546 10.733 -3.839 1.00 6.26 H new ATOM 0 HB2 GLN A 295 -4.860 9.453 -1.410 1.00 6.86 H new ATOM 0 HB3 GLN A 295 -6.041 10.464 -1.534 1.00 6.86 H new ATOM 0 HG2 GLN A 295 -6.013 7.966 -2.883 1.00 7.13 H new ATOM 0 HG3 GLN A 295 -6.782 8.194 -1.546 1.00 7.13 H new ATOM 0 HE21 GLN A 295 -8.202 7.277 -3.640 1.00 7.55 H new ATOM 0 HE22 GLN A 295 -9.159 8.292 -4.162 1.00 7.55 H new ATOM 2148 N SER A 296 -4.700 12.747 -2.537 1.00 6.37 N ATOM 2149 CA SER A 296 -4.014 13.949 -2.114 1.00 6.72 C ATOM 2150 C SER A 296 -3.531 13.868 -0.677 1.00 7.15 C ATOM 2151 O SER A 296 -4.229 13.360 0.204 1.00 8.09 O ATOM 2152 CB SER A 296 -4.965 15.124 -2.244 1.00 9.13 C ATOM 2153 OG SER A 296 -4.336 16.309 -1.798 1.00 9.47 O ATOM 0 H SER A 296 -5.553 12.826 -2.608 1.00 6.37 H new ATOM 0 HA SER A 296 -3.234 14.058 -2.680 1.00 6.72 H new ATOM 0 HB2 SER A 296 -5.242 15.224 -3.168 1.00 9.13 H new ATOM 0 HB3 SER A 296 -5.767 14.959 -1.724 1.00 9.13 H new ATOM 0 HG SER A 296 -4.895 16.936 -1.786 1.00 9.47 H new ATOM 2154 N SER A 297 -2.326 14.380 -0.450 1.00 7.45 N ATOM 2155 CA SER A 297 -1.768 14.488 0.889 1.00 8.17 C ATOM 2156 C SER A 297 -2.099 15.830 1.534 1.00 12.00 C ATOM 2157 O SER A 297 -1.650 16.103 2.649 1.00 12.06 O ATOM 2158 CB SER A 297 -0.250 14.357 0.819 1.00 9.82 C ATOM 2159 OG SER A 297 0.274 15.420 0.040 1.00 9.26 O ATOM 0 H SER A 297 -1.809 14.675 -1.071 1.00 7.45 H new ATOM 0 HA SER A 297 -2.157 13.779 1.425 1.00 8.17 H new ATOM 0 HB2 SER A 297 0.129 14.378 1.712 1.00 9.82 H new ATOM 0 HB3 SER A 297 -0.006 13.504 0.428 1.00 9.82 H new ATOM 0 HG SER A 297 1.108 15.337 -0.023 1.00 9.26 H new ATOM 2160 N AALA A 298 -2.903 16.646 0.853 0.47 9.51 N ATOM 2161 N BALA A 298 -2.839 16.681 0.827 0.53 9.52 N ATOM 2162 CA AALA A 298 -3.205 18.006 1.304 0.47 11.34 C ATOM 2163 CA BALA A 298 -3.191 17.982 1.374 0.53 11.34 C ATOM 2164 C AALA A 298 -3.531 18.121 2.794 0.47 14.00 C ATOM 2165 C BALA A 298 -4.023 17.767 2.630 0.53 12.86 C ATOM 2166 O AALA A 298 -3.063 19.040 3.466 0.47 14.65 O ATOM 2167 O BALA A 298 -5.078 17.139 2.589 0.53 16.38 O ATOM 2168 CB AALA A 298 -4.334 18.598 0.470 0.47 11.12 C ATOM 2169 CB BALA A 298 -3.945 18.813 0.349 0.53 9.81 C ATOM 0 H AALA A 298 -3.289 16.427 0.116 0.47 9.52 H new ATOM 0 H BALA A 298 -3.143 16.524 0.038 0.53 9.52 H new ATOM 0 HA AALA A 298 -2.389 18.514 1.174 0.47 11.34 H new ATOM 0 HA BALA A 298 -2.386 18.473 1.600 0.53 11.34 H new ATOM 0 HB1AALA A 298 -4.526 19.498 0.777 0.47 9.81 H new ATOM 0 HB1BALA A 298 -4.170 19.675 0.733 0.53 9.81 H new ATOM 0 HB2AALA A 298 -4.068 18.625 -0.462 0.47 9.81 H new ATOM 0 HB2BALA A 298 -3.388 18.944 -0.434 0.53 9.81 H new ATOM 0 HB3AALA A 298 -5.128 18.049 0.564 0.47 9.81 H new ATOM 0 HB3BALA A 298 -4.759 18.351 0.093 0.53 9.81 H new ATOM 2170 N AGLY A 299 -4.339 17.200 3.307 0.47 12.51 N ATOM 2171 N BGLY A 299 -3.530 18.273 3.753 0.53 15.28 N ATOM 2172 CA AGLY A 299 -4.781 17.284 4.688 0.47 18.33 C ATOM 2173 CA BGLY A 299 -4.196 18.074 5.023 0.53 18.52 C ATOM 2174 C AGLY A 299 -3.952 16.468 5.663 0.47 19.49 C ATOM 2175 C BGLY A 299 -3.439 17.099 5.903 0.53 20.67 C ATOM 2176 O AGLY A 299 -4.423 16.132 6.751 0.47 24.71 O ATOM 2177 O BGLY A 299 -3.518 17.182 7.128 0.53 22.28 O ATOM 0 H AGLY A 299 -4.640 16.522 2.872 0.47 15.28 H new ATOM 0 H BGLY A 299 -2.807 18.736 3.797 0.53 15.28 H new ATOM 0 HA2AGLY A 299 -4.764 18.213 4.965 0.47 18.52 H new ATOM 0 HA2BGLY A 299 -4.282 18.925 5.481 0.53 18.52 H new ATOM 0 HA3AGLY A 299 -5.704 16.989 4.739 0.47 18.52 H new ATOM 0 HA3BGLY A 299 -5.095 17.742 4.870 0.53 18.52 H new ATOM 2178 N ILE A 300 -2.710 16.168 5.289 1.00 20.11 N ATOM 2179 CA ILE A 300 -1.871 15.249 6.067 1.00 17.58 C ATOM 2180 C ILE A 300 -0.648 15.934 6.648 1.00 20.03 C ATOM 2181 O ILE A 300 -0.240 15.636 7.768 1.00 24.61 O ATOM 2182 CB ILE A 300 -1.356 14.050 5.232 1.00 22.15 C ATOM 2183 CG1 ILE A 300 -2.505 13.190 4.720 1.00 21.38 C ATOM 2184 CG2 ILE A 300 -0.406 13.186 6.064 1.00 22.99 C ATOM 2185 CD1 ILE A 300 -2.028 11.994 3.912 1.00 18.54 C ATOM 0 H AILE A 300 -2.331 16.486 4.586 0.47 20.11 H new ATOM 0 H BILE A 300 -2.685 16.051 4.437 0.53 20.11 H new ATOM 0 HA ILE A 300 -2.456 14.936 6.775 1.00 17.58 H new ATOM 0 HB ILE A 300 -0.880 14.413 4.469 1.00 22.15 H new ATOM 0 HG12 ILE A 300 -3.031 12.878 5.473 1.00 21.38 H new ATOM 0 HG13 ILE A 300 -3.091 13.734 4.171 1.00 21.38 H new ATOM 0 HG21 ILE A 300 -0.093 12.441 5.528 1.00 22.99 H new ATOM 0 HG22 ILE A 300 0.352 13.720 6.349 1.00 22.99 H new ATOM 0 HG23 ILE A 300 -0.874 12.849 6.844 1.00 22.99 H new ATOM 0 HD11 ILE A 300 -2.794 11.481 3.610 1.00 18.54 H new ATOM 0 HD12 ILE A 300 -1.523 12.303 3.143 1.00 18.54 H new ATOM 0 HD13 ILE A 300 -1.462 11.434 4.466 1.00 18.54 H new ATOM 2186 N GLY A 301 -0.047 16.830 5.872 1.00 17.42 N ATOM 2187 CA GLY A 301 1.159 17.514 6.298 1.00 21.05 C ATOM 2188 C GLY A 301 2.430 16.846 5.809 1.00 16.49 C ATOM 2189 O GLY A 301 3.533 17.339 6.042 1.00 20.78 O ATOM 0 H GLY A 301 -0.327 17.055 5.090 1.00 17.42 H new ATOM 0 HA2 GLY A 301 1.136 18.428 5.975 1.00 21.05 H new ATOM 0 HA3 GLY A 301 1.175 17.556 7.267 1.00 21.05 H new ATOM 2190 N ILE A 302 2.277 15.714 5.128 1.00 16.04 N ATOM 2191 CA ILE A 302 3.419 15.006 4.573 1.00 14.82 C ATOM 2192 C ILE A 302 2.962 14.093 3.436 1.00 10.53 C ATOM 2193 O ILE A 302 1.836 13.597 3.444 1.00 11.60 O ATOM 2194 CB ILE A 302 4.169 14.202 5.673 1.00 18.56 C ATOM 2195 CG1 ILE A 302 5.604 13.891 5.245 1.00 19.18 C ATOM 2196 CG2 ILE A 302 3.394 12.949 6.055 1.00 21.63 C ATOM 2197 CD1 ILE A 302 6.516 13.504 6.405 1.00 21.75 C ATOM 0 H ILE A 302 1.517 15.341 4.977 1.00 16.04 H new ATOM 0 HA ILE A 302 4.043 15.656 4.215 1.00 14.82 H new ATOM 0 HB ILE A 302 4.226 14.753 6.469 1.00 18.56 H new ATOM 0 HG12 ILE A 302 5.591 13.168 4.598 1.00 19.18 H new ATOM 0 HG13 ILE A 302 5.975 14.667 4.796 1.00 19.18 H new ATOM 0 HG21 ILE A 302 3.880 12.464 6.741 1.00 21.63 H new ATOM 0 HG22 ILE A 302 2.520 13.199 6.394 1.00 21.63 H new ATOM 0 HG23 ILE A 302 3.288 12.383 5.274 1.00 21.63 H new ATOM 0 HD11 ILE A 302 7.407 13.320 6.069 1.00 21.75 H new ATOM 0 HD12 ILE A 302 6.556 14.234 7.043 1.00 21.75 H new ATOM 0 HD13 ILE A 302 6.166 12.712 6.842 1.00 21.75 H new ATOM 2198 N ASN A 303 3.831 13.903 2.448 1.00 9.98 N ATOM 2199 CA ASN A 303 3.554 12.937 1.387 1.00 7.96 C ATOM 2200 C ASN A 303 3.929 11.537 1.847 1.00 7.34 C ATOM 2201 O ASN A 303 4.896 11.359 2.601 1.00 8.01 O ATOM 2202 CB ASN A 303 4.304 13.309 0.109 1.00 8.24 C ATOM 2203 CG ASN A 303 3.932 14.690 -0.400 1.00 8.89 C ATOM 2204 OD1 ASN A 303 2.762 14.978 -0.634 1.00 9.64 O ATOM 2205 ND2 ASN A 303 4.921 15.553 -0.566 1.00 10.60 N ATOM 0 H ASN A 303 4.580 14.318 2.372 1.00 9.98 H new ATOM 0 HA ASN A 303 2.604 12.954 1.190 1.00 7.96 H new ATOM 0 HB2 ASN A 303 5.259 13.275 0.276 1.00 8.24 H new ATOM 0 HB3 ASN A 303 4.113 12.652 -0.578 1.00 8.24 H new ATOM 0 HD21 ASN A 303 4.755 16.349 -0.847 1.00 10.60 H new ATOM 0 HD22 ASN A 303 5.730 15.318 -0.393 1.00 10.60 H new ATOM 2206 N ILE A 304 3.162 10.548 1.414 1.00 6.93 N ATOM 2207 CA ILE A 304 3.376 9.176 1.874 1.00 6.36 C ATOM 2208 C ILE A 304 3.469 8.211 0.709 1.00 6.58 C ATOM 2209 O ILE A 304 2.495 7.999 -0.016 1.00 7.39 O ATOM 2210 CB ILE A 304 2.257 8.704 2.818 1.00 8.11 C ATOM 2211 CG1 ILE A 304 2.062 9.679 3.987 1.00 8.77 C ATOM 2212 CG2 ILE A 304 2.558 7.280 3.307 1.00 9.56 C ATOM 2213 CD1 ILE A 304 0.859 9.331 4.864 1.00 11.81 C ATOM 0 H ILE A 304 2.514 10.644 0.857 1.00 6.93 H new ATOM 0 HA ILE A 304 4.216 9.182 2.359 1.00 6.36 H new ATOM 0 HB ILE A 304 1.420 8.689 2.328 1.00 8.11 H new ATOM 0 HG12 ILE A 304 2.863 9.684 4.534 1.00 8.77 H new ATOM 0 HG13 ILE A 304 1.951 10.577 3.637 1.00 8.77 H new ATOM 0 HG21 ILE A 304 1.851 6.986 3.902 1.00 9.56 H new ATOM 0 HG22 ILE A 304 2.610 6.681 2.546 1.00 9.56 H new ATOM 0 HG23 ILE A 304 3.403 7.273 3.782 1.00 9.56 H new ATOM 0 HD11 ILE A 304 0.785 9.978 5.583 1.00 11.81 H new ATOM 0 HD12 ILE A 304 0.051 9.350 4.328 1.00 11.81 H new ATOM 0 HD13 ILE A 304 0.977 8.444 5.238 1.00 11.81 H new ATOM 2214 N PHE A 305 4.653 7.642 0.517 1.00 7.58 N ATOM 2215 CA PHE A 305 4.846 6.559 -0.431 1.00 7.22 C ATOM 2216 C PHE A 305 4.464 5.264 0.268 1.00 7.18 C ATOM 2217 O PHE A 305 5.308 4.560 0.829 1.00 8.38 O ATOM 2218 CB PHE A 305 6.290 6.541 -0.940 1.00 7.75 C ATOM 2219 CG PHE A 305 6.637 7.739 -1.785 1.00 7.24 C ATOM 2220 CD1 PHE A 305 6.502 7.693 -3.169 1.00 8.51 C ATOM 2221 CD2 PHE A 305 7.076 8.916 -1.200 1.00 10.12 C ATOM 2222 CE1 PHE A 305 6.804 8.805 -3.948 1.00 9.46 C ATOM 2223 CE2 PHE A 305 7.382 10.027 -1.980 1.00 11.02 C ATOM 2224 CZ PHE A 305 7.239 9.963 -3.355 1.00 11.51 C ATOM 0 H PHE A 305 5.367 7.875 0.935 1.00 7.58 H new ATOM 0 HA PHE A 305 4.285 6.677 -1.214 1.00 7.22 H new ATOM 0 HB2 PHE A 305 6.893 6.502 -0.182 1.00 7.75 H new ATOM 0 HB3 PHE A 305 6.434 5.734 -1.459 1.00 7.75 H new ATOM 0 HD1 PHE A 305 6.207 6.911 -3.577 1.00 8.51 H new ATOM 0 HD2 PHE A 305 7.167 8.964 -0.276 1.00 10.12 H new ATOM 0 HE1 PHE A 305 6.711 8.763 -4.872 1.00 9.46 H new ATOM 0 HE2 PHE A 305 7.682 10.810 -1.578 1.00 11.02 H new ATOM 0 HZ PHE A 305 7.438 10.706 -3.878 1.00 11.51 H new ATOM 2225 N GLY A 306 3.165 4.975 0.253 1.00 7.18 N ATOM 2226 CA GLY A 306 2.613 3.788 0.875 1.00 6.72 C ATOM 2227 C GLY A 306 2.696 2.581 -0.040 1.00 6.66 C ATOM 2228 O GLY A 306 3.424 2.582 -1.040 1.00 6.93 O ATOM 0 H GLY A 306 2.575 5.474 -0.126 1.00 7.18 H new ATOM 0 HA2 GLY A 306 3.091 3.603 1.699 1.00 6.72 H new ATOM 0 HA3 GLY A 306 1.687 3.949 1.114 1.00 6.72 H new ATOM 2229 N ASP A 307 1.924 1.554 0.292 1.00 6.69 N ATOM 2230 CA ASP A 307 2.061 0.268 -0.375 1.00 6.61 C ATOM 2231 C ASP A 307 1.866 0.336 -1.884 1.00 6.63 C ATOM 2232 O ASP A 307 2.523 -0.392 -2.619 1.00 6.96 O ATOM 2233 CB ASP A 307 1.081 -0.753 0.209 1.00 7.66 C ATOM 2234 CG ASP A 307 1.338 -1.051 1.676 1.00 8.33 C ATOM 2235 OD1 ASP A 307 2.496 -0.903 2.130 1.00 8.72 O ATOM 2236 OD2 ASP A 307 0.390 -1.475 2.367 1.00 10.18 O ATOM 0 H ASP A 307 1.316 1.581 0.900 1.00 6.69 H new ATOM 0 HA ASP A 307 2.976 -0.010 -0.215 1.00 6.61 H new ATOM 0 HB2 ASP A 307 0.176 -0.421 0.106 1.00 7.66 H new ATOM 0 HB3 ASP A 307 1.140 -1.578 -0.299 1.00 7.66 H new ATOM 2237 N VAL A 308 0.940 1.169 -2.349 1.00 6.86 N ATOM 2238 CA VAL A 308 0.716 1.318 -3.789 1.00 7.32 C ATOM 2239 C VAL A 308 2.028 1.606 -4.534 1.00 7.69 C ATOM 2240 O VAL A 308 2.269 1.049 -5.606 1.00 8.62 O ATOM 2241 CB VAL A 308 -0.336 2.413 -4.074 1.00 7.21 C ATOM 2242 CG1 VAL A 308 -0.291 2.843 -5.535 1.00 9.65 C ATOM 2243 CG2 VAL A 308 -1.726 1.903 -3.723 1.00 7.68 C ATOM 0 H VAL A 308 0.432 1.655 -1.853 1.00 6.86 H new ATOM 0 HA VAL A 308 0.370 0.475 -4.122 1.00 7.32 H new ATOM 0 HB VAL A 308 -0.130 3.185 -3.523 1.00 7.21 H new ATOM 0 HG11 VAL A 308 -0.958 3.530 -5.691 1.00 9.65 H new ATOM 0 HG12 VAL A 308 0.589 3.195 -5.742 1.00 9.65 H new ATOM 0 HG13 VAL A 308 -0.475 2.079 -6.103 1.00 9.65 H new ATOM 0 HG21 VAL A 308 -2.380 2.596 -3.905 1.00 7.68 H new ATOM 0 HG22 VAL A 308 -1.928 1.120 -4.258 1.00 7.68 H new ATOM 0 HG23 VAL A 308 -1.757 1.668 -2.782 1.00 7.68 H new ATOM 2244 N ALA A 309 2.880 2.450 -3.959 1.00 7.48 N ATOM 2245 CA ALA A 309 4.173 2.754 -4.560 1.00 7.11 C ATOM 2246 C ALA A 309 5.213 1.693 -4.239 1.00 6.64 C ATOM 2247 O ALA A 309 5.937 1.229 -5.119 1.00 7.80 O ATOM 2248 CB ALA A 309 4.665 4.104 -4.099 1.00 8.32 C ATOM 0 H ALA A 309 2.727 2.858 -3.218 1.00 7.48 H new ATOM 0 HA ALA A 309 4.045 2.766 -5.521 1.00 7.11 H new ATOM 0 HB1 ALA A 309 5.525 4.292 -4.507 1.00 8.32 H new ATOM 0 HB2 ALA A 309 4.028 4.787 -4.360 1.00 8.32 H new ATOM 0 HB3 ALA A 309 4.759 4.102 -3.134 1.00 8.32 H new ATOM 2249 N LEU A 310 5.292 1.307 -2.972 1.00 6.59 N ATOM 2250 CA LEU A 310 6.369 0.413 -2.559 1.00 7.46 C ATOM 2251 C LEU A 310 6.273 -0.974 -3.205 1.00 6.81 C ATOM 2252 O LEU A 310 7.297 -1.601 -3.489 1.00 7.18 O ATOM 2253 CB LEU A 310 6.428 0.297 -1.037 1.00 9.22 C ATOM 2254 CG LEU A 310 6.640 1.598 -0.263 1.00 7.41 C ATOM 2255 CD1 LEU A 310 6.789 1.287 1.209 1.00 10.15 C ATOM 2256 CD2 LEU A 310 7.840 2.386 -0.771 1.00 10.79 C ATOM 0 H LEU A 310 4.748 1.543 -2.349 1.00 6.59 H new ATOM 0 HA LEU A 310 7.195 0.812 -2.875 1.00 7.46 H new ATOM 0 HB2 LEU A 310 5.601 -0.107 -0.731 1.00 9.22 H new ATOM 0 HB3 LEU A 310 7.145 -0.314 -0.806 1.00 9.22 H new ATOM 0 HG LEU A 310 5.861 2.160 -0.402 1.00 7.41 H new ATOM 0 HD11 LEU A 310 6.924 2.111 1.702 1.00 10.15 H new ATOM 0 HD12 LEU A 310 5.987 0.846 1.530 1.00 10.15 H new ATOM 0 HD13 LEU A 310 7.553 0.703 1.341 1.00 10.15 H new ATOM 0 HD21 LEU A 310 7.936 3.200 -0.253 1.00 10.79 H new ATOM 0 HD22 LEU A 310 8.642 1.849 -0.679 1.00 10.79 H new ATOM 0 HD23 LEU A 310 7.707 2.611 -1.705 1.00 10.79 H new ATOM 2257 N LYS A 311 5.057 -1.453 -3.461 1.00 6.79 N ATOM 2258 CA LYS A 311 4.906 -2.790 -4.018 1.00 6.50 C ATOM 2259 C LYS A 311 5.363 -2.865 -5.478 1.00 7.00 C ATOM 2260 O LYS A 311 5.544 -3.955 -6.015 1.00 8.09 O ATOM 2261 CB LYS A 311 3.468 -3.309 -3.860 1.00 8.27 C ATOM 2262 CG LYS A 311 2.467 -2.711 -4.843 1.00 7.08 C ATOM 2263 CD LYS A 311 1.080 -3.338 -4.699 1.00 16.61 C ATOM 2264 CE LYS A 311 0.283 -2.754 -3.561 1.00 17.93 C ATOM 2265 NZ LYS A 311 -1.144 -3.210 -3.683 1.00 11.56 N ATOM 0 H LYS A 311 4.322 -1.028 -3.322 1.00 6.79 H new ATOM 0 HA LYS A 311 5.490 -3.371 -3.506 1.00 6.50 H new ATOM 0 HB2 LYS A 311 3.471 -4.273 -3.966 1.00 8.27 H new ATOM 0 HB3 LYS A 311 3.167 -3.124 -2.957 1.00 8.27 H new ATOM 0 HG2 LYS A 311 2.405 -1.754 -4.699 1.00 7.08 H new ATOM 0 HG3 LYS A 311 2.788 -2.841 -5.749 1.00 7.08 H new ATOM 0 HD2 LYS A 311 0.589 -3.217 -5.527 1.00 16.61 H new ATOM 0 HD3 LYS A 311 1.175 -4.294 -4.563 1.00 16.61 H new ATOM 0 HE2 LYS A 311 0.654 -3.037 -2.711 1.00 17.93 H new ATOM 0 HE3 LYS A 311 0.329 -1.785 -3.582 1.00 17.93 H new ATOM 0 HZ1 LYS A 311 -1.617 -2.893 -2.999 1.00 11.56 H new ATOM 0 HZ2 LYS A 311 -1.488 -2.908 -4.446 1.00 11.56 H new ATOM 0 HZ3 LYS A 311 -1.173 -4.100 -3.677 1.00 11.56 H new ATOM 2266 N ALA A 312 5.560 -1.709 -6.112 1.00 7.02 N ATOM 2267 CA ALA A 312 6.129 -1.679 -7.456 1.00 6.88 C ATOM 2268 C ALA A 312 7.659 -1.797 -7.453 1.00 8.72 C ATOM 2269 O ALA A 312 8.276 -1.822 -8.516 1.00 9.40 O ATOM 2270 CB ALA A 312 5.711 -0.413 -8.170 1.00 7.38 C ATOM 0 H ALA A 312 5.372 -0.937 -5.783 1.00 7.02 H new ATOM 0 HA ALA A 312 5.783 -2.453 -7.927 1.00 6.88 H new ATOM 0 HB1 ALA A 312 6.094 -0.402 -9.061 1.00 7.38 H new ATOM 0 HB2 ALA A 312 4.744 -0.381 -8.234 1.00 7.38 H new ATOM 0 HB3 ALA A 312 6.027 0.358 -7.674 1.00 7.38 H new ATOM 2271 N ALA A 313 8.267 -1.870 -6.271 1.00 6.97 N ATOM 2272 CA ALA A 313 9.721 -1.840 -6.155 1.00 8.46 C ATOM 2273 C ALA A 313 10.238 -2.861 -5.155 1.00 7.70 C ATOM 2274 O ALA A 313 9.500 -3.395 -4.329 1.00 7.38 O ATOM 2275 CB ALA A 313 10.171 -0.454 -5.734 1.00 8.07 C ATOM 0 H ALA A 313 7.852 -1.938 -5.521 1.00 6.97 H new ATOM 0 HA ALA A 313 10.087 -2.065 -7.025 1.00 8.46 H new ATOM 0 HB1 ALA A 313 11.138 -0.437 -5.658 1.00 8.07 H new ATOM 0 HB2 ALA A 313 9.888 0.194 -6.398 1.00 8.07 H new ATOM 0 HB3 ALA A 313 9.775 -0.232 -4.877 1.00 8.07 H new ATOM 2276 N PHE A 314 11.535 -3.126 -5.250 1.00 7.41 N ATOM 2277 CA PHE A 314 12.287 -3.782 -4.197 1.00 7.11 C ATOM 2278 C PHE A 314 12.931 -2.634 -3.433 1.00 8.27 C ATOM 2279 O PHE A 314 13.651 -1.811 -4.023 1.00 7.89 O ATOM 2280 CB PHE A 314 13.336 -4.694 -4.831 1.00 8.85 C ATOM 2281 CG PHE A 314 14.231 -5.379 -3.845 1.00 7.37 C ATOM 2282 CD1 PHE A 314 13.863 -6.584 -3.264 1.00 8.15 C ATOM 2283 CD2 PHE A 314 15.459 -4.828 -3.517 1.00 8.04 C ATOM 2284 CE1 PHE A 314 14.711 -7.219 -2.363 1.00 9.14 C ATOM 2285 CE2 PHE A 314 16.308 -5.461 -2.623 1.00 8.89 C ATOM 2286 CZ PHE A 314 15.931 -6.652 -2.049 1.00 8.61 C ATOM 0 H PHE A 314 12.008 -2.926 -5.940 1.00 7.41 H new ATOM 0 HA PHE A 314 11.747 -4.338 -3.614 1.00 7.11 H new ATOM 0 HB2 PHE A 314 12.885 -5.367 -5.365 1.00 8.85 H new ATOM 0 HB3 PHE A 314 13.882 -4.170 -5.438 1.00 8.85 H new ATOM 0 HD1 PHE A 314 13.044 -6.969 -3.478 1.00 8.15 H new ATOM 0 HD2 PHE A 314 15.717 -4.022 -3.902 1.00 8.04 H new ATOM 0 HE1 PHE A 314 14.457 -8.024 -1.973 1.00 9.14 H new ATOM 0 HE2 PHE A 314 17.130 -5.081 -2.412 1.00 8.89 H new ATOM 0 HZ PHE A 314 16.499 -7.077 -1.448 1.00 8.61 H new ATOM 2287 N VAL A 315 12.647 -2.551 -2.137 1.00 7.29 N ATOM 2288 CA VAL A 315 13.023 -1.385 -1.345 1.00 6.82 C ATOM 2289 C VAL A 315 13.996 -1.767 -0.228 1.00 5.91 C ATOM 2290 O VAL A 315 13.711 -2.653 0.590 1.00 7.27 O ATOM 2291 CB VAL A 315 11.786 -0.666 -0.764 1.00 7.30 C ATOM 2292 CG1 VAL A 315 12.193 0.650 -0.127 1.00 9.06 C ATOM 2293 CG2 VAL A 315 10.742 -0.443 -1.858 1.00 8.23 C ATOM 0 H VAL A 315 12.235 -3.163 -1.695 1.00 7.29 H new ATOM 0 HA VAL A 315 13.471 -0.766 -1.943 1.00 6.82 H new ATOM 0 HB VAL A 315 11.391 -1.225 -0.077 1.00 7.30 H new ATOM 0 HG11 VAL A 315 11.408 1.091 0.234 1.00 9.06 H new ATOM 0 HG12 VAL A 315 12.826 0.481 0.588 1.00 9.06 H new ATOM 0 HG13 VAL A 315 12.605 1.219 -0.795 1.00 9.06 H new ATOM 0 HG21 VAL A 315 9.970 0.009 -1.482 1.00 8.23 H new ATOM 0 HG22 VAL A 315 11.124 0.103 -2.563 1.00 8.23 H new ATOM 0 HG23 VAL A 315 10.469 -1.299 -2.224 1.00 8.23 H new ATOM 2294 N VAL A 316 15.146 -1.097 -0.214 1.00 6.48 N ATOM 2295 CA VAL A 316 16.168 -1.310 0.806 1.00 6.81 C ATOM 2296 C VAL A 316 16.115 -0.199 1.838 1.00 6.84 C ATOM 2297 O VAL A 316 16.248 0.985 1.504 1.00 7.52 O ATOM 2298 CB VAL A 316 17.590 -1.327 0.194 1.00 8.73 C ATOM 2299 CG1 VAL A 316 18.657 -1.537 1.292 1.00 8.37 C ATOM 2300 CG2 VAL A 316 17.696 -2.381 -0.881 1.00 9.46 C ATOM 0 H VAL A 316 15.356 -0.503 -0.800 1.00 6.48 H new ATOM 0 HA VAL A 316 15.986 -2.170 1.216 1.00 6.81 H new ATOM 0 HB VAL A 316 17.755 -0.465 -0.218 1.00 8.73 H new ATOM 0 HG11 VAL A 316 19.539 -1.545 0.889 1.00 8.37 H new ATOM 0 HG12 VAL A 316 18.603 -0.815 1.938 1.00 8.37 H new ATOM 0 HG13 VAL A 316 18.499 -2.383 1.739 1.00 8.37 H new ATOM 0 HG21 VAL A 316 18.592 -2.376 -1.252 1.00 9.46 H new ATOM 0 HG22 VAL A 316 17.509 -3.253 -0.499 1.00 9.46 H new ATOM 0 HG23 VAL A 316 17.055 -2.192 -1.584 1.00 9.46 H new ATOM 2301 N PHE A 317 15.911 -0.591 3.091 1.00 6.83 N ATOM 2302 CA PHE A 317 15.962 0.315 4.224 1.00 6.62 C ATOM 2303 C PHE A 317 17.332 0.132 4.856 1.00 7.47 C ATOM 2304 O PHE A 317 17.574 -0.836 5.587 1.00 8.55 O ATOM 2305 CB PHE A 317 14.822 0.010 5.207 1.00 7.77 C ATOM 2306 CG PHE A 317 13.450 0.280 4.638 1.00 6.73 C ATOM 2307 CD1 PHE A 317 12.848 -0.621 3.774 1.00 7.90 C ATOM 2308 CD2 PHE A 317 12.765 1.444 4.968 1.00 7.97 C ATOM 2309 CE1 PHE A 317 11.597 -0.359 3.243 1.00 9.19 C ATOM 2310 CE2 PHE A 317 11.507 1.714 4.441 1.00 8.03 C ATOM 2311 CZ PHE A 317 10.925 0.806 3.574 1.00 9.40 C ATOM 0 H PHE A 317 15.736 -1.405 3.307 1.00 6.83 H new ATOM 0 HA PHE A 317 15.840 1.239 3.954 1.00 6.62 H new ATOM 0 HB2 PHE A 317 14.876 -0.921 5.475 1.00 7.77 H new ATOM 0 HB3 PHE A 317 14.943 0.544 6.008 1.00 7.77 H new ATOM 0 HD1 PHE A 317 13.288 -1.409 3.549 1.00 7.90 H new ATOM 0 HD2 PHE A 317 13.155 2.053 5.552 1.00 7.97 H new ATOM 0 HE1 PHE A 317 11.205 -0.969 2.660 1.00 9.19 H new ATOM 0 HE2 PHE A 317 11.061 2.497 4.669 1.00 8.03 H new ATOM 0 HZ PHE A 317 10.085 0.978 3.214 1.00 9.40 H new ATOM 2312 N ASN A 318 18.249 1.026 4.501 1.00 8.00 N ATOM 2313 CA ASN A 318 19.639 0.905 4.916 1.00 8.16 C ATOM 2314 C ASN A 318 19.863 1.648 6.222 1.00 9.16 C ATOM 2315 O ASN A 318 19.828 2.881 6.257 1.00 9.73 O ATOM 2316 CB ASN A 318 20.560 1.449 3.824 1.00 9.90 C ATOM 2317 CG ASN A 318 21.998 1.550 4.278 1.00 14.35 C ATOM 2318 OD1 ASN A 318 22.424 0.823 5.172 1.00 13.59 O ATOM 2319 ND2 ASN A 318 22.749 2.472 3.682 1.00 14.77 N ATOM 0 H ASN A 318 18.083 1.716 4.015 1.00 8.00 H new ATOM 0 HA ASN A 318 19.846 -0.032 5.057 1.00 8.16 H new ATOM 0 HB2 ASN A 318 20.509 0.873 3.045 1.00 9.90 H new ATOM 0 HB3 ASN A 318 20.248 2.325 3.549 1.00 9.90 H new ATOM 0 HD21 ASN A 318 23.569 2.578 3.919 1.00 14.77 H new ATOM 0 HD22 ASN A 318 22.415 2.962 3.060 1.00 14.77 H new ATOM 2320 N GLY A 319 20.083 0.894 7.295 1.00 11.03 N ATOM 2321 CA GLY A 319 20.223 1.457 8.627 1.00 13.26 C ATOM 2322 C GLY A 319 21.658 1.646 9.077 1.00 15.05 C ATOM 2323 O GLY A 319 21.956 1.563 10.267 1.00 16.99 O ATOM 0 H GLY A 319 20.155 0.037 7.267 1.00 11.03 H new ATOM 0 HA2 GLY A 319 19.771 2.315 8.653 1.00 13.26 H new ATOM 0 HA3 GLY A 319 19.770 0.879 9.260 1.00 13.26 H new ATOM 2324 N ALA A 320 22.548 1.896 8.131 1.00 13.21 N ATOM 2325 CA ALA A 320 23.919 2.271 8.463 1.00 15.10 C ATOM 2326 C ALA A 320 23.938 3.579 9.255 1.00 16.30 C ATOM 2327 O ALA A 320 22.906 4.231 9.431 1.00 16.72 O ATOM 2328 CB ALA A 320 24.737 2.407 7.198 1.00 19.28 C ATOM 0 H ALA A 320 22.382 1.855 7.288 1.00 13.21 H new ATOM 0 HA ALA A 320 24.309 1.575 9.015 1.00 15.10 H new ATOM 0 HB1 ALA A 320 25.646 2.656 7.426 1.00 19.28 H new ATOM 0 HB2 ALA A 320 24.743 1.561 6.724 1.00 19.28 H new ATOM 0 HB3 ALA A 320 24.347 3.091 6.632 1.00 19.28 H new ATOM 2329 N THR A 321 25.124 3.960 9.729 1.00 19.07 N ATOM 2330 CA THR A 321 25.276 5.153 10.557 1.00 20.76 C ATOM 2331 C THR A 321 24.557 6.347 9.943 1.00 15.70 C ATOM 2332 O THR A 321 23.873 7.096 10.640 1.00 18.70 O ATOM 2333 CB THR A 321 26.761 5.493 10.781 1.00 24.25 C ATOM 2334 OG1 THR A 321 27.425 4.363 11.361 1.00 34.22 O ATOM 2335 CG2 THR A 321 26.896 6.685 11.714 1.00 24.83 C ATOM 0 H THR A 321 25.858 3.537 9.580 1.00 19.07 H new ATOM 0 HA THR A 321 24.871 4.957 11.417 1.00 20.76 H new ATOM 0 HB THR A 321 27.164 5.713 9.927 1.00 24.25 H new ATOM 0 HG1 THR A 321 28.236 4.546 11.483 1.00 34.22 H new ATOM 0 HG21 THR A 321 27.835 6.888 11.846 1.00 24.83 H new ATOM 0 HG22 THR A 321 26.451 7.454 11.324 1.00 24.83 H new ATOM 0 HG23 THR A 321 26.488 6.475 12.568 1.00 24.83 H new ATOM 2336 N THR A 322 24.727 6.519 8.638 1.00 17.14 N ATOM 2337 CA THR A 322 23.902 7.455 7.885 1.00 14.36 C ATOM 2338 C THR A 322 22.909 6.657 7.042 1.00 11.83 C ATOM 2339 O THR A 322 23.271 6.103 6.008 1.00 12.95 O ATOM 2340 CB THR A 322 24.739 8.369 6.982 1.00 16.46 C ATOM 2341 OG1 THR A 322 25.639 9.140 7.788 1.00 17.98 O ATOM 2342 CG2 THR A 322 23.844 9.324 6.217 1.00 19.88 C ATOM 0 H THR A 322 25.315 6.103 8.169 1.00 17.14 H new ATOM 0 HA THR A 322 23.436 8.028 8.514 1.00 14.36 H new ATOM 0 HB THR A 322 25.231 7.815 6.356 1.00 16.46 H new ATOM 0 HG1 THR A 322 26.391 8.767 7.804 1.00 17.98 H new ATOM 0 HG21 THR A 322 24.388 9.894 5.651 1.00 19.88 H new ATOM 0 HG22 THR A 322 23.226 8.818 5.667 1.00 19.88 H new ATOM 0 HG23 THR A 322 23.345 9.872 6.843 1.00 19.88 H new ATOM 2343 N PRO A 323 21.649 6.586 7.495 1.00 11.69 N ATOM 2344 CA PRO A 323 20.672 5.767 6.767 1.00 10.76 C ATOM 2345 C PRO A 323 20.406 6.276 5.355 1.00 10.09 C ATOM 2346 O PRO A 323 20.469 7.480 5.101 1.00 10.81 O ATOM 2347 CB PRO A 323 19.411 5.896 7.622 1.00 11.66 C ATOM 2348 CG PRO A 323 19.927 6.171 9.008 1.00 16.23 C ATOM 2349 CD PRO A 323 21.122 7.063 8.784 1.00 13.34 C ATOM 0 HA PRO A 323 20.983 4.856 6.647 1.00 10.76 H new ATOM 0 HB2 PRO A 323 18.842 6.616 7.307 1.00 11.66 H new ATOM 0 HB3 PRO A 323 18.881 5.084 7.596 1.00 11.66 H new ATOM 0 HG2 PRO A 323 19.256 6.607 9.556 1.00 16.23 H new ATOM 0 HG3 PRO A 323 20.176 5.351 9.463 1.00 16.23 H new ATOM 0 HD2 PRO A 323 20.870 7.999 8.746 1.00 13.34 H new ATOM 0 HD3 PRO A 323 21.776 6.974 9.495 1.00 13.34 H new ATOM 2350 N THR A 324 20.096 5.356 4.448 1.00 8.82 N ATOM 2351 CA THR A 324 19.650 5.709 3.105 1.00 9.36 C ATOM 2352 C THR A 324 18.544 4.739 2.704 1.00 8.35 C ATOM 2353 O THR A 324 18.280 3.772 3.421 1.00 9.32 O ATOM 2354 CB THR A 324 20.782 5.612 2.069 1.00 9.00 C ATOM 2355 OG1 THR A 324 21.237 4.252 1.991 1.00 11.11 O ATOM 2356 CG2 THR A 324 21.945 6.545 2.435 1.00 13.92 C ATOM 0 H THR A 324 20.138 4.509 4.594 1.00 8.82 H new ATOM 0 HA THR A 324 19.341 6.628 3.121 1.00 9.36 H new ATOM 0 HB THR A 324 20.441 5.890 1.204 1.00 9.00 H new ATOM 0 HG1 THR A 324 21.855 4.195 1.425 1.00 11.11 H new ATOM 0 HG21 THR A 324 22.645 6.466 1.768 1.00 13.92 H new ATOM 0 HG22 THR A 324 21.628 7.461 2.464 1.00 13.92 H new ATOM 0 HG23 THR A 324 22.297 6.298 3.304 1.00 13.92 H new ATOM 2357 N LEU A 325 17.890 5.017 1.580 1.00 8.84 N ATOM 2358 CA LEU A 325 16.860 4.154 1.004 1.00 7.10 C ATOM 2359 C LEU A 325 17.295 3.751 -0.392 1.00 9.07 C ATOM 2360 O LEU A 325 17.825 4.572 -1.145 1.00 10.90 O ATOM 2361 CB LEU A 325 15.535 4.912 0.894 1.00 11.08 C ATOM 2362 CG LEU A 325 14.551 4.916 2.059 1.00 13.76 C ATOM 2363 CD1 LEU A 325 13.435 5.913 1.769 1.00 12.00 C ATOM 2364 CD2 LEU A 325 13.987 3.526 2.275 1.00 10.97 C ATOM 0 H LEU A 325 18.035 5.729 1.120 1.00 8.84 H new ATOM 0 HA LEU A 325 16.741 3.376 1.571 1.00 7.10 H new ATOM 0 HB2 LEU A 325 15.749 5.837 0.696 1.00 11.08 H new ATOM 0 HB3 LEU A 325 15.065 4.558 0.123 1.00 11.08 H new ATOM 0 HG LEU A 325 15.010 5.182 2.871 1.00 13.76 H new ATOM 0 HD11 LEU A 325 12.806 5.919 2.508 1.00 12.00 H new ATOM 0 HD12 LEU A 325 13.813 6.800 1.660 1.00 12.00 H new ATOM 0 HD13 LEU A 325 12.974 5.656 0.955 1.00 12.00 H new ATOM 0 HD21 LEU A 325 13.363 3.541 3.018 1.00 10.97 H new ATOM 0 HD22 LEU A 325 13.526 3.235 1.472 1.00 10.97 H new ATOM 0 HD23 LEU A 325 14.710 2.910 2.473 1.00 10.97 H new ATOM 2365 N GLY A 326 17.072 2.496 -0.752 1.00 8.09 N ATOM 2366 CA GLY A 326 17.346 2.022 -2.097 1.00 7.87 C ATOM 2367 C GLY A 326 16.073 1.532 -2.773 1.00 7.47 C ATOM 2368 O GLY A 326 15.234 0.891 -2.131 1.00 8.27 O ATOM 0 H GLY A 326 16.757 1.895 -0.223 1.00 8.09 H new ATOM 0 HA2 GLY A 326 17.740 2.737 -2.621 1.00 7.87 H new ATOM 0 HA3 GLY A 326 17.996 1.303 -2.064 1.00 7.87 H new ATOM 2369 N PHE A 327 15.919 1.833 -4.058 1.00 7.05 N ATOM 2370 CA PHE A 327 14.793 1.339 -4.843 1.00 6.83 C ATOM 2371 C PHE A 327 15.300 0.647 -6.094 1.00 6.91 C ATOM 2372 O PHE A 327 16.151 1.191 -6.812 1.00 8.50 O ATOM 2373 CB PHE A 327 13.867 2.478 -5.294 1.00 7.67 C ATOM 2374 CG PHE A 327 13.097 3.138 -4.186 1.00 8.35 C ATOM 2375 CD1 PHE A 327 13.677 4.114 -3.401 1.00 10.41 C ATOM 2376 CD2 PHE A 327 11.771 2.801 -3.961 1.00 9.54 C ATOM 2377 CE1 PHE A 327 12.957 4.735 -2.397 1.00 12.23 C ATOM 2378 CE2 PHE A 327 11.046 3.418 -2.958 1.00 11.96 C ATOM 2379 CZ PHE A 327 11.641 4.384 -2.173 1.00 12.44 C ATOM 0 H PHE A 327 16.465 2.330 -4.500 1.00 7.05 H new ATOM 0 HA PHE A 327 14.300 0.727 -4.274 1.00 6.83 H new ATOM 0 HB2 PHE A 327 14.399 3.151 -5.747 1.00 7.67 H new ATOM 0 HB3 PHE A 327 13.238 2.129 -5.945 1.00 7.67 H new ATOM 0 HD1 PHE A 327 14.562 4.357 -3.549 1.00 10.41 H new ATOM 0 HD2 PHE A 327 11.365 2.153 -4.490 1.00 9.54 H new ATOM 0 HE1 PHE A 327 13.359 5.389 -1.873 1.00 12.23 H new ATOM 0 HE2 PHE A 327 10.158 3.182 -2.813 1.00 11.96 H new ATOM 0 HZ PHE A 327 11.157 4.797 -1.495 1.00 12.44 H new ATOM 2380 N ALA A 328 14.761 -0.531 -6.379 1.00 7.32 N ATOM 2381 CA ALA A 328 14.995 -1.198 -7.662 1.00 6.87 C ATOM 2382 C ALA A 328 13.666 -1.621 -8.273 1.00 7.82 C ATOM 2383 O ALA A 328 12.708 -1.903 -7.554 1.00 8.93 O ATOM 2384 CB ALA A 328 15.901 -2.414 -7.493 1.00 8.63 C ATOM 0 H ALA A 328 14.252 -0.967 -5.841 1.00 7.32 H new ATOM 0 HA ALA A 328 15.439 -0.571 -8.254 1.00 6.87 H new ATOM 0 HB1 ALA A 328 16.040 -2.837 -8.355 1.00 8.63 H new ATOM 0 HB2 ALA A 328 16.755 -2.133 -7.130 1.00 8.63 H new ATOM 0 HB3 ALA A 328 15.484 -3.046 -6.887 1.00 8.63 H new ATOM 2385 N SER A 329 13.605 -1.680 -9.599 1.00 8.13 N ATOM 2386 CA SER A 329 12.474 -2.318 -10.259 1.00 9.18 C ATOM 2387 C SER A 329 12.540 -3.831 -10.035 1.00 7.86 C ATOM 2388 O SER A 329 13.574 -4.367 -9.629 1.00 9.95 O ATOM 2389 CB SER A 329 12.475 -2.004 -11.751 1.00 9.21 C ATOM 2390 OG SER A 329 12.271 -0.621 -11.975 1.00 12.82 O ATOM 0 H SER A 329 14.202 -1.360 -10.129 1.00 8.13 H new ATOM 0 HA SER A 329 11.651 -1.973 -9.879 1.00 9.18 H new ATOM 0 HB2 SER A 329 13.319 -2.278 -12.143 1.00 9.21 H new ATOM 0 HB3 SER A 329 11.778 -2.514 -12.193 1.00 9.21 H new ATOM 0 HG SER A 329 12.981 -0.203 -11.812 1.00 12.82 H new ATOM 2391 N LYS A 330 11.444 -4.534 -10.298 1.00 9.70 N ATOM 2392 CA LYS A 330 11.436 -5.975 -10.075 1.00 10.74 C ATOM 2393 C LYS A 330 10.475 -6.688 -11.004 1.00 14.43 C ATOM 2394 O LYS A 330 9.868 -6.053 -11.856 1.00 14.12 O ATOM 2395 CB LYS A 330 11.101 -6.300 -8.612 1.00 9.68 C ATOM 2396 CG LYS A 330 9.710 -5.855 -8.183 1.00 8.92 C ATOM 2397 CD LYS A 330 9.500 -6.046 -6.686 1.00 10.25 C ATOM 2398 CE LYS A 330 8.057 -5.740 -6.286 1.00 8.66 C ATOM 2399 NZ LYS A 330 7.909 -5.665 -4.805 1.00 8.72 N ATOM 2400 OXT LYS A 330 10.307 -7.904 -10.915 1.00 16.52 O ATOM 0 H LYS A 330 10.709 -4.205 -10.600 1.00 9.70 H new ATOM 0 HA LYS A 330 12.329 -6.298 -10.272 1.00 10.74 H new ATOM 0 HB2 LYS A 330 11.181 -7.257 -8.476 1.00 9.68 H new ATOM 0 HB3 LYS A 330 11.758 -5.876 -8.037 1.00 9.68 H new ATOM 0 HG2 LYS A 330 9.583 -4.921 -8.412 1.00 8.92 H new ATOM 0 HG3 LYS A 330 9.042 -6.361 -8.672 1.00 8.92 H new ATOM 0 HD2 LYS A 330 9.720 -6.958 -6.440 1.00 10.25 H new ATOM 0 HD3 LYS A 330 10.104 -5.467 -6.196 1.00 10.25 H new ATOM 0 HE2 LYS A 330 7.780 -4.900 -6.684 1.00 8.66 H new ATOM 0 HE3 LYS A 330 7.469 -6.427 -6.637 1.00 8.66 H new ATOM 0 HZ1 LYS A 330 7.047 -5.719 -4.589 1.00 8.72 H new ATOM 0 HZ2 LYS A 330 8.352 -6.339 -4.428 1.00 8.72 H new ATOM 0 HZ3 LYS A 330 8.240 -4.892 -4.512 1.00 8.72 H new TER 2401 LYS A 330 HETATM 2402 C1 RB4 A1001 -3.696 7.989 6.620 0.70 18.44 C HETATM 2403 N1 RB4 A1001 -2.442 5.950 7.422 0.70 19.62 N HETATM 2404 O1 RB4 A1001 -4.646 6.008 5.735 0.70 21.76 O HETATM 2405 S1 RB4 A1001 -1.553 8.511 7.853 0.70 24.02 S HETATM 2406 C2 RB4 A1001 -4.827 7.199 5.987 0.70 21.41 C HETATM 2407 N2 RB4 A1001 -0.178 3.316 9.014 0.70 14.15 N HETATM 2408 O2 RB4 A1001 -6.127 7.716 5.975 0.70 26.22 O HETATM 2409 C3 RB4 A1001 -7.160 6.955 5.415 0.70 26.32 C HETATM 2410 N3 RB4 A1001 -4.583 2.462 10.891 0.70 20.95 N HETATM 2411 O3 RB4 A1001 -0.661 6.079 8.910 0.70 24.96 O HETATM 2412 C4 RB4 A1001 -8.038 6.196 6.334 0.70 27.12 C HETATM 2413 C5 RB4 A1001 -3.544 9.505 6.656 0.70 23.24 C HETATM 2414 C6 RB4 A1001 -4.500 10.472 6.067 0.70 25.73 C HETATM 2415 C7 RB4 A1001 -2.330 9.853 7.354 0.70 23.28 C HETATM 2416 C8 RB4 A1001 -2.584 7.379 7.285 0.70 20.21 C HETATM 2417 C9 RB4 A1001 -1.440 5.377 8.279 0.70 20.24 C HETATM 2418 C10 RB4 A1001 -1.373 3.868 8.373 0.70 17.20 C HETATM 2419 C11 RB4 A1001 -0.333 3.295 10.458 0.70 18.71 C HETATM 2420 C12 RB4 A1001 -0.950 2.047 11.027 0.70 18.72 C HETATM 2421 C13 RB4 A1001 -2.437 1.942 10.898 0.70 20.34 C HETATM 2422 C19 RB4 A1001 -3.162 0.779 10.520 0.70 20.01 C HETATM 2423 C20 RB4 A1001 -4.490 1.123 10.524 0.70 20.63 C HETATM 2424 C21 RB4 A1001 -3.350 2.967 11.116 0.70 18.89 C HETATM 2425 C22 RB4 A1001 -2.768 -0.546 10.177 0.70 21.80 C HETATM 2426 C23 RB4 A1001 -3.743 -1.495 9.845 0.70 20.73 C HETATM 2427 C24 RB4 A1001 -5.100 -1.139 9.852 0.70 19.61 C HETATM 2428 C25 RB4 A1001 -5.486 0.155 10.185 0.70 22.36 C HETATM 0 H12A RB4 A1001 -0.549 1.279 10.590 0.70 18.72 H new HETATM 0 H11A RB4 A1001 0.540 3.419 10.863 0.70 18.71 H new HETATM 0 H10A RB4 A1001 -1.435 3.503 7.476 0.70 17.20 H new HETATM 0 HN3 RB4 A1001 -5.317 2.903 10.964 0.70 20.95 H new HETATM 0 HN2 RB4 A1001 0.520 3.042 8.593 0.70 14.15 H new HETATM 0 HN1 RB4 A1001 -2.967 5.430 6.982 0.70 19.62 H new HETATM 0 H7 RB4 A1001 -2.020 10.760 7.505 0.70 23.28 H new HETATM 0 H4B RB4 A1001 -7.506 5.564 6.842 0.70 27.12 H new HETATM 0 H4A RB4 A1001 -8.478 6.810 6.942 0.70 27.12 H new HETATM 0 H4 RB4 A1001 -8.706 5.716 5.821 0.70 27.12 H new HETATM 0 H3A RB4 A1001 -7.720 7.551 4.893 0.70 26.32 H new HETATM 0 H3 RB4 A1001 -6.762 6.324 4.795 0.70 26.32 H new HETATM 0 H25 RB4 A1001 -6.425 0.399 10.187 0.70 22.36 H new HETATM 0 H24 RB4 A1001 -5.773 -1.799 9.623 0.70 19.61 H new HETATM 0 H23 RB4 A1001 -3.480 -2.399 9.610 0.70 20.73 H new HETATM 0 H22 RB4 A1001 -1.829 -0.790 10.173 0.70 21.80 H new HETATM 0 H21 RB4 A1001 -3.141 3.876 11.381 0.70 18.89 H new HETATM 0 H12 RB4 A1001 -0.719 1.991 11.967 0.70 18.72 H new HETATM 0 H11 RB4 A1001 -0.877 4.054 10.720 0.70 18.71 H new HETATM 0 H10 RB4 A1001 -2.152 3.557 8.860 0.70 17.20 H new HETATM 2429 S DMS A2001 -4.488 2.277 5.977 0.68 18.29 S HETATM 2430 O DMS A2001 -3.235 3.338 5.267 0.68 10.35 O HETATM 2431 C1 DMS A2001 -3.687 0.808 6.676 0.68 16.54 C HETATM 2432 C2 DMS A2001 -5.140 3.028 7.493 0.68 19.81 C HETATM 0 H23 DMS A2001 -5.883 2.499 7.823 0.68 19.81 H new HETATM 0 H22 DMS A2001 -4.442 3.059 8.165 0.68 19.81 H new HETATM 0 H21 DMS A2001 -5.445 3.929 7.303 0.68 19.81 H new HETATM 0 H13 DMS A2001 -4.359 0.226 7.064 0.68 16.54 H new HETATM 0 H12 DMS A2001 -3.214 0.333 5.975 0.68 16.54 H new HETATM 0 H11 DMS A2001 -3.058 1.078 7.364 0.68 16.54 H new HETATM 2433 S DMS A4001 -10.008 15.136 -12.188 0.66 20.41 S HETATM 2434 O DMS A4001 -8.496 15.979 -11.713 0.66 18.83 O HETATM 2435 C1 DMS A4001 -11.437 16.031 -11.527 0.66 18.77 C HETATM 2436 C2 DMS A4001 -10.240 15.448 -13.948 0.66 14.11 C HETATM 0 H23 DMS A4001 -11.188 15.514 -14.143 0.66 14.11 H new HETATM 0 H22 DMS A4001 -9.802 16.279 -14.190 0.66 14.11 H new HETATM 0 H21 DMS A4001 -9.855 14.719 -14.460 0.66 14.11 H new HETATM 0 H13 DMS A4001 -12.230 15.477 -11.603 0.66 18.77 H new HETATM 0 H12 DMS A4001 -11.281 16.245 -10.594 0.66 18.77 H new HETATM 0 H11 DMS A4001 -11.566 16.851 -12.029 0.66 18.77 H new HETATM 2437 C1 GOL A3002 8.146 -3.491 -11.349 1.00 16.06 C HETATM 2438 O1 GOL A3002 9.176 -2.616 -10.929 1.00 12.06 O HETATM 2439 C2 GOL A3002 6.846 -2.719 -11.540 1.00 15.60 C HETATM 2440 O2 GOL A3002 7.029 -1.764 -12.564 1.00 16.47 O HETATM 2441 C3 GOL A3002 5.726 -3.687 -11.907 1.00 18.15 C HETATM 2442 O3 GOL A3002 6.006 -4.303 -13.146 1.00 21.96 O HETATM 0 HO3 GOL A3002 6.406 -3.759 -13.646 1.00 21.96 H new HETATM 0 HO2 GOL A3002 6.724 -1.023 -12.314 1.00 16.47 H new HETATM 0 HO1 GOL A3002 8.989 -2.306 -10.171 1.00 12.06 H new HETATM 0 H32 GOL A3002 5.632 -4.361 -11.216 1.00 18.15 H new HETATM 0 H31 GOL A3002 4.882 -3.212 -11.957 1.00 18.15 H new HETATM 0 H2 GOL A3002 6.603 -2.264 -10.718 1.00 15.60 H new HETATM 0 H12 GOL A3002 8.398 -3.923 -12.180 1.00 16.06 H new HETATM 0 H11 GOL A3002 8.020 -4.192 -10.691 1.00 16.06 H new HETATM 2443 C ACT A1428 3.674 7.213 14.753 1.00 19.74 C HETATM 2444 O ACT A1428 4.371 7.099 15.788 1.00 30.46 O HETATM 2445 OXT ACT A1428 4.269 7.622 13.733 1.00 29.58 O1+ HETATM 2446 CH3 ACT A1428 2.212 6.894 14.740 1.00 30.25 C HETATM 0 H3 ACT A1428 2.081 5.965 14.987 1.00 30.25 H new HETATM 0 H2 ACT A1428 1.750 7.465 15.374 1.00 30.25 H new HETATM 0 H1 ACT A1428 1.855 7.045 13.851 1.00 30.25 H new HETATM 2447 O HOH A 331 -0.784 20.943 6.666 1.00 29.41 O HETATM 2448 O HOH A 332 11.847 -12.894 -5.936 1.00 31.49 O HETATM 2449 O HOH A 333 -18.629 6.312 -11.687 1.00 26.33 O HETATM 2450 O HOH A 334 -18.400 -0.616 6.375 1.00 33.28 O HETATM 2451 O HOH A 335 1.361 18.224 1.039 1.00 34.02 O HETATM 2452 O HOH A 336 -11.714 0.872 -1.059 1.00 32.42 O HETATM 2453 O HOH A 337 8.467 -15.387 11.515 1.00 8.23 O HETATM 2454 O HOH A 338 13.199 15.933 7.560 1.00 32.11 O HETATM 2455 O HOH A 339 9.580 -2.948 16.373 1.00 8.65 O HETATM 2456 O HOH A 340 -14.514 3.830 0.180 1.00 32.99 O HETATM 2457 O HOH A 341 19.979 7.304 12.580 1.00 33.29 O HETATM 2458 O HOH A 342 -4.243 -20.751 16.878 1.00 30.99 O HETATM 2459 O HOH A 343 -18.969 8.683 -14.127 1.00 32.60 O HETATM 2460 O HOH A 344 20.256 -12.210 -10.359 1.00 37.97 O HETATM 2461 O HOH A 345 2.206 -3.722 -16.066 1.00 35.57 O HETATM 2462 O HOH A 346 4.827 18.592 -6.664 1.00 30.65 O HETATM 2463 O HOH A 347 -7.052 2.965 2.278 1.00 35.41 O HETATM 2464 O HOH A 348 -7.421 -2.950 9.497 1.00 29.44 O HETATM 2465 O HOH A 349 16.838 -8.794 0.691 1.00 7.67 O HETATM 2466 O HOH A 350 -0.624 -18.181 18.583 1.00 29.52 O HETATM 2467 O HOH A 351 23.056 13.059 2.626 1.00 32.72 O HETATM 2468 O HOH A 352 -19.038 8.079 -6.309 1.00 31.71 O HETATM 2469 O HOH A 353 0.539 -4.627 33.912 1.00 31.70 O HETATM 2470 O HOH A 354 20.361 -8.389 -13.297 1.00 33.32 O HETATM 2471 O HOH A 355 14.362 -20.055 27.596 1.00 32.70 O HETATM 2472 O HOH A 356 7.307 19.473 -6.099 1.00 31.86 O HETATM 2473 O HOH A 357 21.462 4.670 -12.848 1.00 34.81 O HETATM 2474 O HOH A 358 -8.210 -3.722 29.661 1.00 31.67 O HETATM 2475 O HOH A 359 -11.737 -2.055 -15.398 1.00 30.73 O HETATM 2476 O HOH A 360 13.396 15.530 4.154 1.00 33.41 O HETATM 2477 O HOH A 361 2.640 -13.815 5.668 1.00 8.75 O HETATM 2478 O HOH A 362 25.109 -1.500 12.948 1.00 32.59 O HETATM 2479 O HOH A 363 -0.713 -19.516 21.099 1.00 32.50 O HETATM 2480 O HOH A 364 19.198 5.461 -13.356 1.00 32.09 O HETATM 2481 O HOH A 365 20.248 10.018 11.618 1.00 32.15 O HETATM 2482 O HOH A 366 23.220 -13.493 16.617 1.00 33.43 O HETATM 2483 O HOH A 367 16.203 11.395 -1.118 1.00 10.30 O HETATM 2484 O HOH A 368 -22.533 4.329 -6.001 1.00 10.55 O HETATM 2485 O HOH A 369 -9.685 7.661 -19.931 1.00 31.60 O HETATM 2486 O HOH A 370 20.841 -0.451 18.669 1.00 33.28 O HETATM 2487 O HOH A 371 3.505 -6.983 7.333 1.00 8.75 O HETATM 2488 O HOH A 372 25.068 -7.614 -7.163 1.00 33.92 O HETATM 2489 O HOH A 373 -10.573 10.823 3.511 1.00 34.98 O HETATM 2490 O HOH A 374 6.807 21.746 -3.830 1.00 34.87 O HETATM 2491 O HOH A 375 5.118 -18.867 31.926 1.00 29.15 O HETATM 2492 O HOH A 376 -4.973 -7.220 -12.046 1.00 30.20 O HETATM 2493 O HOH A 377 1.818 5.878 33.929 1.00 34.10 O HETATM 2494 O HOH A 378 22.317 14.399 0.487 1.00 33.68 O HETATM 2495 O HOH A 379 17.671 12.998 13.138 1.00 31.53 O HETATM 2496 O HOH A 380 8.467 9.599 -19.499 1.00 32.96 O HETATM 2497 O HOH A 381 -0.046 -16.175 4.724 1.00 21.93 O HETATM 2498 O HOH A 382 -1.314 13.660 9.573 1.00 37.45 O HETATM 2499 O HOH A 383 7.157 6.589 -21.158 1.00 35.79 O HETATM 2500 O HOH A 384 -1.592 -18.454 32.478 1.00 35.86 O HETATM 2501 O HOH A 385 3.737 6.234 -15.862 1.00 10.35 O HETATM 2502 O HOH A 386 22.372 12.773 -1.865 1.00 31.09 O HETATM 2503 O HOH A 387 22.136 -12.465 -8.227 1.00 31.29 O HETATM 2504 O HOH A 388 -7.147 -14.681 27.388 1.00 36.23 O HETATM 2505 O HOH A 389 -5.804 -11.100 -4.472 1.00 33.83 O HETATM 2506 O HOH A 390 13.915 -12.582 -1.041 1.00 11.94 O HETATM 2507 O HOH A 391 -17.605 -5.827 -0.726 1.00 31.84 O HETATM 2508 O HOH A 392 20.223 -15.461 3.560 1.00 34.22 O HETATM 2509 O HOH A 393 27.211 -8.848 4.531 1.00 33.15 O HETATM 2510 O HOH A 394 9.243 -1.161 18.568 1.00 9.07 O HETATM 2511 O HOH A 395 2.908 -16.902 34.649 1.00 33.56 O HETATM 2512 O HOH A 396 24.141 0.860 11.933 1.00 33.73 O HETATM 2513 O HOH A 397 16.181 -1.508 -10.983 1.00 10.63 O HETATM 2514 O HOH A 398 -11.869 -8.567 9.094 1.00 34.11 O HETATM 2515 O HOH A 399 22.396 -13.233 -0.292 1.00 35.36 O HETATM 2516 O HOH A 400 12.616 -8.274 0.736 1.00 9.19 O HETATM 2517 O HOH A 401 1.107 -3.489 5.545 1.00 9.32 O HETATM 2518 O HOH A 402 12.951 17.707 5.435 1.00 42.73 O HETATM 2519 O HOH A 403 28.259 7.932 7.837 1.00 33.14 O HETATM 2520 O HOH A 404 3.749 -4.589 5.948 1.00 8.62 O HETATM 2521 O HOH A 405 12.854 -3.089 22.510 1.00 10.04 O HETATM 2522 O HOH A 406 13.994 -16.045 31.193 1.00 37.29 O HETATM 2523 O HOH A 407 5.785 4.849 16.974 1.00 11.07 O HETATM 2524 O HOH A 408 -13.849 14.640 2.529 1.00 32.56 O HETATM 2525 O HOH A 409 -9.301 -14.149 22.742 1.00 32.77 O HETATM 2526 O HOH A 410 18.652 15.445 7.478 1.00 35.46 O HETATM 2527 O HOH A 411 -8.019 -4.057 -11.461 1.00 35.99 O HETATM 2528 O HOH A 412 -5.665 -12.836 13.237 1.00 10.60 O HETATM 2529 O HOH A 413 -3.194 15.534 -16.645 1.00 10.08 O HETATM 2530 O HOH A 414 8.865 6.023 7.183 1.00 9.63 O HETATM 2531 O HOH A 415 9.704 10.514 24.867 1.00 41.50 O HETATM 2532 O HOH A 416 9.525 8.039 -21.256 1.00 38.53 O HETATM 2533 O HOH A 417 12.761 -10.030 -1.358 1.00 9.48 O HETATM 2534 O HOH A 418 7.905 18.147 -1.275 1.00 20.23 O HETATM 2535 O HOH A 419 6.502 -15.819 -2.744 1.00 26.86 O HETATM 2536 O HOH A 420 -5.268 10.088 -23.901 1.00 37.48 O HETATM 2537 O HOH A 421 -10.640 -1.999 9.998 1.00 30.33 O HETATM 2538 O HOH A 422 -4.064 4.433 2.832 1.00 10.32 O HETATM 2539 O HOH A 423 -7.578 12.759 -2.307 1.00 9.75 O HETATM 2540 O HOH A 424 15.336 10.318 -5.165 1.00 10.69 O HETATM 2541 O HOH A 425 -14.542 17.961 -4.230 1.00 32.43 O HETATM 2542 O HOH A 426 4.161 -19.007 25.399 1.00 12.94 O HETATM 2543 O HOH A 427 19.726 14.214 5.010 1.00 35.26 O HETATM 2544 O HOH A 428 5.384 -11.058 -5.183 1.00 28.67 O HETATM 2545 O HOH A 429 8.184 -1.988 20.972 1.00 9.50 O HETATM 2546 O HOH A 430 4.272 9.583 22.551 1.00 29.77 O HETATM 2547 O HOH A 431 8.113 -3.508 -1.671 1.00 7.29 O HETATM 2548 O HOH A 432 4.219 -2.253 31.864 1.00 11.60 O HETATM 2549 O HOH A 433 12.126 11.976 9.088 1.00 11.89 O HETATM 2550 O HOH A 434 22.382 2.456 -8.807 1.00 11.79 O HETATM 2551 O HOH A 435 -6.213 -5.150 13.972 1.00 10.92 O HETATM 2552 O HOH A 436 -1.185 -1.013 4.606 1.00 13.02 O HETATM 2553 O HOH A 437 24.387 -9.501 4.050 1.00 15.46 O HETATM 2554 O HOH A 438 -1.295 19.730 -2.068 1.00 12.04 O HETATM 2555 O HOH A 439 -4.159 -13.198 10.922 1.00 9.57 O HETATM 2556 O HOH A 440 25.630 2.917 3.941 1.00 35.38 O HETATM 2557 O HOH A 441 3.465 1.048 15.765 1.00 10.22 O HETATM 2558 O HOH A 442 23.656 -8.330 1.591 1.00 16.36 O HETATM 2559 O HOH A 443 -3.013 -2.424 -5.541 1.00 12.16 O HETATM 2560 O HOH A 444 -4.486 -9.595 -2.538 1.00 13.95 O HETATM 2561 O HOH A 445 -3.232 -15.174 13.866 1.00 12.62 O HETATM 2562 O HOH A 446 25.742 -11.723 14.979 1.00 34.61 O HETATM 2563 O HOH A 447 7.412 -16.582 6.628 1.00 11.81 O HETATM 2564 O HOH A 448 5.314 -5.333 -8.371 1.00 20.94 O HETATM 2565 O HOH A 449 22.709 8.325 -1.316 1.00 28.85 O HETATM 2566 O HOH A 450 4.577 -12.599 32.617 1.00 25.47 O HETATM 2567 O HOH A 451 -0.235 -5.185 -13.346 1.00 31.10 O HETATM 2568 O HOH A 452 1.980 -9.711 -8.500 1.00 25.45 O HETATM 2569 O HOH A 453 -12.955 -2.841 -17.479 1.00 29.73 O HETATM 2570 O HOH A 454 -11.578 -6.894 -0.020 1.00 32.97 O HETATM 2571 O HOH A 455 9.466 18.614 3.320 1.00 38.06 O HETATM 2572 O HOH A 456 -11.398 -7.683 29.319 1.00 32.50 O HETATM 2573 O HOH A 457 -16.491 -8.081 19.836 1.00 38.11 O HETATM 2574 O HOH A 458 15.000 -7.720 29.418 1.00 35.45 O HETATM 2575 O HOH A 459 -6.485 17.986 -1.875 1.00 12.68 O HETATM 2576 O HOH A 460 23.342 -1.102 16.764 1.00 32.93 O HETATM 2577 O HOH A 461 9.173 -11.838 -2.531 1.00 15.47 O HETATM 2578 O HOH A 462 19.059 -14.597 15.415 1.00 14.59 O HETATM 2579 O HOH A 463 21.073 9.851 3.822 1.00 12.90 O HETATM 2580 O HOH A 464 -8.786 -8.460 29.763 1.00 36.75 O HETATM 2581 O HOH A 465 9.544 -0.058 -12.401 1.00 12.06 O HETATM 2582 O HOH A 466 23.286 10.400 -2.757 1.00 38.26 O HETATM 2583 O HOH A 467 -17.842 -9.553 13.999 1.00 32.29 O HETATM 2584 O HOH A 468 0.298 -17.183 11.974 1.00 12.31 O HETATM 2585 O HOH A 469 14.211 -1.332 24.172 1.00 12.71 O HETATM 2586 O HOH A 470 -1.758 -1.726 -1.334 1.00 12.40 O HETATM 2587 O HOH A 471 10.127 -9.383 -13.252 1.00 37.64 O HETATM 2588 O HOH A 472 2.693 -0.379 -16.739 1.00 31.88 O HETATM 2589 O HOH A 473 1.812 -20.244 24.683 1.00 14.36 O HETATM 2590 O HOH A 474 17.837 3.013 -13.501 1.00 34.98 O HETATM 2591 O HOH A 475 -8.232 12.399 -20.650 1.00 19.25 O HETATM 2592 O HOH A 476 11.221 -16.978 13.418 1.00 13.18 O HETATM 2593 O HOH A 477 10.919 -16.130 3.221 1.00 25.53 O HETATM 2594 O HOH A 478 -9.325 -0.503 -13.294 1.00 25.95 O HETATM 2595 O HOH A 479 10.732 -19.936 21.495 1.00 30.29 O HETATM 2596 O HOH A 480 9.590 -16.393 20.306 1.00 14.41 O HETATM 2597 O HOH A 481 -19.331 4.145 -13.173 1.00 12.74 O HETATM 2598 O HOH A 482 -13.355 -1.916 -2.754 1.00 13.61 O HETATM 2599 O HOH A 483 3.356 12.783 -17.403 1.00 16.84 O HETATM 2600 O HOH A 484 -5.716 -3.111 -4.927 1.00 14.15 O HETATM 2601 O HOH A 485 -13.536 -0.249 -20.352 1.00 14.44 O HETATM 2602 O HOH A 486 -8.153 9.984 0.350 1.00 14.60 O HETATM 2603 O HOH A 487 -8.196 -10.167 25.599 1.00 16.81 O HETATM 2604 O HOH A 488 -7.527 7.771 1.697 1.00 17.30 O HETATM 2605 O HOH A 489 -8.136 19.517 -9.376 1.00 12.54 O HETATM 2606 O HOH A 490 -9.196 14.851 -3.100 1.00 16.36 O HETATM 2607 O HOH A 491 -0.373 0.079 -16.486 1.00 14.30 O HETATM 2608 O HOH A 492 -1.198 -1.185 7.216 1.00 13.01 O HETATM 2609 O HOH A 493 11.055 -9.911 -6.098 1.00 13.94 O HETATM 2610 O HOH A 494 14.520 5.871 32.229 1.00 14.32 O HETATM 2611 O HOH A 495 -6.788 12.392 0.549 1.00 17.80 O HETATM 2612 O HOH A 496 -0.404 3.792 -18.811 1.00 14.64 O HETATM 2613 O HOH A 497 -6.833 -0.434 -14.552 1.00 19.12 O HETATM 2614 O HOH A 498 -18.139 2.485 -14.943 1.00 13.06 O HETATM 2615 O HOH A 499 -5.516 -16.313 20.486 1.00 16.48 O HETATM 2616 O HOH A 500 -2.068 -16.563 23.728 1.00 13.93 O HETATM 2617 O HOH A 501 16.253 3.911 15.285 1.00 16.37 O HETATM 2618 O HOH A 502 -12.350 -1.139 19.646 1.00 16.95 O HETATM 2619 O HOH A 503 13.933 -12.312 25.836 1.00 16.29 O HETATM 2620 O HOH A 504 17.474 -15.483 6.496 1.00 16.24 O HETATM 2621 O HOH A 505 -2.181 -2.119 -15.323 1.00 17.37 O HETATM 2622 O HOH A 506 -21.969 4.119 0.336 1.00 16.18 O HETATM 2623 O HOH A 507 2.297 4.164 9.045 1.00 15.68 O HETATM 2624 O HOH A 508 -18.609 -5.043 -4.936 1.00 19.31 O HETATM 2625 O HOH A 509 19.965 11.637 -2.614 1.00 16.75 O HETATM 2626 O HOH A 510 5.800 7.999 -19.103 1.00 15.84 O HETATM 2627 O HOH A 511 -21.329 -5.483 2.032 1.00 22.97 O HETATM 2628 O HOH A 512 13.806 0.684 13.182 1.00 16.23 O HETATM 2629 O HOH A 513 11.642 -4.995 -13.916 1.00 20.78 O HETATM 2630 O HOH A 514 15.105 3.356 -13.944 1.00 16.89 O HETATM 2631 O HOH A 515 -1.067 -16.957 14.210 1.00 15.23 O HETATM 2632 O HOH A 516 15.646 2.064 -9.477 1.00 19.10 O HETATM 2633 O HOH A 517 18.797 13.095 9.074 1.00 20.51 O HETATM 2634 O HOH A 518 14.255 1.238 -11.604 1.00 17.15 O HETATM 2635 O HOH A 519 -10.178 3.153 14.647 1.00 19.26 O HETATM 2636 O HOH A 520 21.795 -3.419 17.560 1.00 19.87 O HETATM 2637 O HOH A 521 20.493 8.535 -9.160 1.00 16.27 O HETATM 2638 O HOH A 522 -5.866 4.114 23.429 1.00 26.02 O HETATM 2639 O HOH A 523 11.552 -17.459 18.925 1.00 17.06 O HETATM 2640 O HOH A 524 20.943 -16.161 10.910 1.00 17.69 O HETATM 2641 O HOH A 525 19.423 -10.381 17.008 1.00 20.82 O HETATM 2642 O HOH A 526 16.201 13.806 -4.524 1.00 19.20 O HETATM 2643 O HOH A 527 1.050 8.926 18.794 1.00 22.00 O HETATM 2644 O HOH A 528 -11.063 13.250 -15.243 1.00 18.50 O HETATM 2645 O HOH A 529 -6.151 17.319 -6.367 1.00 16.23 O HETATM 2646 O HOH A 530 -10.121 14.679 -17.892 1.00 20.63 O HETATM 2647 O HOH A 531 5.132 18.502 -1.064 1.00 19.76 O HETATM 2648 O HOH A 532 10.340 18.749 -16.046 1.00 23.41 O HETATM 2649 O HOH A 533 16.649 -2.626 23.847 1.00 18.20 O HETATM 2650 O HOH A 534 20.130 9.580 6.980 1.00 16.74 O HETATM 2651 O HOH A 535 3.933 5.015 32.458 1.00 17.33 O HETATM 2652 O HOH A 536 3.159 7.004 26.009 1.00 20.89 O HETATM 2653 O HOH A 537 -13.131 -8.477 13.567 1.00 21.27 O HETATM 2654 O HOH A 538 -3.015 12.540 -22.377 1.00 21.10 O HETATM 2655 O HOH A 539 2.180 -21.157 22.043 1.00 20.11 O HETATM 2656 O HOH A 540 -19.998 -1.525 1.416 1.00 25.29 O HETATM 2657 O HOH A 541 -0.615 -18.864 24.460 1.00 19.46 O HETATM 2658 O HOH A 542 16.111 12.876 -12.754 1.00 26.53 O HETATM 2659 O HOH A 543 13.853 -2.712 28.120 1.00 19.88 O HETATM 2660 O HOH A 544 22.642 -6.552 -7.963 1.00 20.22 O HETATM 2661 O HOH A 545 7.147 -9.295 -5.498 1.00 27.94 O HETATM 2662 O HOH A 546 10.929 -6.192 31.284 1.00 18.90 O HETATM 2663 O HOH A 547 12.108 9.545 -17.286 1.00 22.16 O HETATM 2664 O HOH A 548 -8.789 6.257 17.712 1.00 20.20 O HETATM 2665 O HOH A 549 -6.297 -3.961 -8.603 1.00 21.21 O HETATM 2666 O HOH A 550 -4.484 -0.536 -16.249 1.00 20.20 O HETATM 2667 O HOH A 551 19.379 -7.296 -10.981 1.00 18.42 O HETATM 2668 O HOH A 552 -10.665 -10.294 0.262 1.00 20.72 O HETATM 2669 O HOH A 553 19.076 -9.842 20.884 1.00 25.62 O HETATM 2670 O HOH A 554 -11.099 0.766 -20.867 1.00 22.19 O HETATM 2671 O HOH A 555 15.000 -16.628 24.538 1.00 18.92 O HETATM 2672 O HOH A 556 10.939 -4.071 35.098 1.00 21.57 O HETATM 2673 O HOH A 557 3.538 -22.116 28.806 1.00 26.66 O HETATM 2674 O HOH A 558 19.000 10.718 -4.985 1.00 23.34 O HETATM 2675 O HOH A 559 13.532 -18.996 25.049 1.00 20.75 O HETATM 2676 O HOH A 560 1.716 6.119 28.189 1.00 22.17 O HETATM 2677 O HOH A 561 26.917 5.320 7.004 1.00 27.75 O HETATM 2678 O HOH A 562 27.194 -4.091 5.055 1.00 24.21 O HETATM 2679 O HOH A 563 -0.703 7.584 -21.023 1.00 23.67 O HETATM 2680 O HOH A 564 -16.529 -3.467 -10.720 1.00 31.91 O HETATM 2681 O HOH A 565 24.578 -12.274 4.406 1.00 21.99 O HETATM 2682 O HOH A 566 7.454 6.575 -17.271 1.00 19.91 O HETATM 2683 O HOH A 567 5.114 7.418 32.262 1.00 21.56 O HETATM 2684 O HOH A 568 -6.010 -3.488 11.687 1.00 26.07 O HETATM 2685 O HOH A 569 24.954 -5.115 10.937 1.00 18.43 O HETATM 2686 O HOH A 570 -4.260 1.497 28.074 1.00 19.05 O HETATM 2687 O HOH A 571 18.333 -7.266 -14.712 1.00 25.49 O HETATM 2688 O HOH A 572 16.425 6.466 16.233 1.00 20.32 O HETATM 2689 O HOH A 573 8.642 7.613 24.298 1.00 20.91 O HETATM 2690 O HOH A 574 14.070 16.598 -9.654 1.00 22.32 O HETATM 2691 O HOH A 575 -1.922 2.368 29.114 1.00 25.55 O HETATM 2692 O HOH A 576 18.346 -9.683 26.131 1.00 28.77 O HETATM 2693 O HOH A 577 7.524 -6.719 -12.799 1.00 26.90 O HETATM 2694 O HOH A 578 1.936 8.408 24.080 1.00 21.12 O HETATM 2695 O HOH A 579 -7.529 16.938 -4.173 1.00 21.76 O HETATM 2696 O HOH A 580 -3.818 5.996 22.209 1.00 23.31 O HETATM 2697 O HOH A 581 -5.300 7.502 -19.580 1.00 28.02 O HETATM 2698 O HOH A 582 8.951 -15.104 1.086 1.00 22.69 O HETATM 2699 O HOH A 583 7.225 12.808 13.517 1.00 21.53 O HETATM 2700 O HOH A 584 -7.478 3.139 21.519 1.00 23.78 O HETATM 2701 O HOH A 585 17.630 13.557 -2.000 1.00 16.70 O HETATM 2702 O HOH A 586 2.965 -9.280 -0.468 1.00 14.03 O HETATM 2703 O HOH A 587 -14.018 -4.528 -3.191 1.00 18.87 O HETATM 2704 O HOH A 588 23.173 10.025 2.079 1.00 18.47 O HETATM 2705 O HOH A 589 10.589 -19.238 17.029 1.00 18.69 O HETATM 2706 O HOH A 590 21.011 -8.500 -9.258 1.00 19.86 O HETATM 2707 O HOH A 591 15.355 5.099 26.294 1.00 19.82 O HETATM 2708 O HOH A 592 -1.120 16.592 -18.136 1.00 19.52 O HETATM 2709 O HOH A 593 1.245 19.908 -0.807 1.00 19.72 O HETATM 2710 O HOH A 594 3.552 20.492 -1.987 1.00 20.53 O HETATM 2711 O HOH A 595 -21.816 4.792 -14.235 1.00 19.15 O HETATM 2712 O HOH A 596 -4.445 -17.606 22.676 1.00 22.68 O HETATM 2713 O HOH A 597 -1.096 -12.892 30.559 1.00 20.46 O HETATM 2714 O HOH A 598 12.210 -19.147 14.730 1.00 26.54 O HETATM 2715 O HOH A 599 -9.896 17.657 -8.616 1.00 20.41 O HETATM 2716 O HOH A 600 20.988 10.977 9.055 1.00 24.32 O HETATM 2717 O HOH A 601 20.868 -12.300 15.670 1.00 21.19 O HETATM 2718 O HOH A 602 -12.285 -2.010 -11.546 1.00 23.16 O HETATM 2719 O HOH A 603 20.254 8.812 -6.282 1.00 21.22 O HETATM 2720 O HOH A 604 3.744 2.744 -18.357 1.00 25.66 O HETATM 2721 O HOH A 605 -13.242 16.701 -9.031 1.00 24.35 O HETATM 2722 O HOH A 606 -4.031 -13.326 0.850 1.00 22.57 O HETATM 2723 O HOH A 607 13.222 -17.945 6.737 1.00 25.04 O HETATM 2724 O HOH A 608 15.114 10.037 14.430 1.00 21.92 O HETATM 2725 O HOH A 609 17.424 8.466 14.754 1.00 24.07 O HETATM 2726 O HOH A 610 23.171 4.970 -8.629 1.00 22.49 O HETATM 2727 O HOH A 611 18.154 12.834 -6.143 1.00 23.58 O HETATM 2728 O HOH A 612 -16.797 -1.972 -1.336 1.00 23.43 O HETATM 2729 O HOH A 613 15.865 -0.543 -13.561 1.00 25.83 O HETATM 2730 O HOH A 614 -2.258 1.447 -18.120 1.00 21.81 O HETATM 2731 O HOH A 615 -0.609 19.235 3.972 1.00 23.64 O HETATM 2732 O HOH A 616 -14.102 -3.118 -9.718 1.00 25.80 O HETATM 2733 O HOH A 617 18.744 -0.624 -13.587 1.00 25.86 O HETATM 2734 O HOH A 618 4.450 -2.358 36.154 1.00 22.44 O HETATM 2735 O HOH A 619 9.014 -23.938 25.838 1.00 26.66 O HETATM 2736 O HOH A 620 11.893 -14.413 -0.833 1.00 25.36 O HETATM 2737 O HOH A 621 -0.264 11.846 -19.020 1.00 25.14 O HETATM 2738 O HOH A 622 10.080 12.447 -20.241 1.00 26.55 O HETATM 2739 O HOH A 623 10.108 -0.121 -15.117 1.00 25.55 O HETATM 2740 O HOH A 624 -7.624 16.948 0.377 1.00 28.05 O HETATM 2741 O HOH A 625 -16.759 -4.456 -2.982 1.00 23.72 O HETATM 2742 O HOH A 626 -12.738 3.509 18.345 1.00 23.35 O HETATM 2743 O HOH A 627 21.970 -6.980 17.792 1.00 24.69 O HETATM 2744 O HOH A 628 11.655 2.117 -15.052 1.00 26.99 O HETATM 2745 O HOH A 629 1.288 -22.517 26.166 1.00 26.40 O HETATM 2746 O HOH A 630 19.290 -16.184 13.154 1.00 25.33 O HETATM 2747 O HOH A 631 10.807 9.982 31.026 1.00 23.03 O HETATM 2748 O HOH A 632 -12.134 -13.187 19.439 1.00 27.94 O HETATM 2749 O HOH A 633 -10.328 3.631 -19.720 1.00 21.67 O HETATM 2750 O HOH A 634 8.987 -22.622 28.328 1.00 25.25 O HETATM 2751 O HOH A 635 2.721 -6.722 -11.664 1.00 26.63 O HETATM 2752 O HOH A 636 16.399 2.123 12.792 1.00 27.69 O HETATM 2753 O HOH A 637 7.133 -10.113 35.196 1.00 28.29 O HETATM 2754 O HOH A 638 25.422 5.925 4.455 1.00 25.59 O HETATM 2755 O HOH A 639 1.525 14.970 -16.032 1.00 27.28 O HETATM 2756 O HOH A 640 22.005 -16.292 7.855 1.00 27.20 O HETATM 2757 O HOH A 641 21.816 12.353 5.027 1.00 27.85 O HETATM 2758 O HOH A 642 12.051 -10.614 29.302 1.00 22.62 O HETATM 2759 O HOH A 643 -9.841 -8.063 7.314 1.00 31.03 O HETATM 2760 O HOH A 644 -16.811 7.008 -10.101 1.00 23.10 O HETATM 2761 O HOH A 645 -11.099 -7.502 -5.222 1.00 27.69 O HETATM 2762 O HOH A 646 5.432 8.925 18.040 1.00 24.11 O HETATM 2763 O HOH A 647 -11.272 -0.416 28.323 1.00 32.60 O HETATM 2764 O HOH A 648 2.580 18.979 -10.412 1.00 25.46 O HETATM 2765 O HOH A 649 -23.867 2.500 -11.565 1.00 25.69 O HETATM 2766 O HOH A 650 4.104 -8.489 -7.346 1.00 26.45 O HETATM 2767 O HOH A 651 -20.066 8.222 2.315 1.00 25.00 O HETATM 2768 O HOH A 652 -6.529 -5.232 31.026 1.00 28.32 O HETATM 2769 O HOH A 653 17.042 6.325 19.016 1.00 25.09 O HETATM 2770 O HOH A 654 11.608 -2.542 -15.436 1.00 30.05 O HETATM 2771 O HOH A 655 3.050 14.493 -21.599 1.00 25.75 O HETATM 2772 O HOH A 656 9.930 21.067 -13.543 1.00 29.32 O HETATM 2773 O HOH A 657 15.188 6.200 21.069 1.00 28.68 O HETATM 2774 O HOH A 658 12.947 7.780 27.480 1.00 21.42 O HETATM 2775 O HOH A 659 -19.407 -3.470 -8.176 1.00 23.27 O HETATM 2776 O HOH A 660 20.469 5.503 -10.573 1.00 27.14 O HETATM 2777 O HOH A 661 4.999 11.332 14.429 1.00 29.03 O HETATM 2778 O HOH A 662 -17.704 4.954 0.536 1.00 31.45 O HETATM 2779 O HOH A 663 3.233 20.827 -7.040 1.00 26.03 O HETATM 2780 O HOH A 664 -6.028 1.058 30.129 1.00 32.09 O HETATM 2781 O HOH A 665 -7.965 -12.481 29.145 1.00 31.35 O HETATM 2782 O HOH A 666 -9.535 -11.273 4.211 1.00 33.39 O HETATM 2783 O HOH A 667 23.722 -9.445 -0.816 1.00 27.21 O HETATM 2784 O HOH A 668 18.340 3.789 19.162 1.00 27.04 O HETATM 2785 O HOH A 669 -4.931 -16.408 27.280 1.00 25.09 O HETATM 2786 O HOH A 670 16.085 -17.371 8.052 1.00 23.37 O HETATM 2787 O HOH A 671 6.343 18.662 -4.031 1.00 25.73 O HETATM 2788 O HOH A 672 -12.596 -11.407 23.727 1.00 31.62 O HETATM 2789 O HOH A 673 -0.968 4.600 28.235 1.00 29.58 O HETATM 2790 O HOH A 674 -5.371 4.732 -19.394 1.00 27.69 O HETATM 2791 O HOH A 675 22.618 9.148 -13.321 1.00 34.74 O HETATM 2792 O HOH A 676 -19.442 14.451 -2.540 1.00 30.94 O HETATM 2793 O HOH A 677 17.133 9.544 -16.036 1.00 28.10 O HETATM 2794 O HOH A 678 2.534 -2.548 34.082 1.00 24.71 O HETATM 2795 O HOH A 679 25.723 -13.980 13.124 1.00 31.98 O HETATM 2796 O HOH A 680 12.265 -5.754 33.461 1.00 28.78 O HETATM 2797 O HOH A 681 19.415 -13.495 19.591 1.00 28.30 O HETATM 2798 O HOH A 682 6.456 16.457 -17.832 1.00 30.16 O HETATM 2799 O HOH A 683 -21.968 6.647 -4.516 1.00 25.06 O HETATM 2800 O HOH A 684 19.614 -3.008 21.620 1.00 25.96 O HETATM 2801 O HOH A 685 21.876 -12.437 -2.958 1.00 28.23 O HETATM 2802 O HOH A 686 9.188 -6.975 36.318 1.00 28.58 O HETATM 2803 O HOH A 687 9.760 -18.274 33.844 1.00 36.77 O HETATM 2804 O HOH A 688 -20.181 6.195 0.109 1.00 23.60 O HETATM 2805 O HOH A 689 16.607 -17.044 22.271 1.00 30.14 O HETATM 2806 O HOH A 690 14.277 9.828 21.322 1.00 27.32 O HETATM 2807 O HOH A 691 -13.929 1.704 12.602 1.00 27.58 O HETATM 2808 O HOH A 692 -10.790 2.889 -22.530 1.00 29.04 O HETATM 2809 O HOH A 693 16.481 -16.149 26.706 1.00 28.71 O HETATM 2810 O HOH A 694 -15.201 -5.989 27.515 1.00 28.78 O HETATM 2811 O HOH A 695 6.336 -23.518 29.221 1.00 30.01 O HETATM 2812 O HOH A 696 -1.937 -14.100 -0.987 1.00 23.91 O HETATM 2813 O HOH A 697 -13.086 -5.606 -5.473 1.00 24.33 O HETATM 2814 O HOH A 698 18.039 1.876 -10.471 1.00 21.73 O HETATM 2815 O HOH A 699 2.145 17.082 -14.688 1.00 21.37 O HETATM 2816 O HOH A 700 11.695 20.851 -7.392 1.00 24.02 O HETATM 2817 O HOH A 701 15.473 -3.077 -14.463 1.00 26.38 O HETATM 2818 O HOH A 702 16.904 9.907 21.290 1.00 30.38 O HETATM 2819 O HOH A 703 9.238 10.720 32.900 1.00 32.46 O HETATM 2820 O HOH A 704 8.258 20.382 -16.992 1.00 27.23 O HETATM 2821 O HOH A 705 5.945 18.912 -18.105 1.00 26.11 O HETATM 2822 O HOH A 706 -20.493 -1.011 4.250 1.00 26.87 O HETATM 2823 O HOH A 707 -5.343 -14.509 8.944 1.00 29.75 O HETATM 2824 O HOH A 708 22.496 -14.184 3.187 1.00 32.59 O HETATM 2825 O HOH A 709 2.381 5.854 11.296 1.00 27.10 O HETATM 2826 O HOH A 710 -3.086 -14.568 31.550 1.00 29.55 O HETATM 2827 O HOH A 711 0.668 7.747 11.823 1.00 29.70 O HETATM 2828 O HOH A 712 27.878 -4.963 14.331 1.00 29.97 O HETATM 2829 O HOH A 713 -2.295 11.719 -24.760 1.00 29.11 O HETATM 2830 O HOH A 714 -1.119 -17.048 20.693 1.00 27.59 O HETATM 2831 O HOH A 715 27.032 -3.512 11.249 1.00 31.81 O HETATM 2832 O HOH A 716 -1.804 5.153 -20.572 1.00 30.08 O HETATM 2833 O HOH A 717 4.896 19.515 -9.221 1.00 25.18 O HETATM 2834 O HOH A 718 -21.355 7.517 -14.939 1.00 27.18 O HETATM 2835 O HOH A 719 23.402 -16.789 12.395 1.00 33.65 O HETATM 2836 O HOH A 720 4.353 -14.423 -4.427 1.00 26.20 O HETATM 2837 O HOH A 721 18.287 -17.211 10.034 1.00 33.51 O HETATM 2838 O HOH A 722 17.334 -16.595 3.922 1.00 30.18 O HETATM 2839 O HOH A 723 24.218 -15.053 8.591 1.00 28.69 O HETATM 2840 O HOH A 724 4.207 21.211 -4.472 1.00 33.81 O HETATM 2841 O HOH A 725 13.712 12.577 -17.195 1.00 28.28 O HETATM 2842 O HOH A 726 -13.090 16.380 -2.587 1.00 29.20 O HETATM 2843 O HOH A 727 9.388 8.632 -17.175 1.00 29.00 O HETATM 2844 O HOH A 728 16.710 -9.473 -14.287 1.00 35.31 O HETATM 2845 O HOH A 729 12.357 -20.176 29.648 1.00 27.66 O HETATM 2846 O HOH A 730 -13.181 -1.249 9.742 1.00 34.45 O HETATM 2847 O HOH A 731 18.777 -15.783 21.108 1.00 30.75 O HETATM 2848 O HOH A 732 -9.639 -14.038 19.593 1.00 30.11 O HETATM 2849 O HOH A 733 15.760 -13.633 27.567 1.00 32.18 O HETATM 2850 O HOH A 734 1.671 -9.187 -11.101 1.00 29.11 O HETATM 2851 O HOH A 735 -9.947 15.858 -0.555 1.00 31.77 O HETATM 2852 O HOH A 736 -13.317 -2.125 0.139 1.00 30.55 O HETATM 2853 O HOH A 737 -9.535 -5.995 -7.401 1.00 36.93 O HETATM 2854 O HOH A 738 -9.855 -11.981 24.582 1.00 32.73 O HETATM 2855 O HOH A 739 -14.329 13.681 -14.707 1.00 30.38 O HETATM 2856 O HOH A 740 -10.007 3.097 22.188 1.00 33.58 O HETATM 2857 O HOH A 741 -3.972 -18.367 16.456 1.00 27.52 O HETATM 2858 O HOH A 742 -11.277 2.062 24.228 1.00 37.29 O HETATM 2859 O HOH A 743 -7.616 -9.567 -5.946 1.00 30.78 O HETATM 2860 O HOH A 744 11.585 12.460 15.749 1.00 29.27 O HETATM 2861 O HOH A 745 14.210 14.297 2.186 1.00 24.20 O HETATM 2862 O HOH A 746 -8.434 1.423 0.642 1.00 32.96 O HETATM 2863 O HOH A 747 -11.851 -3.011 -9.029 1.00 24.65 O HETATM 2864 O HOH A 748 6.151 15.707 2.693 1.00 21.42 O HETATM 2865 O HOH A 749 16.504 13.539 1.806 1.00 27.67 O HETATM 2866 O HOH A 750 -2.476 8.956 -19.962 1.00 28.46 O CONECT 1857 2111 CONECT 2111 1857 CONECT 2402 2406 2413 2416 CONECT 2403 2416 2417 CONECT 2404 2406 CONECT 2405 2415 2416 CONECT 2406 2402 2404 2408 CONECT 2407 2418 2419 CONECT 2408 2406 2409 CONECT 2409 2408 2412 CONECT 2410 2423 2424 CONECT 2411 2417 CONECT 2412 2409 CONECT 2413 2402 2414 2415 CONECT 2414 2413 CONECT 2415 2405 2413 CONECT 2416 2402 2403 2405 CONECT 2417 2403 2411 2418 CONECT 2418 2407 2417 CONECT 2419 2407 2420 CONECT 2420 2419 2421 CONECT 2421 2420 2422 2424 CONECT 2422 2421 2423 2425 CONECT 2423 2410 2422 2428 CONECT 2424 2410 2421 CONECT 2425 2422 2426 CONECT 2426 2425 2427 CONECT 2427 2426 2428 CONECT 2428 2423 2427 CONECT 2429 2430 2431 2432 CONECT 2430 2429 CONECT 2431 2429 CONECT 2432 2429 CONECT 2433 2434 2435 2436 CONECT 2434 2433 CONECT 2435 2433 CONECT 2436 2433 CONECT 2437 2438 2439 CONECT 2438 2437 CONECT 2439 2437 2440 2441 CONECT 2440 2439 CONECT 2441 2439 2442 CONECT 2442 2441 CONECT 2443 2444 2445 2446 CONECT 2444 2443 CONECT 2445 2443 CONECT 2446 2443 END